ID,Type,Value_order,Atom_ID_1,Atom_ID_2,Aromatic_flag,Stereo_config,Ordinal,Details,Sf_ID,Entry_ID,Comp_ID
1,,SING,CD1,CG,no,N,1,,22,10001,NLW
2,,SING,CG,CD2,no,N,2,,22,10001,NLW
3,,SING,CG,CB,no,N,3,,22,10001,NLW
4,,SING,CB,CA,no,N,4,,22,10001,NLW
5,,SING,N,CA,no,N,5,,22,10001,NLW
6,,SING,CA,C,no,N,6,,22,10001,NLW
7,,SING,C,NH2,no,N,7,,22,10001,NLW
8,,DOUB,C,O,no,N,8,,22,10001,NLW
9,,SING,CD2,H1,no,N,9,,22,10001,NLW
10,,SING,CD2,H2,no,N,10,,22,10001,NLW
11,,SING,CD2,H3,no,N,11,,22,10001,NLW
12,,SING,CG,H4,no,N,12,,22,10001,NLW
13,,SING,CD1,H5,no,N,13,,22,10001,NLW
14,,SING,CD1,H6,no,N,14,,22,10001,NLW
15,,SING,CD1,H7,no,N,15,,22,10001,NLW
16,,SING,CB,H8,no,N,16,,22,10001,NLW
17,,SING,CB,H9,no,N,17,,22,10001,NLW
18,,SING,CA,H10,no,N,18,,22,10001,NLW
19,,SING,N,H11,no,N,19,,22,10001,NLW
20,,SING,N,H12,no,N,20,,22,10001,NLW
21,,SING,NH2,H14,no,N,21,,22,10001,NLW
22,,SING,NH2,H15,no,N,22,,22,10001,NLW
1,,DOUB,PB,O1B,no,N,1,,327,10017,ADP
2,,SING,PB,O2B,no,N,2,,327,10017,ADP
3,,SING,PB,O3B,no,N,3,,327,10017,ADP
4,,SING,PB,O3A,no,N,4,,327,10017,ADP
5,,SING,O2B,HOB2,no,N,5,,327,10017,ADP
6,,SING,O3B,HOB3,no,N,6,,327,10017,ADP
7,,DOUB,PA,O1A,no,N,7,,327,10017,ADP
8,,SING,PA,O2A,no,N,8,,327,10017,ADP
9,,SING,PA,O3A,no,N,9,,327,10017,ADP
10,,SING,PA,O5',no,N,10,,327,10017,ADP
11,,SING,O2A,HOA2,no,N,11,,327,10017,ADP
12,,SING,O5',C5',no,N,12,,327,10017,ADP
13,,SING,C5',C4',no,N,13,,327,10017,ADP
14,,SING,C5',H5'1,no,N,14,,327,10017,ADP
15,,SING,C5',H5'2,no,N,15,,327,10017,ADP
16,,SING,C4',O4',no,N,16,,327,10017,ADP
17,,SING,C4',C3',no,N,17,,327,10017,ADP
18,,SING,C4',H4',no,N,18,,327,10017,ADP
19,,SING,O4',C1',no,N,19,,327,10017,ADP
20,,SING,C3',O3',no,N,20,,327,10017,ADP
21,,SING,C3',C2',no,N,21,,327,10017,ADP
22,,SING,C3',H3',no,N,22,,327,10017,ADP
23,,SING,O3',HO3',no,N,23,,327,10017,ADP
24,,SING,C2',O2',no,N,24,,327,10017,ADP
25,,SING,C2',C1',no,N,25,,327,10017,ADP
26,,SING,C2',H2',no,N,26,,327,10017,ADP
27,,SING,O2',HO2',no,N,27,,327,10017,ADP
28,,SING,C1',N9,no,N,28,,327,10017,ADP
29,,SING,C1',H1',no,N,29,,327,10017,ADP
30,,SING,N9,C8,yes,N,30,,327,10017,ADP
31,,SING,N9,C4,yes,N,31,,327,10017,ADP
32,,DOUB,C8,N7,yes,N,32,,327,10017,ADP
33,,SING,C8,H8,no,N,33,,327,10017,ADP
34,,SING,N7,C5,yes,N,34,,327,10017,ADP
35,,SING,C5,C6,yes,N,35,,327,10017,ADP
36,,DOUB,C5,C4,yes,N,36,,327,10017,ADP
37,,SING,C6,N6,no,N,37,,327,10017,ADP
38,,DOUB,C6,N1,yes,N,38,,327,10017,ADP
39,,SING,N6,HN61,no,N,39,,327,10017,ADP
40,,SING,N6,HN62,no,N,40,,327,10017,ADP
41,,SING,N1,C2,yes,N,41,,327,10017,ADP
42,,DOUB,C2,N3,yes,N,42,,327,10017,ADP
43,,SING,C2,H2,no,N,43,,327,10017,ADP
44,,SING,N3,C4,yes,N,44,,327,10017,ADP
1,,DOUB,PB,O1B,no,N,1,,1040,10051,GDP
2,,SING,PB,O2B,no,N,2,,1040,10051,GDP
3,,SING,PB,O3B,no,N,3,,1040,10051,GDP
4,,SING,PB,O3A,no,N,4,,1040,10051,GDP
5,,SING,O2B,HOB2,no,N,5,,1040,10051,GDP
6,,SING,O3B,HOB3,no,N,6,,1040,10051,GDP
7,,SING,O3A,PA,no,N,7,,1040,10051,GDP
8,,DOUB,PA,O1A,no,N,8,,1040,10051,GDP
9,,SING,PA,O2A,no,N,9,,1040,10051,GDP
10,,SING,PA,O5',no,N,10,,1040,10051,GDP
11,,SING,O2A,HOA2,no,N,11,,1040,10051,GDP
12,,SING,O5',C5',no,N,12,,1040,10051,GDP
13,,SING,C5',C4',no,N,13,,1040,10051,GDP
14,,SING,C5',H5',no,N,14,,1040,10051,GDP
15,,SING,C5',H5'',no,N,15,,1040,10051,GDP
16,,SING,C4',O4',no,N,16,,1040,10051,GDP
17,,SING,C4',C3',no,N,17,,1040,10051,GDP
18,,SING,C4',H4',no,N,18,,1040,10051,GDP
19,,SING,O4',C1',no,N,19,,1040,10051,GDP
20,,SING,C3',O3',no,N,20,,1040,10051,GDP
21,,SING,C3',C2',no,N,21,,1040,10051,GDP
22,,SING,C3',H3',no,N,22,,1040,10051,GDP
23,,SING,O3',HO3',no,N,23,,1040,10051,GDP
24,,SING,C2',O2',no,N,24,,1040,10051,GDP
25,,SING,C2',C1',no,N,25,,1040,10051,GDP
26,,SING,C2',H2',no,N,26,,1040,10051,GDP
27,,SING,O2',HO2',no,N,27,,1040,10051,GDP
28,,SING,C1',N9,no,N,28,,1040,10051,GDP
29,,SING,C1',H1',no,N,29,,1040,10051,GDP
30,,SING,N9,C8,yes,N,30,,1040,10051,GDP
31,,SING,N9,C4,yes,N,31,,1040,10051,GDP
32,,DOUB,C8,N7,yes,N,32,,1040,10051,GDP
33,,SING,C8,H8,no,N,33,,1040,10051,GDP
34,,SING,N7,C5,yes,N,34,,1040,10051,GDP
35,,SING,C5,C6,no,N,35,,1040,10051,GDP
36,,DOUB,C5,C4,yes,N,36,,1040,10051,GDP
37,,DOUB,C6,O6,no,N,37,,1040,10051,GDP
38,,SING,C6,N1,no,N,38,,1040,10051,GDP
39,,SING,N1,C2,no,N,39,,1040,10051,GDP
40,,SING,N1,HN1,no,N,40,,1040,10051,GDP
41,,SING,C2,N2,no,N,41,,1040,10051,GDP
42,,DOUB,C2,N3,no,N,42,,1040,10051,GDP
43,,SING,N2,HN21,no,N,43,,1040,10051,GDP
44,,SING,N2,HN22,no,N,44,,1040,10051,GDP
45,,SING,N3,C4,no,N,45,,1040,10051,GDP
1,,SING,FE,NA,no,N,1,,2715,10132,HEC
2,,SING,FE,NB,no,N,2,,2715,10132,HEC
3,,SING,FE,NC,no,N,3,,2715,10132,HEC
4,,SING,FE,ND,no,N,4,,2715,10132,HEC
5,,DOUB,CHA,C1A,no,N,5,,2715,10132,HEC
6,,SING,CHA,C4D,no,N,6,,2715,10132,HEC
7,,SING,CHA,HHA,no,N,7,,2715,10132,HEC
8,,DOUB,CHB,C4A,no,N,8,,2715,10132,HEC
9,,SING,CHB,C1B,no,N,9,,2715,10132,HEC
10,,SING,CHB,HHB,no,N,10,,2715,10132,HEC
11,,DOUB,CHC,C4B,no,N,11,,2715,10132,HEC
12,,SING,CHC,C1C,no,N,12,,2715,10132,HEC
13,,SING,CHC,HHC,no,N,13,,2715,10132,HEC
14,,DOUB,CHD,C4C,no,N,14,,2715,10132,HEC
15,,SING,CHD,C1D,no,N,15,,2715,10132,HEC
16,,SING,CHD,HHD,no,N,16,,2715,10132,HEC
17,,SING,NA,C1A,yes,N,17,,2715,10132,HEC
18,,SING,NA,C4A,yes,N,18,,2715,10132,HEC
19,,SING,C1A,C2A,yes,N,19,,2715,10132,HEC
20,,DOUB,C2A,C3A,yes,N,20,,2715,10132,HEC
21,,SING,C2A,CAA,no,N,21,,2715,10132,HEC
22,,SING,C3A,C4A,yes,N,22,,2715,10132,HEC
23,,SING,C3A,CMA,no,N,23,,2715,10132,HEC
24,,SING,CMA,HMA1,no,N,24,,2715,10132,HEC
25,,SING,CMA,HMA2,no,N,25,,2715,10132,HEC
26,,SING,CMA,HMA3,no,N,26,,2715,10132,HEC
27,,SING,CAA,CBA,no,N,27,,2715,10132,HEC
28,,SING,CAA,HAA1,no,N,28,,2715,10132,HEC
29,,SING,CAA,HAA2,no,N,29,,2715,10132,HEC
30,,SING,CBA,CGA,no,N,30,,2715,10132,HEC
31,,SING,CBA,HBA1,no,N,31,,2715,10132,HEC
32,,SING,CBA,HBA2,no,N,32,,2715,10132,HEC
33,,DOUB,CGA,O1A,no,N,33,,2715,10132,HEC
34,,SING,CGA,O2A,no,N,34,,2715,10132,HEC
35,,SING,O2A,H2A,no,N,35,,2715,10132,HEC
36,,SING,NB,C1B,yes,N,36,,2715,10132,HEC
37,,SING,NB,C4B,yes,N,37,,2715,10132,HEC
38,,DOUB,C1B,C2B,yes,N,38,,2715,10132,HEC
39,,SING,C2B,C3B,yes,N,39,,2715,10132,HEC
40,,SING,C2B,CMB,no,N,40,,2715,10132,HEC
41,,SING,C3B,C4B,yes,N,41,,2715,10132,HEC
42,,DOUB,C3B,CAB,no,E,42,,2715,10132,HEC
43,,SING,CMB,HMB1,no,N,43,,2715,10132,HEC
44,,SING,CMB,HMB2,no,N,44,,2715,10132,HEC
45,,SING,CMB,HMB3,no,N,45,,2715,10132,HEC
46,,SING,CAB,CBB,no,N,46,,2715,10132,HEC
47,,SING,CAB,HAB,no,N,47,,2715,10132,HEC
48,,SING,CBB,HBB1,no,N,48,,2715,10132,HEC
49,,SING,CBB,HBB2,no,N,49,,2715,10132,HEC
50,,SING,CBB,HBB3,no,N,50,,2715,10132,HEC
51,,SING,NC,C1C,yes,N,51,,2715,10132,HEC
52,,SING,NC,C4C,yes,N,52,,2715,10132,HEC
53,,DOUB,C1C,C2C,yes,N,53,,2715,10132,HEC
54,,SING,C2C,C3C,yes,N,54,,2715,10132,HEC
55,,SING,C2C,CMC,no,N,55,,2715,10132,HEC
56,,SING,C3C,C4C,yes,N,56,,2715,10132,HEC
57,,DOUB,C3C,CAC,no,E,57,,2715,10132,HEC
58,,SING,CMC,HMC1,no,N,58,,2715,10132,HEC
59,,SING,CMC,HMC2,no,N,59,,2715,10132,HEC
60,,SING,CMC,HMC3,no,N,60,,2715,10132,HEC
61,,SING,CAC,CBC,no,N,61,,2715,10132,HEC
62,,SING,CAC,HAC,no,N,62,,2715,10132,HEC
63,,SING,CBC,HBC1,no,N,63,,2715,10132,HEC
64,,SING,CBC,HBC2,no,N,64,,2715,10132,HEC
65,,SING,CBC,HBC3,no,N,65,,2715,10132,HEC
66,,SING,ND,C1D,yes,N,66,,2715,10132,HEC
67,,SING,ND,C4D,yes,N,67,,2715,10132,HEC
68,,DOUB,C1D,C2D,yes,N,68,,2715,10132,HEC
69,,SING,C2D,C3D,yes,N,69,,2715,10132,HEC
70,,SING,C2D,CMD,no,N,70,,2715,10132,HEC
71,,DOUB,C3D,C4D,yes,N,71,,2715,10132,HEC
72,,SING,C3D,CAD,no,N,72,,2715,10132,HEC
73,,SING,CMD,HMD1,no,N,73,,2715,10132,HEC
74,,SING,CMD,HMD2,no,N,74,,2715,10132,HEC
75,,SING,CMD,HMD3,no,N,75,,2715,10132,HEC
76,,SING,CAD,CBD,no,N,76,,2715,10132,HEC
77,,SING,CAD,HAD1,no,N,77,,2715,10132,HEC
78,,SING,CAD,HAD2,no,N,78,,2715,10132,HEC
79,,SING,CBD,CGD,no,N,79,,2715,10132,HEC
80,,SING,CBD,HBD1,no,N,80,,2715,10132,HEC
81,,SING,CBD,HBD2,no,N,81,,2715,10132,HEC
82,,DOUB,CGD,O1D,no,N,82,,2715,10132,HEC
83,,SING,CGD,O2D,no,N,83,,2715,10132,HEC
84,,SING,O2D,H2D,no,N,84,,2715,10132,HEC
1,,SING,FE,NA,no,N,1,,2730,10133,HEC
2,,SING,FE,NB,no,N,2,,2730,10133,HEC
3,,SING,FE,NC,no,N,3,,2730,10133,HEC
4,,SING,FE,ND,no,N,4,,2730,10133,HEC
5,,DOUB,CHA,C1A,no,N,5,,2730,10133,HEC
6,,SING,CHA,C4D,no,N,6,,2730,10133,HEC
7,,SING,CHA,HHA,no,N,7,,2730,10133,HEC
8,,DOUB,CHB,C4A,no,N,8,,2730,10133,HEC
9,,SING,CHB,C1B,no,N,9,,2730,10133,HEC
10,,SING,CHB,HHB,no,N,10,,2730,10133,HEC
11,,DOUB,CHC,C4B,no,N,11,,2730,10133,HEC
12,,SING,CHC,C1C,no,N,12,,2730,10133,HEC
13,,SING,CHC,HHC,no,N,13,,2730,10133,HEC
14,,DOUB,CHD,C4C,no,N,14,,2730,10133,HEC
15,,SING,CHD,C1D,no,N,15,,2730,10133,HEC
16,,SING,CHD,HHD,no,N,16,,2730,10133,HEC
17,,SING,NA,C1A,yes,N,17,,2730,10133,HEC
18,,SING,NA,C4A,yes,N,18,,2730,10133,HEC
19,,SING,C1A,C2A,yes,N,19,,2730,10133,HEC
20,,DOUB,C2A,C3A,yes,N,20,,2730,10133,HEC
21,,SING,C2A,CAA,no,N,21,,2730,10133,HEC
22,,SING,C3A,C4A,yes,N,22,,2730,10133,HEC
23,,SING,C3A,CMA,no,N,23,,2730,10133,HEC
24,,SING,CMA,HMA1,no,N,24,,2730,10133,HEC
25,,SING,CMA,HMA2,no,N,25,,2730,10133,HEC
26,,SING,CMA,HMA3,no,N,26,,2730,10133,HEC
27,,SING,CAA,CBA,no,N,27,,2730,10133,HEC
28,,SING,CAA,HAA1,no,N,28,,2730,10133,HEC
29,,SING,CAA,HAA2,no,N,29,,2730,10133,HEC
30,,SING,CBA,CGA,no,N,30,,2730,10133,HEC
31,,SING,CBA,HBA1,no,N,31,,2730,10133,HEC
32,,SING,CBA,HBA2,no,N,32,,2730,10133,HEC
33,,DOUB,CGA,O1A,no,N,33,,2730,10133,HEC
34,,SING,CGA,O2A,no,N,34,,2730,10133,HEC
35,,SING,O2A,H2A,no,N,35,,2730,10133,HEC
36,,SING,NB,C1B,yes,N,36,,2730,10133,HEC
37,,SING,NB,C4B,yes,N,37,,2730,10133,HEC
38,,DOUB,C1B,C2B,yes,N,38,,2730,10133,HEC
39,,SING,C2B,C3B,yes,N,39,,2730,10133,HEC
40,,SING,C2B,CMB,no,N,40,,2730,10133,HEC
41,,SING,C3B,C4B,yes,N,41,,2730,10133,HEC
42,,DOUB,C3B,CAB,no,E,42,,2730,10133,HEC
43,,SING,CMB,HMB1,no,N,43,,2730,10133,HEC
44,,SING,CMB,HMB2,no,N,44,,2730,10133,HEC
45,,SING,CMB,HMB3,no,N,45,,2730,10133,HEC
46,,SING,CAB,CBB,no,N,46,,2730,10133,HEC
47,,SING,CAB,HAB,no,N,47,,2730,10133,HEC
48,,SING,CBB,HBB1,no,N,48,,2730,10133,HEC
49,,SING,CBB,HBB2,no,N,49,,2730,10133,HEC
50,,SING,CBB,HBB3,no,N,50,,2730,10133,HEC
51,,SING,NC,C1C,yes,N,51,,2730,10133,HEC
52,,SING,NC,C4C,yes,N,52,,2730,10133,HEC
53,,DOUB,C1C,C2C,yes,N,53,,2730,10133,HEC
54,,SING,C2C,C3C,yes,N,54,,2730,10133,HEC
55,,SING,C2C,CMC,no,N,55,,2730,10133,HEC
56,,SING,C3C,C4C,yes,N,56,,2730,10133,HEC
57,,DOUB,C3C,CAC,no,E,57,,2730,10133,HEC
58,,SING,CMC,HMC1,no,N,58,,2730,10133,HEC
59,,SING,CMC,HMC2,no,N,59,,2730,10133,HEC
60,,SING,CMC,HMC3,no,N,60,,2730,10133,HEC
61,,SING,CAC,CBC,no,N,61,,2730,10133,HEC
62,,SING,CAC,HAC,no,N,62,,2730,10133,HEC
63,,SING,CBC,HBC1,no,N,63,,2730,10133,HEC
64,,SING,CBC,HBC2,no,N,64,,2730,10133,HEC
65,,SING,CBC,HBC3,no,N,65,,2730,10133,HEC
66,,SING,ND,C1D,yes,N,66,,2730,10133,HEC
67,,SING,ND,C4D,yes,N,67,,2730,10133,HEC
68,,DOUB,C1D,C2D,yes,N,68,,2730,10133,HEC
69,,SING,C2D,C3D,yes,N,69,,2730,10133,HEC
70,,SING,C2D,CMD,no,N,70,,2730,10133,HEC
71,,DOUB,C3D,C4D,yes,N,71,,2730,10133,HEC
72,,SING,C3D,CAD,no,N,72,,2730,10133,HEC
73,,SING,CMD,HMD1,no,N,73,,2730,10133,HEC
74,,SING,CMD,HMD2,no,N,74,,2730,10133,HEC
75,,SING,CMD,HMD3,no,N,75,,2730,10133,HEC
76,,SING,CAD,CBD,no,N,76,,2730,10133,HEC
77,,SING,CAD,HAD1,no,N,77,,2730,10133,HEC
78,,SING,CAD,HAD2,no,N,78,,2730,10133,HEC
79,,SING,CBD,CGD,no,N,79,,2730,10133,HEC
80,,SING,CBD,HBD1,no,N,80,,2730,10133,HEC
81,,SING,CBD,HBD2,no,N,81,,2730,10133,HEC
82,,DOUB,CGD,O1D,no,N,82,,2730,10133,HEC
83,,SING,CGD,O2D,no,N,83,,2730,10133,HEC
84,,SING,O2D,H2D,no,N,84,,2730,10133,HEC
1,,SING,FE,NA,no,N,1,,2745,10134,HEC
2,,SING,FE,NB,no,N,2,,2745,10134,HEC
3,,SING,FE,NC,no,N,3,,2745,10134,HEC
4,,SING,FE,ND,no,N,4,,2745,10134,HEC
5,,DOUB,CHA,C1A,no,N,5,,2745,10134,HEC
6,,SING,CHA,C4D,no,N,6,,2745,10134,HEC
7,,SING,CHA,HHA,no,N,7,,2745,10134,HEC
8,,DOUB,CHB,C4A,no,N,8,,2745,10134,HEC
9,,SING,CHB,C1B,no,N,9,,2745,10134,HEC
10,,SING,CHB,HHB,no,N,10,,2745,10134,HEC
11,,DOUB,CHC,C4B,no,N,11,,2745,10134,HEC
12,,SING,CHC,C1C,no,N,12,,2745,10134,HEC
13,,SING,CHC,HHC,no,N,13,,2745,10134,HEC
14,,DOUB,CHD,C4C,no,N,14,,2745,10134,HEC
15,,SING,CHD,C1D,no,N,15,,2745,10134,HEC
16,,SING,CHD,HHD,no,N,16,,2745,10134,HEC
17,,SING,NA,C1A,yes,N,17,,2745,10134,HEC
18,,SING,NA,C4A,yes,N,18,,2745,10134,HEC
19,,SING,C1A,C2A,yes,N,19,,2745,10134,HEC
20,,DOUB,C2A,C3A,yes,N,20,,2745,10134,HEC
21,,SING,C2A,CAA,no,N,21,,2745,10134,HEC
22,,SING,C3A,C4A,yes,N,22,,2745,10134,HEC
23,,SING,C3A,CMA,no,N,23,,2745,10134,HEC
24,,SING,CMA,HMA1,no,N,24,,2745,10134,HEC
25,,SING,CMA,HMA2,no,N,25,,2745,10134,HEC
26,,SING,CMA,HMA3,no,N,26,,2745,10134,HEC
27,,SING,CAA,CBA,no,N,27,,2745,10134,HEC
28,,SING,CAA,HAA1,no,N,28,,2745,10134,HEC
29,,SING,CAA,HAA2,no,N,29,,2745,10134,HEC
30,,SING,CBA,CGA,no,N,30,,2745,10134,HEC
31,,SING,CBA,HBA1,no,N,31,,2745,10134,HEC
32,,SING,CBA,HBA2,no,N,32,,2745,10134,HEC
33,,DOUB,CGA,O1A,no,N,33,,2745,10134,HEC
34,,SING,CGA,O2A,no,N,34,,2745,10134,HEC
35,,SING,O2A,H2A,no,N,35,,2745,10134,HEC
36,,SING,NB,C1B,yes,N,36,,2745,10134,HEC
37,,SING,NB,C4B,yes,N,37,,2745,10134,HEC
38,,DOUB,C1B,C2B,yes,N,38,,2745,10134,HEC
39,,SING,C2B,C3B,yes,N,39,,2745,10134,HEC
40,,SING,C2B,CMB,no,N,40,,2745,10134,HEC
41,,SING,C3B,C4B,yes,N,41,,2745,10134,HEC
42,,DOUB,C3B,CAB,no,E,42,,2745,10134,HEC
43,,SING,CMB,HMB1,no,N,43,,2745,10134,HEC
44,,SING,CMB,HMB2,no,N,44,,2745,10134,HEC
45,,SING,CMB,HMB3,no,N,45,,2745,10134,HEC
46,,SING,CAB,CBB,no,N,46,,2745,10134,HEC
47,,SING,CAB,HAB,no,N,47,,2745,10134,HEC
48,,SING,CBB,HBB1,no,N,48,,2745,10134,HEC
49,,SING,CBB,HBB2,no,N,49,,2745,10134,HEC
50,,SING,CBB,HBB3,no,N,50,,2745,10134,HEC
51,,SING,NC,C1C,yes,N,51,,2745,10134,HEC
52,,SING,NC,C4C,yes,N,52,,2745,10134,HEC
53,,DOUB,C1C,C2C,yes,N,53,,2745,10134,HEC
54,,SING,C2C,C3C,yes,N,54,,2745,10134,HEC
55,,SING,C2C,CMC,no,N,55,,2745,10134,HEC
56,,SING,C3C,C4C,yes,N,56,,2745,10134,HEC
57,,DOUB,C3C,CAC,no,E,57,,2745,10134,HEC
58,,SING,CMC,HMC1,no,N,58,,2745,10134,HEC
59,,SING,CMC,HMC2,no,N,59,,2745,10134,HEC
60,,SING,CMC,HMC3,no,N,60,,2745,10134,HEC
61,,SING,CAC,CBC,no,N,61,,2745,10134,HEC
62,,SING,CAC,HAC,no,N,62,,2745,10134,HEC
63,,SING,CBC,HBC1,no,N,63,,2745,10134,HEC
64,,SING,CBC,HBC2,no,N,64,,2745,10134,HEC
65,,SING,CBC,HBC3,no,N,65,,2745,10134,HEC
66,,SING,ND,C1D,yes,N,66,,2745,10134,HEC
67,,SING,ND,C4D,yes,N,67,,2745,10134,HEC
68,,DOUB,C1D,C2D,yes,N,68,,2745,10134,HEC
69,,SING,C2D,C3D,yes,N,69,,2745,10134,HEC
70,,SING,C2D,CMD,no,N,70,,2745,10134,HEC
71,,DOUB,C3D,C4D,yes,N,71,,2745,10134,HEC
72,,SING,C3D,CAD,no,N,72,,2745,10134,HEC
73,,SING,CMD,HMD1,no,N,73,,2745,10134,HEC
74,,SING,CMD,HMD2,no,N,74,,2745,10134,HEC
75,,SING,CMD,HMD3,no,N,75,,2745,10134,HEC
76,,SING,CAD,CBD,no,N,76,,2745,10134,HEC
77,,SING,CAD,HAD1,no,N,77,,2745,10134,HEC
78,,SING,CAD,HAD2,no,N,78,,2745,10134,HEC
79,,SING,CBD,CGD,no,N,79,,2745,10134,HEC
80,,SING,CBD,HBD1,no,N,80,,2745,10134,HEC
81,,SING,CBD,HBD2,no,N,81,,2745,10134,HEC
82,,DOUB,CGD,O1D,no,N,82,,2745,10134,HEC
83,,SING,CGD,O2D,no,N,83,,2745,10134,HEC
84,,SING,O2D,H2D,no,N,84,,2745,10134,HEC
1,,SING,FE,NA,no,N,1,,2760,10135,HEC
2,,SING,FE,NB,no,N,2,,2760,10135,HEC
3,,SING,FE,NC,no,N,3,,2760,10135,HEC
4,,SING,FE,ND,no,N,4,,2760,10135,HEC
5,,DOUB,CHA,C1A,no,N,5,,2760,10135,HEC
6,,SING,CHA,C4D,no,N,6,,2760,10135,HEC
7,,SING,CHA,HHA,no,N,7,,2760,10135,HEC
8,,DOUB,CHB,C4A,no,N,8,,2760,10135,HEC
9,,SING,CHB,C1B,no,N,9,,2760,10135,HEC
10,,SING,CHB,HHB,no,N,10,,2760,10135,HEC
11,,DOUB,CHC,C4B,no,N,11,,2760,10135,HEC
12,,SING,CHC,C1C,no,N,12,,2760,10135,HEC
13,,SING,CHC,HHC,no,N,13,,2760,10135,HEC
14,,DOUB,CHD,C4C,no,N,14,,2760,10135,HEC
15,,SING,CHD,C1D,no,N,15,,2760,10135,HEC
16,,SING,CHD,HHD,no,N,16,,2760,10135,HEC
17,,SING,NA,C1A,yes,N,17,,2760,10135,HEC
18,,SING,NA,C4A,yes,N,18,,2760,10135,HEC
19,,SING,C1A,C2A,yes,N,19,,2760,10135,HEC
20,,DOUB,C2A,C3A,yes,N,20,,2760,10135,HEC
21,,SING,C2A,CAA,no,N,21,,2760,10135,HEC
22,,SING,C3A,C4A,yes,N,22,,2760,10135,HEC
23,,SING,C3A,CMA,no,N,23,,2760,10135,HEC
24,,SING,CMA,HMA1,no,N,24,,2760,10135,HEC
25,,SING,CMA,HMA2,no,N,25,,2760,10135,HEC
26,,SING,CMA,HMA3,no,N,26,,2760,10135,HEC
27,,SING,CAA,CBA,no,N,27,,2760,10135,HEC
28,,SING,CAA,HAA1,no,N,28,,2760,10135,HEC
29,,SING,CAA,HAA2,no,N,29,,2760,10135,HEC
30,,SING,CBA,CGA,no,N,30,,2760,10135,HEC
31,,SING,CBA,HBA1,no,N,31,,2760,10135,HEC
32,,SING,CBA,HBA2,no,N,32,,2760,10135,HEC
33,,DOUB,CGA,O1A,no,N,33,,2760,10135,HEC
34,,SING,CGA,O2A,no,N,34,,2760,10135,HEC
35,,SING,O2A,H2A,no,N,35,,2760,10135,HEC
36,,SING,NB,C1B,yes,N,36,,2760,10135,HEC
37,,SING,NB,C4B,yes,N,37,,2760,10135,HEC
38,,DOUB,C1B,C2B,yes,N,38,,2760,10135,HEC
39,,SING,C2B,C3B,yes,N,39,,2760,10135,HEC
40,,SING,C2B,CMB,no,N,40,,2760,10135,HEC
41,,SING,C3B,C4B,yes,N,41,,2760,10135,HEC
42,,DOUB,C3B,CAB,no,E,42,,2760,10135,HEC
43,,SING,CMB,HMB1,no,N,43,,2760,10135,HEC
44,,SING,CMB,HMB2,no,N,44,,2760,10135,HEC
45,,SING,CMB,HMB3,no,N,45,,2760,10135,HEC
46,,SING,CAB,CBB,no,N,46,,2760,10135,HEC
47,,SING,CAB,HAB,no,N,47,,2760,10135,HEC
48,,SING,CBB,HBB1,no,N,48,,2760,10135,HEC
49,,SING,CBB,HBB2,no,N,49,,2760,10135,HEC
50,,SING,CBB,HBB3,no,N,50,,2760,10135,HEC
51,,SING,NC,C1C,yes,N,51,,2760,10135,HEC
52,,SING,NC,C4C,yes,N,52,,2760,10135,HEC
53,,DOUB,C1C,C2C,yes,N,53,,2760,10135,HEC
54,,SING,C2C,C3C,yes,N,54,,2760,10135,HEC
55,,SING,C2C,CMC,no,N,55,,2760,10135,HEC
56,,SING,C3C,C4C,yes,N,56,,2760,10135,HEC
57,,DOUB,C3C,CAC,no,E,57,,2760,10135,HEC
58,,SING,CMC,HMC1,no,N,58,,2760,10135,HEC
59,,SING,CMC,HMC2,no,N,59,,2760,10135,HEC
60,,SING,CMC,HMC3,no,N,60,,2760,10135,HEC
61,,SING,CAC,CBC,no,N,61,,2760,10135,HEC
62,,SING,CAC,HAC,no,N,62,,2760,10135,HEC
63,,SING,CBC,HBC1,no,N,63,,2760,10135,HEC
64,,SING,CBC,HBC2,no,N,64,,2760,10135,HEC
65,,SING,CBC,HBC3,no,N,65,,2760,10135,HEC
66,,SING,ND,C1D,yes,N,66,,2760,10135,HEC
67,,SING,ND,C4D,yes,N,67,,2760,10135,HEC
68,,DOUB,C1D,C2D,yes,N,68,,2760,10135,HEC
69,,SING,C2D,C3D,yes,N,69,,2760,10135,HEC
70,,SING,C2D,CMD,no,N,70,,2760,10135,HEC
71,,DOUB,C3D,C4D,yes,N,71,,2760,10135,HEC
72,,SING,C3D,CAD,no,N,72,,2760,10135,HEC
73,,SING,CMD,HMD1,no,N,73,,2760,10135,HEC
74,,SING,CMD,HMD2,no,N,74,,2760,10135,HEC
75,,SING,CMD,HMD3,no,N,75,,2760,10135,HEC
76,,SING,CAD,CBD,no,N,76,,2760,10135,HEC
77,,SING,CAD,HAD1,no,N,77,,2760,10135,HEC
78,,SING,CAD,HAD2,no,N,78,,2760,10135,HEC
79,,SING,CBD,CGD,no,N,79,,2760,10135,HEC
80,,SING,CBD,HBD1,no,N,80,,2760,10135,HEC
81,,SING,CBD,HBD2,no,N,81,,2760,10135,HEC
82,,DOUB,CGD,O1D,no,N,82,,2760,10135,HEC
83,,SING,CGD,O2D,no,N,83,,2760,10135,HEC
84,,SING,O2D,H2D,no,N,84,,2760,10135,HEC
1,,SING,N,CA,no,N,1,,4945,1024,IYR
2,,SING,N,H,no,N,2,,4945,1024,IYR
3,,SING,N,H2,no,N,3,,4945,1024,IYR
4,,SING,CA,CB,no,N,4,,4945,1024,IYR
5,,SING,CA,C,no,N,5,,4945,1024,IYR
6,,SING,CA,HA,no,N,6,,4945,1024,IYR
7,,SING,CB,CC,no,N,7,,4945,1024,IYR
8,,SING,CB,HB2,no,N,8,,4945,1024,IYR
9,,SING,CB,HB3,no,N,9,,4945,1024,IYR
10,,DOUB,CC,CD,yes,N,10,,4945,1024,IYR
11,,SING,CC,CH,yes,N,11,,4945,1024,IYR
12,,SING,CD,CE,yes,N,12,,4945,1024,IYR
13,,SING,CD,HD,no,N,13,,4945,1024,IYR
14,,SING,CE,IE,no,N,14,,4945,1024,IYR
15,,DOUB,CE,CF,yes,N,15,,4945,1024,IYR
16,,SING,CF,OF,no,N,16,,4945,1024,IYR
17,,SING,CF,CG,yes,N,17,,4945,1024,IYR
18,,SING,OF,HF,no,N,18,,4945,1024,IYR
19,,DOUB,CG,CH,yes,N,19,,4945,1024,IYR
20,,SING,CG,HG,no,N,20,,4945,1024,IYR
21,,SING,CH,HH,no,N,21,,4945,1024,IYR
22,,DOUB,C,O,no,N,22,,4945,1024,IYR
23,,SING,C,OXT,no,N,23,,4945,1024,IYR
24,,SING,OXT,HXT,no,N,24,,4945,1024,IYR
1,,SING,N,CA,no,N,1,,6939,1042,AYA
2,,SING,N,CT,no,N,2,,6939,1042,AYA
3,,SING,N,H,no,N,3,,6939,1042,AYA
4,,SING,CA,CB,no,N,4,,6939,1042,AYA
5,,SING,CA,C,no,N,5,,6939,1042,AYA
6,,SING,CA,HA,no,N,6,,6939,1042,AYA
7,,SING,CB,HB1,no,N,7,,6939,1042,AYA
8,,SING,CB,HB2,no,N,8,,6939,1042,AYA
9,,SING,CB,HB3,no,N,9,,6939,1042,AYA
10,,DOUB,C,O,no,N,10,,6939,1042,AYA
11,,SING,C,OXT,no,N,11,,6939,1042,AYA
12,,SING,OXT,HXT,no,N,12,,6939,1042,AYA
13,,DOUB,CT,OT,no,N,13,,6939,1042,AYA
14,,SING,CT,CM,no,N,14,,6939,1042,AYA
15,,SING,CM,HM1,no,N,15,,6939,1042,AYA
16,,SING,CM,HM2,no,N,16,,6939,1042,AYA
17,,SING,CM,HM3,no,N,17,,6939,1042,AYA
1,,SING,N,CA,no,N,1,,6953,1043,AYA
2,,SING,N,CT,no,N,2,,6953,1043,AYA
3,,SING,N,H,no,N,3,,6953,1043,AYA
4,,SING,CA,CB,no,N,4,,6953,1043,AYA
5,,SING,CA,C,no,N,5,,6953,1043,AYA
6,,SING,CA,HA,no,N,6,,6953,1043,AYA
7,,SING,CB,HB1,no,N,7,,6953,1043,AYA
8,,SING,CB,HB2,no,N,8,,6953,1043,AYA
9,,SING,CB,HB3,no,N,9,,6953,1043,AYA
10,,DOUB,C,O,no,N,10,,6953,1043,AYA
11,,SING,C,OXT,no,N,11,,6953,1043,AYA
12,,SING,OXT,HXT,no,N,12,,6953,1043,AYA
13,,DOUB,CT,OT,no,N,13,,6953,1043,AYA
14,,SING,CT,CM,no,N,14,,6953,1043,AYA
15,,SING,CM,HM1,no,N,15,,6953,1043,AYA
16,,SING,CM,HM2,no,N,16,,6953,1043,AYA
17,,SING,CM,HM3,no,N,17,,6953,1043,AYA
1,,SING,N,CA,no,N,1,,6967,1044,AYA
2,,SING,N,CT,no,N,2,,6967,1044,AYA
3,,SING,N,H,no,N,3,,6967,1044,AYA
4,,SING,CA,CB,no,N,4,,6967,1044,AYA
5,,SING,CA,C,no,N,5,,6967,1044,AYA
6,,SING,CA,HA,no,N,6,,6967,1044,AYA
7,,SING,CB,HB1,no,N,7,,6967,1044,AYA
8,,SING,CB,HB2,no,N,8,,6967,1044,AYA
9,,SING,CB,HB3,no,N,9,,6967,1044,AYA
10,,DOUB,C,O,no,N,10,,6967,1044,AYA
11,,SING,C,OXT,no,N,11,,6967,1044,AYA
12,,SING,OXT,HXT,no,N,12,,6967,1044,AYA
13,,DOUB,CT,OT,no,N,13,,6967,1044,AYA
14,,SING,CT,CM,no,N,14,,6967,1044,AYA
15,,SING,CM,HM1,no,N,15,,6967,1044,AYA
16,,SING,CM,HM2,no,N,16,,6967,1044,AYA
17,,SING,CM,HM3,no,N,17,,6967,1044,AYA
1,,SING,N,CA,no,N,1,,6981,1045,AYA
2,,SING,N,CT,no,N,2,,6981,1045,AYA
3,,SING,N,H,no,N,3,,6981,1045,AYA
4,,SING,CA,CB,no,N,4,,6981,1045,AYA
5,,SING,CA,C,no,N,5,,6981,1045,AYA
6,,SING,CA,HA,no,N,6,,6981,1045,AYA
7,,SING,CB,HB1,no,N,7,,6981,1045,AYA
8,,SING,CB,HB2,no,N,8,,6981,1045,AYA
9,,SING,CB,HB3,no,N,9,,6981,1045,AYA
10,,DOUB,C,O,no,N,10,,6981,1045,AYA
11,,SING,C,OXT,no,N,11,,6981,1045,AYA
12,,SING,OXT,HXT,no,N,12,,6981,1045,AYA
13,,DOUB,CT,OT,no,N,13,,6981,1045,AYA
14,,SING,CT,CM,no,N,14,,6981,1045,AYA
15,,SING,CM,HM1,no,N,15,,6981,1045,AYA
16,,SING,CM,HM2,no,N,16,,6981,1045,AYA
17,,SING,CM,HM3,no,N,17,,6981,1045,AYA
1,,SING,N,CA,no,N,1,,7047,1056,AYA
2,,SING,N,CT,no,N,2,,7047,1056,AYA
3,,SING,N,H,no,N,3,,7047,1056,AYA
4,,SING,CA,CB,no,N,4,,7047,1056,AYA
5,,SING,CA,C,no,N,5,,7047,1056,AYA
6,,SING,CA,HA,no,N,6,,7047,1056,AYA
7,,SING,CB,HB1,no,N,7,,7047,1056,AYA
8,,SING,CB,HB2,no,N,8,,7047,1056,AYA
9,,SING,CB,HB3,no,N,9,,7047,1056,AYA
10,,DOUB,C,O,no,N,10,,7047,1056,AYA
11,,SING,C,OXT,no,N,11,,7047,1056,AYA
12,,SING,OXT,HXT,no,N,12,,7047,1056,AYA
13,,DOUB,CT,OT,no,N,13,,7047,1056,AYA
14,,SING,CT,CM,no,N,14,,7047,1056,AYA
15,,SING,CM,HM1,no,N,15,,7047,1056,AYA
16,,SING,CM,HM2,no,N,16,,7047,1056,AYA
17,,SING,CM,HM3,no,N,17,,7047,1056,AYA
1,,SING,C1,C2,no,N,1,,7061,1058,AAC
2,,SING,C1,O1,no,N,2,,7061,1058,AAC
3,,DOUB,C1,O2,no,N,3,,7061,1058,AAC
4,,SING,C2,N1,no,N,4,,7061,1058,AAC
5,,SING,C2,HC21,no,N,5,,7061,1058,AAC
6,,SING,C2,HC22,no,N,6,,7061,1058,AAC
7,,SING,C3,C4,no,N,7,,7061,1058,AAC
8,,SING,C3,N1,no,N,8,,7061,1058,AAC
9,,DOUB,C3,O3,no,N,9,,7061,1058,AAC
10,,SING,C4,HC41,no,N,10,,7061,1058,AAC
11,,SING,C4,HC42,no,N,11,,7061,1058,AAC
12,,SING,C4,HC43,no,N,12,,7061,1058,AAC
13,,SING,N1,HN1,no,N,13,,7061,1058,AAC
14,,SING,O1,HO1,no,N,14,,7061,1058,AAC
1,,SING,FE,NA,no,N,1,,7062,1058,HEC
2,,SING,FE,NB,no,N,2,,7062,1058,HEC
3,,SING,FE,NC,no,N,3,,7062,1058,HEC
4,,SING,FE,ND,no,N,4,,7062,1058,HEC
5,,DOUB,CHA,C1A,no,N,5,,7062,1058,HEC
6,,SING,CHA,C4D,no,N,6,,7062,1058,HEC
7,,SING,CHA,HHA,no,N,7,,7062,1058,HEC
8,,DOUB,CHB,C4A,no,N,8,,7062,1058,HEC
9,,SING,CHB,C1B,no,N,9,,7062,1058,HEC
10,,SING,CHB,HHB,no,N,10,,7062,1058,HEC
11,,DOUB,CHC,C4B,no,N,11,,7062,1058,HEC
12,,SING,CHC,C1C,no,N,12,,7062,1058,HEC
13,,SING,CHC,HHC,no,N,13,,7062,1058,HEC
14,,DOUB,CHD,C4C,no,N,14,,7062,1058,HEC
15,,SING,CHD,C1D,no,N,15,,7062,1058,HEC
16,,SING,CHD,HHD,no,N,16,,7062,1058,HEC
17,,SING,NA,C1A,yes,N,17,,7062,1058,HEC
18,,SING,NA,C4A,yes,N,18,,7062,1058,HEC
19,,SING,C1A,C2A,yes,N,19,,7062,1058,HEC
20,,DOUB,C2A,C3A,yes,N,20,,7062,1058,HEC
21,,SING,C2A,CAA,no,N,21,,7062,1058,HEC
22,,SING,C3A,C4A,yes,N,22,,7062,1058,HEC
23,,SING,C3A,CMA,no,N,23,,7062,1058,HEC
24,,SING,CMA,HMA1,no,N,24,,7062,1058,HEC
25,,SING,CMA,HMA2,no,N,25,,7062,1058,HEC
26,,SING,CMA,HMA3,no,N,26,,7062,1058,HEC
27,,SING,CAA,CBA,no,N,27,,7062,1058,HEC
28,,SING,CAA,HAA1,no,N,28,,7062,1058,HEC
29,,SING,CAA,HAA2,no,N,29,,7062,1058,HEC
30,,SING,CBA,CGA,no,N,30,,7062,1058,HEC
31,,SING,CBA,HBA1,no,N,31,,7062,1058,HEC
32,,SING,CBA,HBA2,no,N,32,,7062,1058,HEC
33,,DOUB,CGA,O1A,no,N,33,,7062,1058,HEC
34,,SING,CGA,O2A,no,N,34,,7062,1058,HEC
35,,SING,O2A,H2A,no,N,35,,7062,1058,HEC
36,,SING,NB,C1B,yes,N,36,,7062,1058,HEC
37,,SING,NB,C4B,yes,N,37,,7062,1058,HEC
38,,DOUB,C1B,C2B,yes,N,38,,7062,1058,HEC
39,,SING,C2B,C3B,yes,N,39,,7062,1058,HEC
40,,SING,C2B,CMB,no,N,40,,7062,1058,HEC
41,,SING,C3B,C4B,yes,N,41,,7062,1058,HEC
42,,DOUB,C3B,CAB,no,E,42,,7062,1058,HEC
43,,SING,CMB,HMB1,no,N,43,,7062,1058,HEC
44,,SING,CMB,HMB2,no,N,44,,7062,1058,HEC
45,,SING,CMB,HMB3,no,N,45,,7062,1058,HEC
46,,SING,CAB,CBB,no,N,46,,7062,1058,HEC
47,,SING,CAB,HAB,no,N,47,,7062,1058,HEC
48,,SING,CBB,HBB1,no,N,48,,7062,1058,HEC
49,,SING,CBB,HBB2,no,N,49,,7062,1058,HEC
50,,SING,CBB,HBB3,no,N,50,,7062,1058,HEC
51,,SING,NC,C1C,yes,N,51,,7062,1058,HEC
52,,SING,NC,C4C,yes,N,52,,7062,1058,HEC
53,,DOUB,C1C,C2C,yes,N,53,,7062,1058,HEC
54,,SING,C2C,C3C,yes,N,54,,7062,1058,HEC
55,,SING,C2C,CMC,no,N,55,,7062,1058,HEC
56,,SING,C3C,C4C,yes,N,56,,7062,1058,HEC
57,,DOUB,C3C,CAC,no,E,57,,7062,1058,HEC
58,,SING,CMC,HMC1,no,N,58,,7062,1058,HEC
59,,SING,CMC,HMC2,no,N,59,,7062,1058,HEC
60,,SING,CMC,HMC3,no,N,60,,7062,1058,HEC
61,,SING,CAC,CBC,no,N,61,,7062,1058,HEC
62,,SING,CAC,HAC,no,N,62,,7062,1058,HEC
63,,SING,CBC,HBC1,no,N,63,,7062,1058,HEC
64,,SING,CBC,HBC2,no,N,64,,7062,1058,HEC
65,,SING,CBC,HBC3,no,N,65,,7062,1058,HEC
66,,SING,ND,C1D,yes,N,66,,7062,1058,HEC
67,,SING,ND,C4D,yes,N,67,,7062,1058,HEC
68,,DOUB,C1D,C2D,yes,N,68,,7062,1058,HEC
69,,SING,C2D,C3D,yes,N,69,,7062,1058,HEC
70,,SING,C2D,CMD,no,N,70,,7062,1058,HEC
71,,DOUB,C3D,C4D,yes,N,71,,7062,1058,HEC
72,,SING,C3D,CAD,no,N,72,,7062,1058,HEC
73,,SING,CMD,HMD1,no,N,73,,7062,1058,HEC
74,,SING,CMD,HMD2,no,N,74,,7062,1058,HEC
75,,SING,CMD,HMD3,no,N,75,,7062,1058,HEC
76,,SING,CAD,CBD,no,N,76,,7062,1058,HEC
77,,SING,CAD,HAD1,no,N,77,,7062,1058,HEC
78,,SING,CAD,HAD2,no,N,78,,7062,1058,HEC
79,,SING,CBD,CGD,no,N,79,,7062,1058,HEC
80,,SING,CBD,HBD1,no,N,80,,7062,1058,HEC
81,,SING,CBD,HBD2,no,N,81,,7062,1058,HEC
82,,DOUB,CGD,O1D,no,N,82,,7062,1058,HEC
83,,SING,CGD,O2D,no,N,83,,7062,1058,HEC
84,,SING,O2D,H2D,no,N,84,,7062,1058,HEC
1,,SING,FE,NA,no,N,1,,7219,1095,HEC
2,,SING,FE,NB,no,N,2,,7219,1095,HEC
3,,SING,FE,NC,no,N,3,,7219,1095,HEC
4,,SING,FE,ND,no,N,4,,7219,1095,HEC
5,,DOUB,CHA,C1A,no,N,5,,7219,1095,HEC
6,,SING,CHA,C4D,no,N,6,,7219,1095,HEC
7,,SING,CHA,HHA,no,N,7,,7219,1095,HEC
8,,DOUB,CHB,C4A,no,N,8,,7219,1095,HEC
9,,SING,CHB,C1B,no,N,9,,7219,1095,HEC
10,,SING,CHB,HHB,no,N,10,,7219,1095,HEC
11,,DOUB,CHC,C4B,no,N,11,,7219,1095,HEC
12,,SING,CHC,C1C,no,N,12,,7219,1095,HEC
13,,SING,CHC,HHC,no,N,13,,7219,1095,HEC
14,,DOUB,CHD,C4C,no,N,14,,7219,1095,HEC
15,,SING,CHD,C1D,no,N,15,,7219,1095,HEC
16,,SING,CHD,HHD,no,N,16,,7219,1095,HEC
17,,SING,NA,C1A,yes,N,17,,7219,1095,HEC
18,,SING,NA,C4A,yes,N,18,,7219,1095,HEC
19,,SING,C1A,C2A,yes,N,19,,7219,1095,HEC
20,,DOUB,C2A,C3A,yes,N,20,,7219,1095,HEC
21,,SING,C2A,CAA,no,N,21,,7219,1095,HEC
22,,SING,C3A,C4A,yes,N,22,,7219,1095,HEC
23,,SING,C3A,CMA,no,N,23,,7219,1095,HEC
24,,SING,CMA,HMA1,no,N,24,,7219,1095,HEC
25,,SING,CMA,HMA2,no,N,25,,7219,1095,HEC
26,,SING,CMA,HMA3,no,N,26,,7219,1095,HEC
27,,SING,CAA,CBA,no,N,27,,7219,1095,HEC
28,,SING,CAA,HAA1,no,N,28,,7219,1095,HEC
29,,SING,CAA,HAA2,no,N,29,,7219,1095,HEC
30,,SING,CBA,CGA,no,N,30,,7219,1095,HEC
31,,SING,CBA,HBA1,no,N,31,,7219,1095,HEC
32,,SING,CBA,HBA2,no,N,32,,7219,1095,HEC
33,,DOUB,CGA,O1A,no,N,33,,7219,1095,HEC
34,,SING,CGA,O2A,no,N,34,,7219,1095,HEC
35,,SING,O2A,H2A,no,N,35,,7219,1095,HEC
36,,SING,NB,C1B,yes,N,36,,7219,1095,HEC
37,,SING,NB,C4B,yes,N,37,,7219,1095,HEC
38,,DOUB,C1B,C2B,yes,N,38,,7219,1095,HEC
39,,SING,C2B,C3B,yes,N,39,,7219,1095,HEC
40,,SING,C2B,CMB,no,N,40,,7219,1095,HEC
41,,SING,C3B,C4B,yes,N,41,,7219,1095,HEC
42,,DOUB,C3B,CAB,no,E,42,,7219,1095,HEC
43,,SING,CMB,HMB1,no,N,43,,7219,1095,HEC
44,,SING,CMB,HMB2,no,N,44,,7219,1095,HEC
45,,SING,CMB,HMB3,no,N,45,,7219,1095,HEC
46,,SING,CAB,CBB,no,N,46,,7219,1095,HEC
47,,SING,CAB,HAB,no,N,47,,7219,1095,HEC
48,,SING,CBB,HBB1,no,N,48,,7219,1095,HEC
49,,SING,CBB,HBB2,no,N,49,,7219,1095,HEC
50,,SING,CBB,HBB3,no,N,50,,7219,1095,HEC
51,,SING,NC,C1C,yes,N,51,,7219,1095,HEC
52,,SING,NC,C4C,yes,N,52,,7219,1095,HEC
53,,DOUB,C1C,C2C,yes,N,53,,7219,1095,HEC
54,,SING,C2C,C3C,yes,N,54,,7219,1095,HEC
55,,SING,C2C,CMC,no,N,55,,7219,1095,HEC
56,,SING,C3C,C4C,yes,N,56,,7219,1095,HEC
57,,DOUB,C3C,CAC,no,E,57,,7219,1095,HEC
58,,SING,CMC,HMC1,no,N,58,,7219,1095,HEC
59,,SING,CMC,HMC2,no,N,59,,7219,1095,HEC
60,,SING,CMC,HMC3,no,N,60,,7219,1095,HEC
61,,SING,CAC,CBC,no,N,61,,7219,1095,HEC
62,,SING,CAC,HAC,no,N,62,,7219,1095,HEC
63,,SING,CBC,HBC1,no,N,63,,7219,1095,HEC
64,,SING,CBC,HBC2,no,N,64,,7219,1095,HEC
65,,SING,CBC,HBC3,no,N,65,,7219,1095,HEC
66,,SING,ND,C1D,yes,N,66,,7219,1095,HEC
67,,SING,ND,C4D,yes,N,67,,7219,1095,HEC
68,,DOUB,C1D,C2D,yes,N,68,,7219,1095,HEC
69,,SING,C2D,C3D,yes,N,69,,7219,1095,HEC
70,,SING,C2D,CMD,no,N,70,,7219,1095,HEC
71,,DOUB,C3D,C4D,yes,N,71,,7219,1095,HEC
72,,SING,C3D,CAD,no,N,72,,7219,1095,HEC
73,,SING,CMD,HMD1,no,N,73,,7219,1095,HEC
74,,SING,CMD,HMD2,no,N,74,,7219,1095,HEC
75,,SING,CMD,HMD3,no,N,75,,7219,1095,HEC
76,,SING,CAD,CBD,no,N,76,,7219,1095,HEC
77,,SING,CAD,HAD1,no,N,77,,7219,1095,HEC
78,,SING,CAD,HAD2,no,N,78,,7219,1095,HEC
79,,SING,CBD,CGD,no,N,79,,7219,1095,HEC
80,,SING,CBD,HBD1,no,N,80,,7219,1095,HEC
81,,SING,CBD,HBD2,no,N,81,,7219,1095,HEC
82,,DOUB,CGD,O1D,no,N,82,,7219,1095,HEC
83,,SING,CGD,O2D,no,N,83,,7219,1095,HEC
84,,SING,O2D,H2D,no,N,84,,7219,1095,HEC
1,,SING,N,CA,no,N,1,,7220,1095,M3L
2,,SING,N,H,no,N,2,,7220,1095,M3L
3,,SING,N,H2,no,N,3,,7220,1095,M3L
4,,SING,CA,CB,no,N,4,,7220,1095,M3L
5,,SING,CA,C,no,N,5,,7220,1095,M3L
6,,SING,CA,HA,no,N,6,,7220,1095,M3L
7,,SING,CB,CG,no,N,7,,7220,1095,M3L
8,,SING,CB,HB2,no,N,8,,7220,1095,M3L
9,,SING,CB,HB3,no,N,9,,7220,1095,M3L
10,,SING,CG,CD,no,N,10,,7220,1095,M3L
11,,SING,CG,HG2,no,N,11,,7220,1095,M3L
12,,SING,CG,HG3,no,N,12,,7220,1095,M3L
13,,SING,CD,CE,no,N,13,,7220,1095,M3L
14,,SING,CD,HD2,no,N,14,,7220,1095,M3L
15,,SING,CD,HD3,no,N,15,,7220,1095,M3L
16,,SING,CE,NZ,no,N,16,,7220,1095,M3L
17,,SING,CE,HE2,no,N,17,,7220,1095,M3L
18,,SING,CE,HE3,no,N,18,,7220,1095,M3L
19,,SING,NZ,CM1,no,N,19,,7220,1095,M3L
20,,SING,NZ,CM2,no,N,20,,7220,1095,M3L
21,,SING,NZ,CM3,no,N,21,,7220,1095,M3L
22,,DOUB,C,O,no,N,22,,7220,1095,M3L
23,,SING,C,OXT,no,N,23,,7220,1095,M3L
24,,SING,OXT,HXT,no,N,24,,7220,1095,M3L
25,,SING,CM1,HM11,no,N,25,,7220,1095,M3L
26,,SING,CM1,HM12,no,N,26,,7220,1095,M3L
27,,SING,CM1,HM13,no,N,27,,7220,1095,M3L
28,,SING,CM2,HM21,no,N,28,,7220,1095,M3L
29,,SING,CM2,HM22,no,N,29,,7220,1095,M3L
30,,SING,CM2,HM23,no,N,30,,7220,1095,M3L
31,,SING,CM3,HM31,no,N,31,,7220,1095,M3L
32,,SING,CM3,HM32,no,N,32,,7220,1095,M3L
33,,SING,CM3,HM33,no,N,33,,7220,1095,M3L
1,,SING,C1A,C2A,no,N,1,,7273,1099,SAC
2,,DOUB,C1A,OAC,no,N,2,,7273,1099,SAC
3,,SING,C1A,N,no,N,3,,7273,1099,SAC
4,,SING,C2A,H2A1,no,N,4,,7273,1099,SAC
5,,SING,C2A,H2A2,no,N,5,,7273,1099,SAC
6,,SING,C2A,H2A3,no,N,6,,7273,1099,SAC
7,,SING,N,CA,no,N,7,,7273,1099,SAC
8,,SING,N,H,no,N,8,,7273,1099,SAC
9,,SING,CA,C,no,N,9,,7273,1099,SAC
10,,SING,CA,CB,no,N,10,,7273,1099,SAC
11,,SING,CA,HA,no,N,11,,7273,1099,SAC
12,,DOUB,C,O,no,N,12,,7273,1099,SAC
13,,SING,C,OXT,no,N,13,,7273,1099,SAC
14,,SING,OXT,HXT,no,N,14,,7273,1099,SAC
15,,SING,CB,OG,no,N,15,,7273,1099,SAC
16,,SING,CB,HB2,no,N,16,,7273,1099,SAC
17,,SING,CB,HB3,no,N,17,,7273,1099,SAC
18,,SING,OG,HG,no,N,18,,7273,1099,SAC
1,,SING,C1A,C2A,no,N,1,,7287,1100,SAC
2,,DOUB,C1A,OAC,no,N,2,,7287,1100,SAC
3,,SING,C1A,N,no,N,3,,7287,1100,SAC
4,,SING,C2A,H2A1,no,N,4,,7287,1100,SAC
5,,SING,C2A,H2A2,no,N,5,,7287,1100,SAC
6,,SING,C2A,H2A3,no,N,6,,7287,1100,SAC
7,,SING,N,CA,no,N,7,,7287,1100,SAC
8,,SING,N,H,no,N,8,,7287,1100,SAC
9,,SING,CA,C,no,N,9,,7287,1100,SAC
10,,SING,CA,CB,no,N,10,,7287,1100,SAC
11,,SING,CA,HA,no,N,11,,7287,1100,SAC
12,,DOUB,C,O,no,N,12,,7287,1100,SAC
13,,SING,C,OXT,no,N,13,,7287,1100,SAC
14,,SING,OXT,HXT,no,N,14,,7287,1100,SAC
15,,SING,CB,OG,no,N,15,,7287,1100,SAC
16,,SING,CB,HB2,no,N,16,,7287,1100,SAC
17,,SING,CB,HB3,no,N,17,,7287,1100,SAC
18,,SING,OG,HG,no,N,18,,7287,1100,SAC
1,,DOUB,C,O,no,N,1,,7392,11005,ACE
2,,SING,C,CH3,no,N,2,,7392,11005,ACE
3,,SING,C,H,no,N,3,,7392,11005,ACE
4,,SING,CH3,H1,no,N,4,,7392,11005,ACE
5,,SING,CH3,H2,no,N,5,,7392,11005,ACE
6,,SING,CH3,H3,no,N,6,,7392,11005,ACE
1,,SING,N,HN1,no,N,1,,7393,11005,NH2
2,,SING,N,HN2,no,N,2,,7393,11005,NH2
1,,SING,N,CA,,,,,7411,11006,ILE_NH2
2,,SING,N,H,,,,,7411,11006,ILE_NH2
3,,SING,CA,C,,,,,7411,11006,ILE_NH2
4,,SING,CA,CB,,,,,7411,11006,ILE_NH2
5,,SING,CA,HA,,,,,7411,11006,ILE_NH2
6,,DOUB,C,O,,,,,7411,11006,ILE_NH2
7,,SING,CB,CG1,,,,,7411,11006,ILE_NH2
8,,SING,CB,CG2,,,,,7411,11006,ILE_NH2
9,,SING,CB,HB,,,,,7411,11006,ILE_NH2
10,,SING,CG1,CD1,,,,,7411,11006,ILE_NH2
11,,SING,CG1,HG12,,,,,7411,11006,ILE_NH2
12,,SING,CG1,HG13,,,,,7411,11006,ILE_NH2
13,,SING,CG2,HG21,,,,,7411,11006,ILE_NH2
14,,SING,CG2,HG22,,,,,7411,11006,ILE_NH2
15,,SING,CG2,HG23,,,,,7411,11006,ILE_NH2
16,,SING,CD1,HD11,,,,,7411,11006,ILE_NH2
17,,SING,CD1,HD12,,,,,7411,11006,ILE_NH2
18,,SING,CD1,HD13,,,,,7411,11006,ILE_NH2
19,,SING,C,N2,,,,,7411,11006,ILE_NH2
20,,SING,NT,HT1,,,,,7411,11006,ILE_NH2
21,,SING,NT,HT2,,,,,7411,11006,ILE_NH2
1,,SING,C1,C2,,,,,7412,11006,FUC
2,,SING,C1,O1,,,,,7412,11006,FUC
3,,SING,C1,O5,,,,,7412,11006,FUC
4,,SING,C1,H1,,,,,7412,11006,FUC
5,,SING,C2,C3,,,,,7412,11006,FUC
6,,SING,C2,O2,,,,,7412,11006,FUC
7,,SING,C2,H2,,,,,7412,11006,FUC
8,,SING,C3,C4,,,,,7412,11006,FUC
9,,SING,C3,O3,,,,,7412,11006,FUC
10,,SING,C3,H3,,,,,7412,11006,FUC
11,,SING,C4,C5,,,,,7412,11006,FUC
12,,SING,C4,O4,,,,,7412,11006,FUC
13,,SING,C4,H4,,,,,7412,11006,FUC
14,,SING,C5,C6,,,,,7412,11006,FUC
15,,SING,C5,O5,,,,,7412,11006,FUC
16,,SING,C5,H5,,,,,7412,11006,FUC
17,,SING,C6,H61,,,,,7412,11006,FUC
18,,SING,C6,H62,,,,,7412,11006,FUC
19,,SING,C6,H63,,,,,7412,11006,FUC
20,,SING,O1,HO1,,,,,7412,11006,FUC
21,,SING,O2,HO2,,,,,7412,11006,FUC
22,,SING,O3,HO3,,,,,7412,11006,FUC
23,,SING,O4,HO4,,,,,7412,11006,FUC
1,,SING,C1,C2,,,,,7413,11006,NAG
2,,SING,C1,O1,,,,,7413,11006,NAG
3,,SING,C1,O5,,,,,7413,11006,NAG
4,,SING,C1,H1,,,,,7413,11006,NAG
5,,SING,C2,C3,,,,,7413,11006,NAG
6,,SING,C2,N2,,,,,7413,11006,NAG
7,,SING,C2,H2,,,,,7413,11006,NAG
8,,SING,C3,C4,,,,,7413,11006,NAG
9,,SING,C3,O3,,,,,7413,11006,NAG
10,,SING,C3,H3,,,,,7413,11006,NAG
11,,SING,C4,C5,,,,,7413,11006,NAG
12,,SING,C4,O4,,,,,7413,11006,NAG
13,,SING,C4,H4,,,,,7413,11006,NAG
14,,SING,C5,C6,,,,,7413,11006,NAG
15,,SING,C5,O5,,,,,7413,11006,NAG
16,,SING,C5,H5,,,,,7413,11006,NAG
17,,SING,C6,O6,,,,,7413,11006,NAG
18,,SING,C6,H61,,,,,7413,11006,NAG
19,,SING,C6,H62,,,,,7413,11006,NAG
20,,SING,C7,C8,,,,,7413,11006,NAG
21,,SING,C7,N2,,,,,7413,11006,NAG
22,,DOUB,C7,O7,,,,,7413,11006,NAG
23,,SING,C8,H81,,,,,7413,11006,NAG
24,,SING,C8,H82,,,,,7413,11006,NAG
25,,SING,C8,H83,,,,,7413,11006,NAG
26,,SING,N2,HN2,,,,,7413,11006,NAG
27,,SING,O1,HO1,,,,,7413,11006,NAG
28,,SING,O3,HO3,,,,,7413,11006,NAG
29,,SING,O4,HO4,,,,,7413,11006,NAG
30,,SING,O6,HO6,,,,,7413,11006,NAG
1,,DOUB,PG,O1G,,,,,7509,11010,GCP
2,,SING,PG,O2G,,,,,7509,11010,GCP
3,,SING,PG,O3G,,,,,7509,11010,GCP
4,,SING,PG,C3B,,,,,7509,11010,GCP
5,,SING,O2G,HOG2,,,,,7509,11010,GCP
6,,SING,O3G,HOG3,,,,,7509,11010,GCP
7,,SING,C3B,PB,,,,,7509,11010,GCP
8,,SING,C3B,H3B1,,,,,7509,11010,GCP
9,,SING,C3B,H3B2,,,,,7509,11010,GCP
10,,DOUB,PB,O1B,,,,,7509,11010,GCP
11,,SING,PB,O2B,,,,,7509,11010,GCP
12,,SING,PB,O3A,,,,,7509,11010,GCP
13,,SING,O2B,HOB2,,,,,7509,11010,GCP
14,,SING,O3A,PA,,,,,7509,11010,GCP
15,,DOUB,PA,O1A,,,,,7509,11010,GCP
16,,SING,PA,O2A,,,,,7509,11010,GCP
17,,SING,PA,O5',,,,,7509,11010,GCP
18,,SING,O2A,HOA2,,,,,7509,11010,GCP
19,,SING,O5',C5',,,,,7509,11010,GCP
20,,SING,C5',C4',,,,,7509,11010,GCP
21,,SING,C5',H5'2,,,,,7509,11010,GCP
22,,SING,C5',H5'1,,,,,7509,11010,GCP
23,,SING,C4',O4',,,,,7509,11010,GCP
24,,SING,C4',C3',,,,,7509,11010,GCP
25,,SING,C4',H4',,,,,7509,11010,GCP
26,,SING,O4',C1',,,,,7509,11010,GCP
27,,SING,C3',O3',,,,,7509,11010,GCP
28,,SING,C3',C2',,,,,7509,11010,GCP
29,,SING,C3',H3',,,,,7509,11010,GCP
30,,SING,O3',HO3',,,,,7509,11010,GCP
31,,SING,C2',O2',,,,,7509,11010,GCP
32,,SING,C2',C1',,,,,7509,11010,GCP
33,,SING,C2',H2',,,,,7509,11010,GCP
34,,SING,O2',HO2',,,,,7509,11010,GCP
35,,SING,C1',N9,,,,,7509,11010,GCP
36,,SING,C1',H1',,,,,7509,11010,GCP
37,,SING,N9,C8,,,,,7509,11010,GCP
38,,SING,N9,C4,,,,,7509,11010,GCP
39,,DOUB,C8,N7,,,,,7509,11010,GCP
40,,SING,C8,H8,,,,,7509,11010,GCP
41,,SING,N7,C5,,,,,7509,11010,GCP
42,,SING,C5,C6,,,,,7509,11010,GCP
43,,DOUB,C5,C4,,,,,7509,11010,GCP
44,,DOUB,C6,O6,,,,,7509,11010,GCP
45,,SING,C6,N1,,,,,7509,11010,GCP
46,,SING,N1,C2,,,,,7509,11010,GCP
47,,SING,N1,HN1,,,,,7509,11010,GCP
48,,SING,C2,N2,,,,,7509,11010,GCP
49,,DOUB,C2,N3,,,,,7509,11010,GCP
50,,SING,N2,HN21,,,,,7509,11010,GCP
51,,SING,N2,HN22,,,,,7509,11010,GCP
52,,SING,N3,C4,,,,,7509,11010,GCP
1,,SING,C1,C2,,,,,8292,11053,1
2,,DOUB,C1,C6,,,,,8292,11053,1
3,,DOUB,C2,C3,,,,,8292,11053,1
4,,SING,C3,C4,,,,,8292,11053,1
5,,DOUB,C4,C5,,,,,8292,11053,1
6,,SING,C5,C6,,,,,8292,11053,1
7,,SING,C1,C7,,,,,8292,11053,1
8,,SING,C4,C8,,,,,8292,11053,1
9,,SING,C5,C9,,,,,8292,11053,1
10,,SING,C2,C10,,,,,8292,11053,1
11,,SING,C10,S1,,,,,8292,11053,1
12,,SING,C9,S2,,,,,8292,11053,1
13,,SING,S1,C11,,,,,8292,11053,1
14,,SING,S2,C12,,,,,8292,11053,1
15,,SING,C11,N1,,,,,8292,11053,1
16,,DOUB,C11,N2,,,,,8292,11053,1
17,,DOUB,C12,N3,,,,,8292,11053,1
18,,SING,C12,N4,,,,,8292,11053,1
19,,SING,C3,H1,,,,,8292,11053,1
20,,SING,C6,H2,,,,,8292,11053,1
21,,SING,C7,H3,,,,,8292,11053,1
22,,SING,C7,H4,,,,,8292,11053,1
23,,SING,C7,H5,,,,,8292,11053,1
24,,SING,C8,H6,,,,,8292,11053,1
25,,SING,C8,H7,,,,,8292,11053,1
26,,SING,C8,H8,,,,,8292,11053,1
27,,SING,C9,H9,,,,,8292,11053,1
28,,SING,C9,H10,,,,,8292,11053,1
29,,SING,C10,H11,,,,,8292,11053,1
30,,SING,C10,H12,,,,,8292,11053,1
31,,SING,N1,H13,,,,,8292,11053,1
32,,SING,N1,H14,,,,,8292,11053,1
33,,SING,N2,H15,,,,,8292,11053,1
34,,SING,N2,H16,,,,,8292,11053,1
35,,SING,N3,H17,,,,,8292,11053,1
36,,SING,N3,H18,,,,,8292,11053,1
37,,SING,N4,H19,,,,,8292,11053,1
38,,SING,N4,H20,,,,,8292,11053,1
1,,SING,N,CA,,,,,8380,11058,LYS_NH2
2,,SING,N,H,,,,,8380,11058,LYS_NH2
3,,SING,CA,C,,,,,8380,11058,LYS_NH2
4,,SING,CA,CB,,,,,8380,11058,LYS_NH2
5,,SING,CA,HA,,,,,8380,11058,LYS_NH2
6,,DOUB,C,O,,,,,8380,11058,LYS_NH2
7,,SING,CB,CG,,,,,8380,11058,LYS_NH2
8,,SING,CB,HB2,,,,,8380,11058,LYS_NH2
9,,SING,CB,HB3,,,,,8380,11058,LYS_NH2
10,,SING,CG,CD,,,,,8380,11058,LYS_NH2
11,,SING,CG,HG2,,,,,8380,11058,LYS_NH2
12,,SING,CG,HG3,,,,,8380,11058,LYS_NH2
13,,SING,CD,CE,,,,,8380,11058,LYS_NH2
14,,SING,CD,HD2,,,,,8380,11058,LYS_NH2
15,,SING,CD,HD3,,,,,8380,11058,LYS_NH2
16,,SING,CE,NZ,,,,,8380,11058,LYS_NH2
17,,SING,CE,HE2,,,,,8380,11058,LYS_NH2
18,,SING,CE,HE3,,,,,8380,11058,LYS_NH2
19,,SING,NZ,HZ1,,,,,8380,11058,LYS_NH2
20,,SING,NZ,HZ2,,,,,8380,11058,LYS_NH2
21,,SING,NZ,HZ3,,,,,8380,11058,LYS_NH2
22,,SING,NT,C,,,,,8380,11058,LYS_NH2
23,,SING,NT,HT1,,,,,8380,11058,LYS_NH2
24,,SING,NT,HT2,,,,,8380,11058,LYS_NH2
1,,SING,N,HN1,no,N,1,,8398,11059,NH2
2,,SING,N,HN2,no,N,2,,8398,11059,NH2
1,,SING,C1,C2,no,N,1,,8578,1107,AAC
2,,SING,C1,O1,no,N,2,,8578,1107,AAC
3,,DOUB,C1,O2,no,N,3,,8578,1107,AAC
4,,SING,C2,N1,no,N,4,,8578,1107,AAC
5,,SING,C2,HC21,no,N,5,,8578,1107,AAC
6,,SING,C2,HC22,no,N,6,,8578,1107,AAC
7,,SING,C3,C4,no,N,7,,8578,1107,AAC
8,,SING,C3,N1,no,N,8,,8578,1107,AAC
9,,DOUB,C3,O3,no,N,9,,8578,1107,AAC
10,,SING,C4,HC41,no,N,10,,8578,1107,AAC
11,,SING,C4,HC42,no,N,11,,8578,1107,AAC
12,,SING,C4,HC43,no,N,12,,8578,1107,AAC
13,,SING,N1,HN1,no,N,13,,8578,1107,AAC
14,,SING,O1,HO1,no,N,14,,8578,1107,AAC
1,,SING,FE,NA,no,N,1,,8579,1107,HEC
2,,SING,FE,NB,no,N,2,,8579,1107,HEC
3,,SING,FE,NC,no,N,3,,8579,1107,HEC
4,,SING,FE,ND,no,N,4,,8579,1107,HEC
5,,DOUB,CHA,C1A,no,N,5,,8579,1107,HEC
6,,SING,CHA,C4D,no,N,6,,8579,1107,HEC
7,,SING,CHA,HHA,no,N,7,,8579,1107,HEC
8,,DOUB,CHB,C4A,no,N,8,,8579,1107,HEC
9,,SING,CHB,C1B,no,N,9,,8579,1107,HEC
10,,SING,CHB,HHB,no,N,10,,8579,1107,HEC
11,,DOUB,CHC,C4B,no,N,11,,8579,1107,HEC
12,,SING,CHC,C1C,no,N,12,,8579,1107,HEC
13,,SING,CHC,HHC,no,N,13,,8579,1107,HEC
14,,DOUB,CHD,C4C,no,N,14,,8579,1107,HEC
15,,SING,CHD,C1D,no,N,15,,8579,1107,HEC
16,,SING,CHD,HHD,no,N,16,,8579,1107,HEC
17,,SING,NA,C1A,yes,N,17,,8579,1107,HEC
18,,SING,NA,C4A,yes,N,18,,8579,1107,HEC
19,,SING,C1A,C2A,yes,N,19,,8579,1107,HEC
20,,DOUB,C2A,C3A,yes,N,20,,8579,1107,HEC
21,,SING,C2A,CAA,no,N,21,,8579,1107,HEC
22,,SING,C3A,C4A,yes,N,22,,8579,1107,HEC
23,,SING,C3A,CMA,no,N,23,,8579,1107,HEC
24,,SING,CMA,HMA1,no,N,24,,8579,1107,HEC
25,,SING,CMA,HMA2,no,N,25,,8579,1107,HEC
26,,SING,CMA,HMA3,no,N,26,,8579,1107,HEC
27,,SING,CAA,CBA,no,N,27,,8579,1107,HEC
28,,SING,CAA,HAA1,no,N,28,,8579,1107,HEC
29,,SING,CAA,HAA2,no,N,29,,8579,1107,HEC
30,,SING,CBA,CGA,no,N,30,,8579,1107,HEC
31,,SING,CBA,HBA1,no,N,31,,8579,1107,HEC
32,,SING,CBA,HBA2,no,N,32,,8579,1107,HEC
33,,DOUB,CGA,O1A,no,N,33,,8579,1107,HEC
34,,SING,CGA,O2A,no,N,34,,8579,1107,HEC
35,,SING,O2A,H2A,no,N,35,,8579,1107,HEC
36,,SING,NB,C1B,yes,N,36,,8579,1107,HEC
37,,SING,NB,C4B,yes,N,37,,8579,1107,HEC
38,,DOUB,C1B,C2B,yes,N,38,,8579,1107,HEC
39,,SING,C2B,C3B,yes,N,39,,8579,1107,HEC
40,,SING,C2B,CMB,no,N,40,,8579,1107,HEC
41,,SING,C3B,C4B,yes,N,41,,8579,1107,HEC
42,,DOUB,C3B,CAB,no,E,42,,8579,1107,HEC
43,,SING,CMB,HMB1,no,N,43,,8579,1107,HEC
44,,SING,CMB,HMB2,no,N,44,,8579,1107,HEC
45,,SING,CMB,HMB3,no,N,45,,8579,1107,HEC
46,,SING,CAB,CBB,no,N,46,,8579,1107,HEC
47,,SING,CAB,HAB,no,N,47,,8579,1107,HEC
48,,SING,CBB,HBB1,no,N,48,,8579,1107,HEC
49,,SING,CBB,HBB2,no,N,49,,8579,1107,HEC
50,,SING,CBB,HBB3,no,N,50,,8579,1107,HEC
51,,SING,NC,C1C,yes,N,51,,8579,1107,HEC
52,,SING,NC,C4C,yes,N,52,,8579,1107,HEC
53,,DOUB,C1C,C2C,yes,N,53,,8579,1107,HEC
54,,SING,C2C,C3C,yes,N,54,,8579,1107,HEC
55,,SING,C2C,CMC,no,N,55,,8579,1107,HEC
56,,SING,C3C,C4C,yes,N,56,,8579,1107,HEC
57,,DOUB,C3C,CAC,no,E,57,,8579,1107,HEC
58,,SING,CMC,HMC1,no,N,58,,8579,1107,HEC
59,,SING,CMC,HMC2,no,N,59,,8579,1107,HEC
60,,SING,CMC,HMC3,no,N,60,,8579,1107,HEC
61,,SING,CAC,CBC,no,N,61,,8579,1107,HEC
62,,SING,CAC,HAC,no,N,62,,8579,1107,HEC
63,,SING,CBC,HBC1,no,N,63,,8579,1107,HEC
64,,SING,CBC,HBC2,no,N,64,,8579,1107,HEC
65,,SING,CBC,HBC3,no,N,65,,8579,1107,HEC
66,,SING,ND,C1D,yes,N,66,,8579,1107,HEC
67,,SING,ND,C4D,yes,N,67,,8579,1107,HEC
68,,DOUB,C1D,C2D,yes,N,68,,8579,1107,HEC
69,,SING,C2D,C3D,yes,N,69,,8579,1107,HEC
70,,SING,C2D,CMD,no,N,70,,8579,1107,HEC
71,,DOUB,C3D,C4D,yes,N,71,,8579,1107,HEC
72,,SING,C3D,CAD,no,N,72,,8579,1107,HEC
73,,SING,CMD,HMD1,no,N,73,,8579,1107,HEC
74,,SING,CMD,HMD2,no,N,74,,8579,1107,HEC
75,,SING,CMD,HMD3,no,N,75,,8579,1107,HEC
76,,SING,CAD,CBD,no,N,76,,8579,1107,HEC
77,,SING,CAD,HAD1,no,N,77,,8579,1107,HEC
78,,SING,CAD,HAD2,no,N,78,,8579,1107,HEC
79,,SING,CBD,CGD,no,N,79,,8579,1107,HEC
80,,SING,CBD,HBD1,no,N,80,,8579,1107,HEC
81,,SING,CBD,HBD2,no,N,81,,8579,1107,HEC
82,,DOUB,CGD,O1D,no,N,82,,8579,1107,HEC
83,,SING,CGD,O2D,no,N,83,,8579,1107,HEC
84,,SING,O2D,H2D,no,N,84,,8579,1107,HEC
1,,DOUB,C1,O2,no,N,1,,8629,11073,JH3
2,,SING,C1,O1,no,N,2,,8629,11073,JH3
3,,SING,C1,C2,no,N,3,,8629,11073,JH3
4,,SING,O1,CM,no,N,4,,8629,11073,JH3
5,,SING,CM,HM,no,N,5,,8629,11073,JH3
6,,SING,CM,HMA,no,N,6,,8629,11073,JH3
7,,SING,CM,HMB,no,N,7,,8629,11073,JH3
8,,DOUB,C2,C3,no,E,8,,8629,11073,JH3
9,,SING,C2,H2,no,N,9,,8629,11073,JH3
10,,SING,C3,C3',no,N,10,,8629,11073,JH3
11,,SING,C3,C4,no,N,11,,8629,11073,JH3
12,,SING,C3',H3',no,N,12,,8629,11073,JH3
13,,SING,C3',H3'A,no,N,13,,8629,11073,JH3
14,,SING,C3',H3'B,no,N,14,,8629,11073,JH3
15,,SING,C4,C5,no,N,15,,8629,11073,JH3
16,,SING,C4,H4,no,N,16,,8629,11073,JH3
17,,SING,C4,H4A,no,N,17,,8629,11073,JH3
18,,SING,C5,C6,no,N,18,,8629,11073,JH3
19,,SING,C5,H5,no,N,19,,8629,11073,JH3
20,,SING,C5,H5A,no,N,20,,8629,11073,JH3
21,,DOUB,C6,C7,no,E,21,,8629,11073,JH3
22,,SING,C6,H6,no,N,22,,8629,11073,JH3
23,,SING,C7,C7',no,N,23,,8629,11073,JH3
24,,SING,C7,C8,no,N,24,,8629,11073,JH3
25,,SING,C7',H7',no,N,25,,8629,11073,JH3
26,,SING,C7',H7'A,no,N,26,,8629,11073,JH3
27,,SING,C7',H7'B,no,N,27,,8629,11073,JH3
28,,SING,C8,C9,no,N,28,,8629,11073,JH3
29,,SING,C8,H8,no,N,29,,8629,11073,JH3
30,,SING,C8,H8A,no,N,30,,8629,11073,JH3
31,,SING,C9,CA,no,N,31,,8629,11073,JH3
32,,SING,C9,H9,no,N,32,,8629,11073,JH3
33,,SING,C9,H9A,no,N,33,,8629,11073,JH3
34,,SING,CA,O3,no,N,34,,8629,11073,JH3
35,,SING,CA,CB,no,N,35,,8629,11073,JH3
36,,SING,CA,HA,no,N,36,,8629,11073,JH3
37,,SING,O3,CB,no,N,37,,8629,11073,JH3
38,,SING,CB,CB',no,N,38,,8629,11073,JH3
39,,SING,CB,CC,no,N,39,,8629,11073,JH3
40,,SING,CB',HB',no,N,40,,8629,11073,JH3
41,,SING,CB',HB'A,no,N,41,,8629,11073,JH3
42,,SING,CB',HB'B,no,N,42,,8629,11073,JH3
43,,SING,CC,HC,no,N,43,,8629,11073,JH3
44,,SING,CC,HCA,no,N,44,,8629,11073,JH3
45,,SING,CC,HCB,no,N,45,,8629,11073,JH3
1,,SING,C1,C2,no,N,1,,8759,1108,AAC
2,,SING,C1,O1,no,N,2,,8759,1108,AAC
3,,DOUB,C1,O2,no,N,3,,8759,1108,AAC
4,,SING,C2,N1,no,N,4,,8759,1108,AAC
5,,SING,C2,HC21,no,N,5,,8759,1108,AAC
6,,SING,C2,HC22,no,N,6,,8759,1108,AAC
7,,SING,C3,C4,no,N,7,,8759,1108,AAC
8,,SING,C3,N1,no,N,8,,8759,1108,AAC
9,,DOUB,C3,O3,no,N,9,,8759,1108,AAC
10,,SING,C4,HC41,no,N,10,,8759,1108,AAC
11,,SING,C4,HC42,no,N,11,,8759,1108,AAC
12,,SING,C4,HC43,no,N,12,,8759,1108,AAC
13,,SING,N1,HN1,no,N,13,,8759,1108,AAC
14,,SING,O1,HO1,no,N,14,,8759,1108,AAC
1,,SING,FE,NA,no,N,1,,8760,1108,HEC
2,,SING,FE,NB,no,N,2,,8760,1108,HEC
3,,SING,FE,NC,no,N,3,,8760,1108,HEC
4,,SING,FE,ND,no,N,4,,8760,1108,HEC
5,,DOUB,CHA,C1A,no,N,5,,8760,1108,HEC
6,,SING,CHA,C4D,no,N,6,,8760,1108,HEC
7,,SING,CHA,HHA,no,N,7,,8760,1108,HEC
8,,DOUB,CHB,C4A,no,N,8,,8760,1108,HEC
9,,SING,CHB,C1B,no,N,9,,8760,1108,HEC
10,,SING,CHB,HHB,no,N,10,,8760,1108,HEC
11,,DOUB,CHC,C4B,no,N,11,,8760,1108,HEC
12,,SING,CHC,C1C,no,N,12,,8760,1108,HEC
13,,SING,CHC,HHC,no,N,13,,8760,1108,HEC
14,,DOUB,CHD,C4C,no,N,14,,8760,1108,HEC
15,,SING,CHD,C1D,no,N,15,,8760,1108,HEC
16,,SING,CHD,HHD,no,N,16,,8760,1108,HEC
17,,SING,NA,C1A,yes,N,17,,8760,1108,HEC
18,,SING,NA,C4A,yes,N,18,,8760,1108,HEC
19,,SING,C1A,C2A,yes,N,19,,8760,1108,HEC
20,,DOUB,C2A,C3A,yes,N,20,,8760,1108,HEC
21,,SING,C2A,CAA,no,N,21,,8760,1108,HEC
22,,SING,C3A,C4A,yes,N,22,,8760,1108,HEC
23,,SING,C3A,CMA,no,N,23,,8760,1108,HEC
24,,SING,CMA,HMA1,no,N,24,,8760,1108,HEC
25,,SING,CMA,HMA2,no,N,25,,8760,1108,HEC
26,,SING,CMA,HMA3,no,N,26,,8760,1108,HEC
27,,SING,CAA,CBA,no,N,27,,8760,1108,HEC
28,,SING,CAA,HAA1,no,N,28,,8760,1108,HEC
29,,SING,CAA,HAA2,no,N,29,,8760,1108,HEC
30,,SING,CBA,CGA,no,N,30,,8760,1108,HEC
31,,SING,CBA,HBA1,no,N,31,,8760,1108,HEC
32,,SING,CBA,HBA2,no,N,32,,8760,1108,HEC
33,,DOUB,CGA,O1A,no,N,33,,8760,1108,HEC
34,,SING,CGA,O2A,no,N,34,,8760,1108,HEC
35,,SING,O2A,H2A,no,N,35,,8760,1108,HEC
36,,SING,NB,C1B,yes,N,36,,8760,1108,HEC
37,,SING,NB,C4B,yes,N,37,,8760,1108,HEC
38,,DOUB,C1B,C2B,yes,N,38,,8760,1108,HEC
39,,SING,C2B,C3B,yes,N,39,,8760,1108,HEC
40,,SING,C2B,CMB,no,N,40,,8760,1108,HEC
41,,SING,C3B,C4B,yes,N,41,,8760,1108,HEC
42,,DOUB,C3B,CAB,no,E,42,,8760,1108,HEC
43,,SING,CMB,HMB1,no,N,43,,8760,1108,HEC
44,,SING,CMB,HMB2,no,N,44,,8760,1108,HEC
45,,SING,CMB,HMB3,no,N,45,,8760,1108,HEC
46,,SING,CAB,CBB,no,N,46,,8760,1108,HEC
47,,SING,CAB,HAB,no,N,47,,8760,1108,HEC
48,,SING,CBB,HBB1,no,N,48,,8760,1108,HEC
49,,SING,CBB,HBB2,no,N,49,,8760,1108,HEC
50,,SING,CBB,HBB3,no,N,50,,8760,1108,HEC
51,,SING,NC,C1C,yes,N,51,,8760,1108,HEC
52,,SING,NC,C4C,yes,N,52,,8760,1108,HEC
53,,DOUB,C1C,C2C,yes,N,53,,8760,1108,HEC
54,,SING,C2C,C3C,yes,N,54,,8760,1108,HEC
55,,SING,C2C,CMC,no,N,55,,8760,1108,HEC
56,,SING,C3C,C4C,yes,N,56,,8760,1108,HEC
57,,DOUB,C3C,CAC,no,E,57,,8760,1108,HEC
58,,SING,CMC,HMC1,no,N,58,,8760,1108,HEC
59,,SING,CMC,HMC2,no,N,59,,8760,1108,HEC
60,,SING,CMC,HMC3,no,N,60,,8760,1108,HEC
61,,SING,CAC,CBC,no,N,61,,8760,1108,HEC
62,,SING,CAC,HAC,no,N,62,,8760,1108,HEC
63,,SING,CBC,HBC1,no,N,63,,8760,1108,HEC
64,,SING,CBC,HBC2,no,N,64,,8760,1108,HEC
65,,SING,CBC,HBC3,no,N,65,,8760,1108,HEC
66,,SING,ND,C1D,yes,N,66,,8760,1108,HEC
67,,SING,ND,C4D,yes,N,67,,8760,1108,HEC
68,,DOUB,C1D,C2D,yes,N,68,,8760,1108,HEC
69,,SING,C2D,C3D,yes,N,69,,8760,1108,HEC
70,,SING,C2D,CMD,no,N,70,,8760,1108,HEC
71,,DOUB,C3D,C4D,yes,N,71,,8760,1108,HEC
72,,SING,C3D,CAD,no,N,72,,8760,1108,HEC
73,,SING,CMD,HMD1,no,N,73,,8760,1108,HEC
74,,SING,CMD,HMD2,no,N,74,,8760,1108,HEC
75,,SING,CMD,HMD3,no,N,75,,8760,1108,HEC
76,,SING,CAD,CBD,no,N,76,,8760,1108,HEC
77,,SING,CAD,HAD1,no,N,77,,8760,1108,HEC
78,,SING,CAD,HAD2,no,N,78,,8760,1108,HEC
79,,SING,CBD,CGD,no,N,79,,8760,1108,HEC
80,,SING,CBD,HBD1,no,N,80,,8760,1108,HEC
81,,SING,CBD,HBD2,no,N,81,,8760,1108,HEC
82,,DOUB,CGD,O1D,no,N,82,,8760,1108,HEC
83,,SING,CGD,O2D,no,N,83,,8760,1108,HEC
84,,SING,O2D,H2D,no,N,84,,8760,1108,HEC
1,,SING,C1,C2,no,N,1,,8970,1109,AAC
2,,SING,C1,O1,no,N,2,,8970,1109,AAC
3,,DOUB,C1,O2,no,N,3,,8970,1109,AAC
4,,SING,C2,N1,no,N,4,,8970,1109,AAC
5,,SING,C2,HC21,no,N,5,,8970,1109,AAC
6,,SING,C2,HC22,no,N,6,,8970,1109,AAC
7,,SING,C3,C4,no,N,7,,8970,1109,AAC
8,,SING,C3,N1,no,N,8,,8970,1109,AAC
9,,DOUB,C3,O3,no,N,9,,8970,1109,AAC
10,,SING,C4,HC41,no,N,10,,8970,1109,AAC
11,,SING,C4,HC42,no,N,11,,8970,1109,AAC
12,,SING,C4,HC43,no,N,12,,8970,1109,AAC
13,,SING,N1,HN1,no,N,13,,8970,1109,AAC
14,,SING,O1,HO1,no,N,14,,8970,1109,AAC
1,,SING,FE,NA,no,N,1,,8971,1109,HEC
2,,SING,FE,NB,no,N,2,,8971,1109,HEC
3,,SING,FE,NC,no,N,3,,8971,1109,HEC
4,,SING,FE,ND,no,N,4,,8971,1109,HEC
5,,DOUB,CHA,C1A,no,N,5,,8971,1109,HEC
6,,SING,CHA,C4D,no,N,6,,8971,1109,HEC
7,,SING,CHA,HHA,no,N,7,,8971,1109,HEC
8,,DOUB,CHB,C4A,no,N,8,,8971,1109,HEC
9,,SING,CHB,C1B,no,N,9,,8971,1109,HEC
10,,SING,CHB,HHB,no,N,10,,8971,1109,HEC
11,,DOUB,CHC,C4B,no,N,11,,8971,1109,HEC
12,,SING,CHC,C1C,no,N,12,,8971,1109,HEC
13,,SING,CHC,HHC,no,N,13,,8971,1109,HEC
14,,DOUB,CHD,C4C,no,N,14,,8971,1109,HEC
15,,SING,CHD,C1D,no,N,15,,8971,1109,HEC
16,,SING,CHD,HHD,no,N,16,,8971,1109,HEC
17,,SING,NA,C1A,yes,N,17,,8971,1109,HEC
18,,SING,NA,C4A,yes,N,18,,8971,1109,HEC
19,,SING,C1A,C2A,yes,N,19,,8971,1109,HEC
20,,DOUB,C2A,C3A,yes,N,20,,8971,1109,HEC
21,,SING,C2A,CAA,no,N,21,,8971,1109,HEC
22,,SING,C3A,C4A,yes,N,22,,8971,1109,HEC
23,,SING,C3A,CMA,no,N,23,,8971,1109,HEC
24,,SING,CMA,HMA1,no,N,24,,8971,1109,HEC
25,,SING,CMA,HMA2,no,N,25,,8971,1109,HEC
26,,SING,CMA,HMA3,no,N,26,,8971,1109,HEC
27,,SING,CAA,CBA,no,N,27,,8971,1109,HEC
28,,SING,CAA,HAA1,no,N,28,,8971,1109,HEC
29,,SING,CAA,HAA2,no,N,29,,8971,1109,HEC
30,,SING,CBA,CGA,no,N,30,,8971,1109,HEC
31,,SING,CBA,HBA1,no,N,31,,8971,1109,HEC
32,,SING,CBA,HBA2,no,N,32,,8971,1109,HEC
33,,DOUB,CGA,O1A,no,N,33,,8971,1109,HEC
34,,SING,CGA,O2A,no,N,34,,8971,1109,HEC
35,,SING,O2A,H2A,no,N,35,,8971,1109,HEC
36,,SING,NB,C1B,yes,N,36,,8971,1109,HEC
37,,SING,NB,C4B,yes,N,37,,8971,1109,HEC
38,,DOUB,C1B,C2B,yes,N,38,,8971,1109,HEC
39,,SING,C2B,C3B,yes,N,39,,8971,1109,HEC
40,,SING,C2B,CMB,no,N,40,,8971,1109,HEC
41,,SING,C3B,C4B,yes,N,41,,8971,1109,HEC
42,,DOUB,C3B,CAB,no,E,42,,8971,1109,HEC
43,,SING,CMB,HMB1,no,N,43,,8971,1109,HEC
44,,SING,CMB,HMB2,no,N,44,,8971,1109,HEC
45,,SING,CMB,HMB3,no,N,45,,8971,1109,HEC
46,,SING,CAB,CBB,no,N,46,,8971,1109,HEC
47,,SING,CAB,HAB,no,N,47,,8971,1109,HEC
48,,SING,CBB,HBB1,no,N,48,,8971,1109,HEC
49,,SING,CBB,HBB2,no,N,49,,8971,1109,HEC
50,,SING,CBB,HBB3,no,N,50,,8971,1109,HEC
51,,SING,NC,C1C,yes,N,51,,8971,1109,HEC
52,,SING,NC,C4C,yes,N,52,,8971,1109,HEC
53,,DOUB,C1C,C2C,yes,N,53,,8971,1109,HEC
54,,SING,C2C,C3C,yes,N,54,,8971,1109,HEC
55,,SING,C2C,CMC,no,N,55,,8971,1109,HEC
56,,SING,C3C,C4C,yes,N,56,,8971,1109,HEC
57,,DOUB,C3C,CAC,no,E,57,,8971,1109,HEC
58,,SING,CMC,HMC1,no,N,58,,8971,1109,HEC
59,,SING,CMC,HMC2,no,N,59,,8971,1109,HEC
60,,SING,CMC,HMC3,no,N,60,,8971,1109,HEC
61,,SING,CAC,CBC,no,N,61,,8971,1109,HEC
62,,SING,CAC,HAC,no,N,62,,8971,1109,HEC
63,,SING,CBC,HBC1,no,N,63,,8971,1109,HEC
64,,SING,CBC,HBC2,no,N,64,,8971,1109,HEC
65,,SING,CBC,HBC3,no,N,65,,8971,1109,HEC
66,,SING,ND,C1D,yes,N,66,,8971,1109,HEC
67,,SING,ND,C4D,yes,N,67,,8971,1109,HEC
68,,DOUB,C1D,C2D,yes,N,68,,8971,1109,HEC
69,,SING,C2D,C3D,yes,N,69,,8971,1109,HEC
70,,SING,C2D,CMD,no,N,70,,8971,1109,HEC
71,,DOUB,C3D,C4D,yes,N,71,,8971,1109,HEC
72,,SING,C3D,CAD,no,N,72,,8971,1109,HEC
73,,SING,CMD,HMD1,no,N,73,,8971,1109,HEC
74,,SING,CMD,HMD2,no,N,74,,8971,1109,HEC
75,,SING,CMD,HMD3,no,N,75,,8971,1109,HEC
76,,SING,CAD,CBD,no,N,76,,8971,1109,HEC
77,,SING,CAD,HAD1,no,N,77,,8971,1109,HEC
78,,SING,CAD,HAD2,no,N,78,,8971,1109,HEC
79,,SING,CBD,CGD,no,N,79,,8971,1109,HEC
80,,SING,CBD,HBD1,no,N,80,,8971,1109,HEC
81,,SING,CBD,HBD2,no,N,81,,8971,1109,HEC
82,,DOUB,CGD,O1D,no,N,82,,8971,1109,HEC
83,,SING,CGD,O2D,no,N,83,,8971,1109,HEC
84,,SING,O2D,H2D,no,N,84,,8971,1109,HEC
1,,SING,C1,C2,no,N,1,,9169,1110,AAC
2,,SING,C1,O1,no,N,2,,9169,1110,AAC
3,,DOUB,C1,O2,no,N,3,,9169,1110,AAC
4,,SING,C2,N1,no,N,4,,9169,1110,AAC
5,,SING,C2,HC21,no,N,5,,9169,1110,AAC
6,,SING,C2,HC22,no,N,6,,9169,1110,AAC
7,,SING,C3,C4,no,N,7,,9169,1110,AAC
8,,SING,C3,N1,no,N,8,,9169,1110,AAC
9,,DOUB,C3,O3,no,N,9,,9169,1110,AAC
10,,SING,C4,HC41,no,N,10,,9169,1110,AAC
11,,SING,C4,HC42,no,N,11,,9169,1110,AAC
12,,SING,C4,HC43,no,N,12,,9169,1110,AAC
13,,SING,N1,HN1,no,N,13,,9169,1110,AAC
14,,SING,O1,HO1,no,N,14,,9169,1110,AAC
1,,SING,FE,NA,no,N,1,,9170,1110,HEC
2,,SING,FE,NB,no,N,2,,9170,1110,HEC
3,,SING,FE,NC,no,N,3,,9170,1110,HEC
4,,SING,FE,ND,no,N,4,,9170,1110,HEC
5,,DOUB,CHA,C1A,no,N,5,,9170,1110,HEC
6,,SING,CHA,C4D,no,N,6,,9170,1110,HEC
7,,SING,CHA,HHA,no,N,7,,9170,1110,HEC
8,,DOUB,CHB,C4A,no,N,8,,9170,1110,HEC
9,,SING,CHB,C1B,no,N,9,,9170,1110,HEC
10,,SING,CHB,HHB,no,N,10,,9170,1110,HEC
11,,DOUB,CHC,C4B,no,N,11,,9170,1110,HEC
12,,SING,CHC,C1C,no,N,12,,9170,1110,HEC
13,,SING,CHC,HHC,no,N,13,,9170,1110,HEC
14,,DOUB,CHD,C4C,no,N,14,,9170,1110,HEC
15,,SING,CHD,C1D,no,N,15,,9170,1110,HEC
16,,SING,CHD,HHD,no,N,16,,9170,1110,HEC
17,,SING,NA,C1A,yes,N,17,,9170,1110,HEC
18,,SING,NA,C4A,yes,N,18,,9170,1110,HEC
19,,SING,C1A,C2A,yes,N,19,,9170,1110,HEC
20,,DOUB,C2A,C3A,yes,N,20,,9170,1110,HEC
21,,SING,C2A,CAA,no,N,21,,9170,1110,HEC
22,,SING,C3A,C4A,yes,N,22,,9170,1110,HEC
23,,SING,C3A,CMA,no,N,23,,9170,1110,HEC
24,,SING,CMA,HMA1,no,N,24,,9170,1110,HEC
25,,SING,CMA,HMA2,no,N,25,,9170,1110,HEC
26,,SING,CMA,HMA3,no,N,26,,9170,1110,HEC
27,,SING,CAA,CBA,no,N,27,,9170,1110,HEC
28,,SING,CAA,HAA1,no,N,28,,9170,1110,HEC
29,,SING,CAA,HAA2,no,N,29,,9170,1110,HEC
30,,SING,CBA,CGA,no,N,30,,9170,1110,HEC
31,,SING,CBA,HBA1,no,N,31,,9170,1110,HEC
32,,SING,CBA,HBA2,no,N,32,,9170,1110,HEC
33,,DOUB,CGA,O1A,no,N,33,,9170,1110,HEC
34,,SING,CGA,O2A,no,N,34,,9170,1110,HEC
35,,SING,O2A,H2A,no,N,35,,9170,1110,HEC
36,,SING,NB,C1B,yes,N,36,,9170,1110,HEC
37,,SING,NB,C4B,yes,N,37,,9170,1110,HEC
38,,DOUB,C1B,C2B,yes,N,38,,9170,1110,HEC
39,,SING,C2B,C3B,yes,N,39,,9170,1110,HEC
40,,SING,C2B,CMB,no,N,40,,9170,1110,HEC
41,,SING,C3B,C4B,yes,N,41,,9170,1110,HEC
42,,DOUB,C3B,CAB,no,E,42,,9170,1110,HEC
43,,SING,CMB,HMB1,no,N,43,,9170,1110,HEC
44,,SING,CMB,HMB2,no,N,44,,9170,1110,HEC
45,,SING,CMB,HMB3,no,N,45,,9170,1110,HEC
46,,SING,CAB,CBB,no,N,46,,9170,1110,HEC
47,,SING,CAB,HAB,no,N,47,,9170,1110,HEC
48,,SING,CBB,HBB1,no,N,48,,9170,1110,HEC
49,,SING,CBB,HBB2,no,N,49,,9170,1110,HEC
50,,SING,CBB,HBB3,no,N,50,,9170,1110,HEC
51,,SING,NC,C1C,yes,N,51,,9170,1110,HEC
52,,SING,NC,C4C,yes,N,52,,9170,1110,HEC
53,,DOUB,C1C,C2C,yes,N,53,,9170,1110,HEC
54,,SING,C2C,C3C,yes,N,54,,9170,1110,HEC
55,,SING,C2C,CMC,no,N,55,,9170,1110,HEC
56,,SING,C3C,C4C,yes,N,56,,9170,1110,HEC
57,,DOUB,C3C,CAC,no,E,57,,9170,1110,HEC
58,,SING,CMC,HMC1,no,N,58,,9170,1110,HEC
59,,SING,CMC,HMC2,no,N,59,,9170,1110,HEC
60,,SING,CMC,HMC3,no,N,60,,9170,1110,HEC
61,,SING,CAC,CBC,no,N,61,,9170,1110,HEC
62,,SING,CAC,HAC,no,N,62,,9170,1110,HEC
63,,SING,CBC,HBC1,no,N,63,,9170,1110,HEC
64,,SING,CBC,HBC2,no,N,64,,9170,1110,HEC
65,,SING,CBC,HBC3,no,N,65,,9170,1110,HEC
66,,SING,ND,C1D,yes,N,66,,9170,1110,HEC
67,,SING,ND,C4D,yes,N,67,,9170,1110,HEC
68,,DOUB,C1D,C2D,yes,N,68,,9170,1110,HEC
69,,SING,C2D,C3D,yes,N,69,,9170,1110,HEC
70,,SING,C2D,CMD,no,N,70,,9170,1110,HEC
71,,DOUB,C3D,C4D,yes,N,71,,9170,1110,HEC
72,,SING,C3D,CAD,no,N,72,,9170,1110,HEC
73,,SING,CMD,HMD1,no,N,73,,9170,1110,HEC
74,,SING,CMD,HMD2,no,N,74,,9170,1110,HEC
75,,SING,CMD,HMD3,no,N,75,,9170,1110,HEC
76,,SING,CAD,CBD,no,N,76,,9170,1110,HEC
77,,SING,CAD,HAD1,no,N,77,,9170,1110,HEC
78,,SING,CAD,HAD2,no,N,78,,9170,1110,HEC
79,,SING,CBD,CGD,no,N,79,,9170,1110,HEC
80,,SING,CBD,HBD1,no,N,80,,9170,1110,HEC
81,,SING,CBD,HBD2,no,N,81,,9170,1110,HEC
82,,DOUB,CGD,O1D,no,N,82,,9170,1110,HEC
83,,SING,CGD,O2D,no,N,83,,9170,1110,HEC
84,,SING,O2D,H2D,no,N,84,,9170,1110,HEC
1,,SING,C1,C2,no,N,1,,9365,1111,AAC
2,,SING,C1,O1,no,N,2,,9365,1111,AAC
3,,DOUB,C1,O2,no,N,3,,9365,1111,AAC
4,,SING,C2,N1,no,N,4,,9365,1111,AAC
5,,SING,C2,HC21,no,N,5,,9365,1111,AAC
6,,SING,C2,HC22,no,N,6,,9365,1111,AAC
7,,SING,C3,C4,no,N,7,,9365,1111,AAC
8,,SING,C3,N1,no,N,8,,9365,1111,AAC
9,,DOUB,C3,O3,no,N,9,,9365,1111,AAC
10,,SING,C4,HC41,no,N,10,,9365,1111,AAC
11,,SING,C4,HC42,no,N,11,,9365,1111,AAC
12,,SING,C4,HC43,no,N,12,,9365,1111,AAC
13,,SING,N1,HN1,no,N,13,,9365,1111,AAC
14,,SING,O1,HO1,no,N,14,,9365,1111,AAC
1,,SING,FE,NA,no,N,1,,9366,1111,HEC
2,,SING,FE,NB,no,N,2,,9366,1111,HEC
3,,SING,FE,NC,no,N,3,,9366,1111,HEC
4,,SING,FE,ND,no,N,4,,9366,1111,HEC
5,,DOUB,CHA,C1A,no,N,5,,9366,1111,HEC
6,,SING,CHA,C4D,no,N,6,,9366,1111,HEC
7,,SING,CHA,HHA,no,N,7,,9366,1111,HEC
8,,DOUB,CHB,C4A,no,N,8,,9366,1111,HEC
9,,SING,CHB,C1B,no,N,9,,9366,1111,HEC
10,,SING,CHB,HHB,no,N,10,,9366,1111,HEC
11,,DOUB,CHC,C4B,no,N,11,,9366,1111,HEC
12,,SING,CHC,C1C,no,N,12,,9366,1111,HEC
13,,SING,CHC,HHC,no,N,13,,9366,1111,HEC
14,,DOUB,CHD,C4C,no,N,14,,9366,1111,HEC
15,,SING,CHD,C1D,no,N,15,,9366,1111,HEC
16,,SING,CHD,HHD,no,N,16,,9366,1111,HEC
17,,SING,NA,C1A,yes,N,17,,9366,1111,HEC
18,,SING,NA,C4A,yes,N,18,,9366,1111,HEC
19,,SING,C1A,C2A,yes,N,19,,9366,1111,HEC
20,,DOUB,C2A,C3A,yes,N,20,,9366,1111,HEC
21,,SING,C2A,CAA,no,N,21,,9366,1111,HEC
22,,SING,C3A,C4A,yes,N,22,,9366,1111,HEC
23,,SING,C3A,CMA,no,N,23,,9366,1111,HEC
24,,SING,CMA,HMA1,no,N,24,,9366,1111,HEC
25,,SING,CMA,HMA2,no,N,25,,9366,1111,HEC
26,,SING,CMA,HMA3,no,N,26,,9366,1111,HEC
27,,SING,CAA,CBA,no,N,27,,9366,1111,HEC
28,,SING,CAA,HAA1,no,N,28,,9366,1111,HEC
29,,SING,CAA,HAA2,no,N,29,,9366,1111,HEC
30,,SING,CBA,CGA,no,N,30,,9366,1111,HEC
31,,SING,CBA,HBA1,no,N,31,,9366,1111,HEC
32,,SING,CBA,HBA2,no,N,32,,9366,1111,HEC
33,,DOUB,CGA,O1A,no,N,33,,9366,1111,HEC
34,,SING,CGA,O2A,no,N,34,,9366,1111,HEC
35,,SING,O2A,H2A,no,N,35,,9366,1111,HEC
36,,SING,NB,C1B,yes,N,36,,9366,1111,HEC
37,,SING,NB,C4B,yes,N,37,,9366,1111,HEC
38,,DOUB,C1B,C2B,yes,N,38,,9366,1111,HEC
39,,SING,C2B,C3B,yes,N,39,,9366,1111,HEC
40,,SING,C2B,CMB,no,N,40,,9366,1111,HEC
41,,SING,C3B,C4B,yes,N,41,,9366,1111,HEC
42,,DOUB,C3B,CAB,no,E,42,,9366,1111,HEC
43,,SING,CMB,HMB1,no,N,43,,9366,1111,HEC
44,,SING,CMB,HMB2,no,N,44,,9366,1111,HEC
45,,SING,CMB,HMB3,no,N,45,,9366,1111,HEC
46,,SING,CAB,CBB,no,N,46,,9366,1111,HEC
47,,SING,CAB,HAB,no,N,47,,9366,1111,HEC
48,,SING,CBB,HBB1,no,N,48,,9366,1111,HEC
49,,SING,CBB,HBB2,no,N,49,,9366,1111,HEC
50,,SING,CBB,HBB3,no,N,50,,9366,1111,HEC
51,,SING,NC,C1C,yes,N,51,,9366,1111,HEC
52,,SING,NC,C4C,yes,N,52,,9366,1111,HEC
53,,DOUB,C1C,C2C,yes,N,53,,9366,1111,HEC
54,,SING,C2C,C3C,yes,N,54,,9366,1111,HEC
55,,SING,C2C,CMC,no,N,55,,9366,1111,HEC
56,,SING,C3C,C4C,yes,N,56,,9366,1111,HEC
57,,DOUB,C3C,CAC,no,E,57,,9366,1111,HEC
58,,SING,CMC,HMC1,no,N,58,,9366,1111,HEC
59,,SING,CMC,HMC2,no,N,59,,9366,1111,HEC
60,,SING,CMC,HMC3,no,N,60,,9366,1111,HEC
61,,SING,CAC,CBC,no,N,61,,9366,1111,HEC
62,,SING,CAC,HAC,no,N,62,,9366,1111,HEC
63,,SING,CBC,HBC1,no,N,63,,9366,1111,HEC
64,,SING,CBC,HBC2,no,N,64,,9366,1111,HEC
65,,SING,CBC,HBC3,no,N,65,,9366,1111,HEC
66,,SING,ND,C1D,yes,N,66,,9366,1111,HEC
67,,SING,ND,C4D,yes,N,67,,9366,1111,HEC
68,,DOUB,C1D,C2D,yes,N,68,,9366,1111,HEC
69,,SING,C2D,C3D,yes,N,69,,9366,1111,HEC
70,,SING,C2D,CMD,no,N,70,,9366,1111,HEC
71,,DOUB,C3D,C4D,yes,N,71,,9366,1111,HEC
72,,SING,C3D,CAD,no,N,72,,9366,1111,HEC
73,,SING,CMD,HMD1,no,N,73,,9366,1111,HEC
74,,SING,CMD,HMD2,no,N,74,,9366,1111,HEC
75,,SING,CMD,HMD3,no,N,75,,9366,1111,HEC
76,,SING,CAD,CBD,no,N,76,,9366,1111,HEC
77,,SING,CAD,HAD1,no,N,77,,9366,1111,HEC
78,,SING,CAD,HAD2,no,N,78,,9366,1111,HEC
79,,SING,CBD,CGD,no,N,79,,9366,1111,HEC
80,,SING,CBD,HBD1,no,N,80,,9366,1111,HEC
81,,SING,CBD,HBD2,no,N,81,,9366,1111,HEC
82,,DOUB,CGD,O1D,no,N,82,,9366,1111,HEC
83,,SING,CGD,O2D,no,N,83,,9366,1111,HEC
84,,SING,O2D,H2D,no,N,84,,9366,1111,HEC
1,,SING,N,CA,,,,,9472,11115,M3L
2,,SING,N,H,,,,,9472,11115,M3L
3,,SING,N,H2,,,,,9472,11115,M3L
4,,SING,CA,CB,,,,,9472,11115,M3L
5,,SING,CA,C,,,,,9472,11115,M3L
6,,SING,CA,HA,,,,,9472,11115,M3L
7,,SING,CB,CG,,,,,9472,11115,M3L
8,,SING,CB,HB2,,,,,9472,11115,M3L
9,,SING,CB,HB3,,,,,9472,11115,M3L
10,,SING,CG,CD,,,,,9472,11115,M3L
11,,SING,CG,HG2,,,,,9472,11115,M3L
12,,SING,CG,HG3,,,,,9472,11115,M3L
13,,SING,CD,CE,,,,,9472,11115,M3L
14,,SING,CD,HD2,,,,,9472,11115,M3L
15,,SING,CD,HD3,,,,,9472,11115,M3L
16,,SING,CE,NZ,,,,,9472,11115,M3L
17,,SING,CE,HE2,,,,,9472,11115,M3L
18,,SING,CE,HE3,,,,,9472,11115,M3L
19,,SING,NZ,CM1,,,,,9472,11115,M3L
20,,SING,NZ,CM2,,,,,9472,11115,M3L
21,,SING,NZ,CM3,,,,,9472,11115,M3L
22,,DOUB,C,O,,,,,9472,11115,M3L
23,,SING,C,OXT,,,,,9472,11115,M3L
24,,SING,OXT,HXT,,,,,9472,11115,M3L
25,,SING,CM1,HM11,,,,,9472,11115,M3L
26,,SING,CM1,HM12,,,,,9472,11115,M3L
27,,SING,CM1,HM13,,,,,9472,11115,M3L
28,,SING,CM2,HM21,,,,,9472,11115,M3L
29,,SING,CM2,HM22,,,,,9472,11115,M3L
30,,SING,CM2,HM23,,,,,9472,11115,M3L
31,,SING,CM3,HM31,,,,,9472,11115,M3L
32,,SING,CM3,HM32,,,,,9472,11115,M3L
33,,SING,CM3,HM33,,,,,9472,11115,M3L
1,,SING,C1,C2,no,N,1,,9567,1112,AAC
2,,SING,C1,O1,no,N,2,,9567,1112,AAC
3,,DOUB,C1,O2,no,N,3,,9567,1112,AAC
4,,SING,C2,N1,no,N,4,,9567,1112,AAC
5,,SING,C2,HC21,no,N,5,,9567,1112,AAC
6,,SING,C2,HC22,no,N,6,,9567,1112,AAC
7,,SING,C3,C4,no,N,7,,9567,1112,AAC
8,,SING,C3,N1,no,N,8,,9567,1112,AAC
9,,DOUB,C3,O3,no,N,9,,9567,1112,AAC
10,,SING,C4,HC41,no,N,10,,9567,1112,AAC
11,,SING,C4,HC42,no,N,11,,9567,1112,AAC
12,,SING,C4,HC43,no,N,12,,9567,1112,AAC
13,,SING,N1,HN1,no,N,13,,9567,1112,AAC
14,,SING,O1,HO1,no,N,14,,9567,1112,AAC
1,,SING,FE,NA,no,N,1,,9568,1112,HEC
2,,SING,FE,NB,no,N,2,,9568,1112,HEC
3,,SING,FE,NC,no,N,3,,9568,1112,HEC
4,,SING,FE,ND,no,N,4,,9568,1112,HEC
5,,DOUB,CHA,C1A,no,N,5,,9568,1112,HEC
6,,SING,CHA,C4D,no,N,6,,9568,1112,HEC
7,,SING,CHA,HHA,no,N,7,,9568,1112,HEC
8,,DOUB,CHB,C4A,no,N,8,,9568,1112,HEC
9,,SING,CHB,C1B,no,N,9,,9568,1112,HEC
10,,SING,CHB,HHB,no,N,10,,9568,1112,HEC
11,,DOUB,CHC,C4B,no,N,11,,9568,1112,HEC
12,,SING,CHC,C1C,no,N,12,,9568,1112,HEC
13,,SING,CHC,HHC,no,N,13,,9568,1112,HEC
14,,DOUB,CHD,C4C,no,N,14,,9568,1112,HEC
15,,SING,CHD,C1D,no,N,15,,9568,1112,HEC
16,,SING,CHD,HHD,no,N,16,,9568,1112,HEC
17,,SING,NA,C1A,yes,N,17,,9568,1112,HEC
18,,SING,NA,C4A,yes,N,18,,9568,1112,HEC
19,,SING,C1A,C2A,yes,N,19,,9568,1112,HEC
20,,DOUB,C2A,C3A,yes,N,20,,9568,1112,HEC
21,,SING,C2A,CAA,no,N,21,,9568,1112,HEC
22,,SING,C3A,C4A,yes,N,22,,9568,1112,HEC
23,,SING,C3A,CMA,no,N,23,,9568,1112,HEC
24,,SING,CMA,HMA1,no,N,24,,9568,1112,HEC
25,,SING,CMA,HMA2,no,N,25,,9568,1112,HEC
26,,SING,CMA,HMA3,no,N,26,,9568,1112,HEC
27,,SING,CAA,CBA,no,N,27,,9568,1112,HEC
28,,SING,CAA,HAA1,no,N,28,,9568,1112,HEC
29,,SING,CAA,HAA2,no,N,29,,9568,1112,HEC
30,,SING,CBA,CGA,no,N,30,,9568,1112,HEC
31,,SING,CBA,HBA1,no,N,31,,9568,1112,HEC
32,,SING,CBA,HBA2,no,N,32,,9568,1112,HEC
33,,DOUB,CGA,O1A,no,N,33,,9568,1112,HEC
34,,SING,CGA,O2A,no,N,34,,9568,1112,HEC
35,,SING,O2A,H2A,no,N,35,,9568,1112,HEC
36,,SING,NB,C1B,yes,N,36,,9568,1112,HEC
37,,SING,NB,C4B,yes,N,37,,9568,1112,HEC
38,,DOUB,C1B,C2B,yes,N,38,,9568,1112,HEC
39,,SING,C2B,C3B,yes,N,39,,9568,1112,HEC
40,,SING,C2B,CMB,no,N,40,,9568,1112,HEC
13,,SING,CD,CE,,,,,14155,11359,MLY
41,,SING,C3B,C4B,yes,N,41,,9568,1112,HEC
42,,DOUB,C3B,CAB,no,E,42,,9568,1112,HEC
43,,SING,CMB,HMB1,no,N,43,,9568,1112,HEC
44,,SING,CMB,HMB2,no,N,44,,9568,1112,HEC
45,,SING,CMB,HMB3,no,N,45,,9568,1112,HEC
46,,SING,CAB,CBB,no,N,46,,9568,1112,HEC
47,,SING,CAB,HAB,no,N,47,,9568,1112,HEC
48,,SING,CBB,HBB1,no,N,48,,9568,1112,HEC
49,,SING,CBB,HBB2,no,N,49,,9568,1112,HEC
50,,SING,CBB,HBB3,no,N,50,,9568,1112,HEC
51,,SING,NC,C1C,yes,N,51,,9568,1112,HEC
52,,SING,NC,C4C,yes,N,52,,9568,1112,HEC
53,,DOUB,C1C,C2C,yes,N,53,,9568,1112,HEC
54,,SING,C2C,C3C,yes,N,54,,9568,1112,HEC
55,,SING,C2C,CMC,no,N,55,,9568,1112,HEC
56,,SING,C3C,C4C,yes,N,56,,9568,1112,HEC
57,,DOUB,C3C,CAC,no,E,57,,9568,1112,HEC
58,,SING,CMC,HMC1,no,N,58,,9568,1112,HEC
59,,SING,CMC,HMC2,no,N,59,,9568,1112,HEC
60,,SING,CMC,HMC3,no,N,60,,9568,1112,HEC
61,,SING,CAC,CBC,no,N,61,,9568,1112,HEC
62,,SING,CAC,HAC,no,N,62,,9568,1112,HEC
63,,SING,CBC,HBC1,no,N,63,,9568,1112,HEC
64,,SING,CBC,HBC2,no,N,64,,9568,1112,HEC
65,,SING,CBC,HBC3,no,N,65,,9568,1112,HEC
66,,SING,ND,C1D,yes,N,66,,9568,1112,HEC
67,,SING,ND,C4D,yes,N,67,,9568,1112,HEC
68,,DOUB,C1D,C2D,yes,N,68,,9568,1112,HEC
69,,SING,C2D,C3D,yes,N,69,,9568,1112,HEC
70,,SING,C2D,CMD,no,N,70,,9568,1112,HEC
71,,DOUB,C3D,C4D,yes,N,71,,9568,1112,HEC
72,,SING,C3D,CAD,no,N,72,,9568,1112,HEC
73,,SING,CMD,HMD1,no,N,73,,9568,1112,HEC
74,,SING,CMD,HMD2,no,N,74,,9568,1112,HEC
75,,SING,CMD,HMD3,no,N,75,,9568,1112,HEC
76,,SING,CAD,CBD,no,N,76,,9568,1112,HEC
77,,SING,CAD,HAD1,no,N,77,,9568,1112,HEC
78,,SING,CAD,HAD2,no,N,78,,9568,1112,HEC
79,,SING,CBD,CGD,no,N,79,,9568,1112,HEC
80,,SING,CBD,HBD1,no,N,80,,9568,1112,HEC
81,,SING,CBD,HBD2,no,N,81,,9568,1112,HEC
82,,DOUB,CGD,O1D,no,N,82,,9568,1112,HEC
83,,SING,CGD,O2D,no,N,83,,9568,1112,HEC
84,,SING,O2D,H2D,no,N,84,,9568,1112,HEC
1,,SING,C1,C2,no,N,1,,9762,1113,AAC
2,,SING,C1,O1,no,N,2,,9762,1113,AAC
3,,DOUB,C1,O2,no,N,3,,9762,1113,AAC
4,,SING,C2,N1,no,N,4,,9762,1113,AAC
5,,SING,C2,HC21,no,N,5,,9762,1113,AAC
6,,SING,C2,HC22,no,N,6,,9762,1113,AAC
7,,SING,C3,C4,no,N,7,,9762,1113,AAC
8,,SING,C3,N1,no,N,8,,9762,1113,AAC
9,,DOUB,C3,O3,no,N,9,,9762,1113,AAC
10,,SING,C4,HC41,no,N,10,,9762,1113,AAC
11,,SING,C4,HC42,no,N,11,,9762,1113,AAC
12,,SING,C4,HC43,no,N,12,,9762,1113,AAC
13,,SING,N1,HN1,no,N,13,,9762,1113,AAC
14,,SING,O1,HO1,no,N,14,,9762,1113,AAC
1,,SING,C1,C2,no,N,1,,9963,1114,AAC
2,,SING,C1,O1,no,N,2,,9963,1114,AAC
3,,DOUB,C1,O2,no,N,3,,9963,1114,AAC
4,,SING,C2,N1,no,N,4,,9963,1114,AAC
5,,SING,C2,HC21,no,N,5,,9963,1114,AAC
6,,SING,C2,HC22,no,N,6,,9963,1114,AAC
7,,SING,C3,C4,no,N,7,,9963,1114,AAC
8,,SING,C3,N1,no,N,8,,9963,1114,AAC
9,,DOUB,C3,O3,no,N,9,,9963,1114,AAC
10,,SING,C4,HC41,no,N,10,,9963,1114,AAC
11,,SING,C4,HC42,no,N,11,,9963,1114,AAC
12,,SING,C4,HC43,no,N,12,,9963,1114,AAC
13,,SING,N1,HN1,no,N,13,,9963,1114,AAC
14,,SING,O1,HO1,no,N,14,,9963,1114,AAC
1,,SING,FE,NA,no,N,1,,9964,1114,HEC
2,,SING,FE,NB,no,N,2,,9964,1114,HEC
3,,SING,FE,NC,no,N,3,,9964,1114,HEC
4,,SING,FE,ND,no,N,4,,9964,1114,HEC
5,,DOUB,CHA,C1A,no,N,5,,9964,1114,HEC
6,,SING,CHA,C4D,no,N,6,,9964,1114,HEC
7,,SING,CHA,HHA,no,N,7,,9964,1114,HEC
8,,DOUB,CHB,C4A,no,N,8,,9964,1114,HEC
9,,SING,CHB,C1B,no,N,9,,9964,1114,HEC
10,,SING,CHB,HHB,no,N,10,,9964,1114,HEC
11,,DOUB,CHC,C4B,no,N,11,,9964,1114,HEC
12,,SING,CHC,C1C,no,N,12,,9964,1114,HEC
13,,SING,CHC,HHC,no,N,13,,9964,1114,HEC
14,,DOUB,CHD,C4C,no,N,14,,9964,1114,HEC
15,,SING,CHD,C1D,no,N,15,,9964,1114,HEC
16,,SING,CHD,HHD,no,N,16,,9964,1114,HEC
17,,SING,NA,C1A,yes,N,17,,9964,1114,HEC
18,,SING,NA,C4A,yes,N,18,,9964,1114,HEC
19,,SING,C1A,C2A,yes,N,19,,9964,1114,HEC
20,,DOUB,C2A,C3A,yes,N,20,,9964,1114,HEC
21,,SING,C2A,CAA,no,N,21,,9964,1114,HEC
22,,SING,C3A,C4A,yes,N,22,,9964,1114,HEC
23,,SING,C3A,CMA,no,N,23,,9964,1114,HEC
24,,SING,CMA,HMA1,no,N,24,,9964,1114,HEC
25,,SING,CMA,HMA2,no,N,25,,9964,1114,HEC
26,,SING,CMA,HMA3,no,N,26,,9964,1114,HEC
27,,SING,CAA,CBA,no,N,27,,9964,1114,HEC
28,,SING,CAA,HAA1,no,N,28,,9964,1114,HEC
29,,SING,CAA,HAA2,no,N,29,,9964,1114,HEC
30,,SING,CBA,CGA,no,N,30,,9964,1114,HEC
31,,SING,CBA,HBA1,no,N,31,,9964,1114,HEC
32,,SING,CBA,HBA2,no,N,32,,9964,1114,HEC
33,,DOUB,CGA,O1A,no,N,33,,9964,1114,HEC
34,,SING,CGA,O2A,no,N,34,,9964,1114,HEC
35,,SING,O2A,H2A,no,N,35,,9964,1114,HEC
36,,SING,NB,C1B,yes,N,36,,9964,1114,HEC
37,,SING,NB,C4B,yes,N,37,,9964,1114,HEC
38,,DOUB,C1B,C2B,yes,N,38,,9964,1114,HEC
39,,SING,C2B,C3B,yes,N,39,,9964,1114,HEC
40,,SING,C2B,CMB,no,N,40,,9964,1114,HEC
41,,SING,C3B,C4B,yes,N,41,,9964,1114,HEC
42,,DOUB,C3B,CAB,no,E,42,,9964,1114,HEC
43,,SING,CMB,HMB1,no,N,43,,9964,1114,HEC
44,,SING,CMB,HMB2,no,N,44,,9964,1114,HEC
45,,SING,CMB,HMB3,no,N,45,,9964,1114,HEC
46,,SING,CAB,CBB,no,N,46,,9964,1114,HEC
47,,SING,CAB,HAB,no,N,47,,9964,1114,HEC
48,,SING,CBB,HBB1,no,N,48,,9964,1114,HEC
49,,SING,CBB,HBB2,no,N,49,,9964,1114,HEC
50,,SING,CBB,HBB3,no,N,50,,9964,1114,HEC
51,,SING,NC,C1C,yes,N,51,,9964,1114,HEC
52,,SING,NC,C4C,yes,N,52,,9964,1114,HEC
53,,DOUB,C1C,C2C,yes,N,53,,9964,1114,HEC
54,,SING,C2C,C3C,yes,N,54,,9964,1114,HEC
55,,SING,C2C,CMC,no,N,55,,9964,1114,HEC
56,,SING,C3C,C4C,yes,N,56,,9964,1114,HEC
57,,DOUB,C3C,CAC,no,E,57,,9964,1114,HEC
58,,SING,CMC,HMC1,no,N,58,,9964,1114,HEC
59,,SING,CMC,HMC2,no,N,59,,9964,1114,HEC
60,,SING,CMC,HMC3,no,N,60,,9964,1114,HEC
61,,SING,CAC,CBC,no,N,61,,9964,1114,HEC
62,,SING,CAC,HAC,no,N,62,,9964,1114,HEC
63,,SING,CBC,HBC1,no,N,63,,9964,1114,HEC
64,,SING,CBC,HBC2,no,N,64,,9964,1114,HEC
65,,SING,CBC,HBC3,no,N,65,,9964,1114,HEC
66,,SING,ND,C1D,yes,N,66,,9964,1114,HEC
67,,SING,ND,C4D,yes,N,67,,9964,1114,HEC
68,,DOUB,C1D,C2D,yes,N,68,,9964,1114,HEC
69,,SING,C2D,C3D,yes,N,69,,9964,1114,HEC
70,,SING,C2D,CMD,no,N,70,,9964,1114,HEC
71,,DOUB,C3D,C4D,yes,N,71,,9964,1114,HEC
72,,SING,C3D,CAD,no,N,72,,9964,1114,HEC
73,,SING,CMD,HMD1,no,N,73,,9964,1114,HEC
74,,SING,CMD,HMD2,no,N,74,,9964,1114,HEC
75,,SING,CMD,HMD3,no,N,75,,9964,1114,HEC
76,,SING,CAD,CBD,no,N,76,,9964,1114,HEC
77,,SING,CAD,HAD1,no,N,77,,9964,1114,HEC
78,,SING,CAD,HAD2,no,N,78,,9964,1114,HEC
79,,SING,CBD,CGD,no,N,79,,9964,1114,HEC
80,,SING,CBD,HBD1,no,N,80,,9964,1114,HEC
81,,SING,CBD,HBD2,no,N,81,,9964,1114,HEC
82,,DOUB,CGD,O1D,no,N,82,,9964,1114,HEC
83,,SING,CGD,O2D,no,N,83,,9964,1114,HEC
84,,SING,O2D,H2D,no,N,84,,9964,1114,HEC
1,,SING,FE,NA,no,N,1,,10159,1115,HEC
2,,SING,FE,NB,no,N,2,,10159,1115,HEC
3,,SING,FE,NC,no,N,3,,10159,1115,HEC
4,,SING,FE,ND,no,N,4,,10159,1115,HEC
5,,DOUB,CHA,C1A,no,N,5,,10159,1115,HEC
6,,SING,CHA,C4D,no,N,6,,10159,1115,HEC
7,,SING,CHA,HHA,no,N,7,,10159,1115,HEC
8,,DOUB,CHB,C4A,no,N,8,,10159,1115,HEC
9,,SING,CHB,C1B,no,N,9,,10159,1115,HEC
10,,SING,CHB,HHB,no,N,10,,10159,1115,HEC
11,,DOUB,CHC,C4B,no,N,11,,10159,1115,HEC
12,,SING,CHC,C1C,no,N,12,,10159,1115,HEC
13,,SING,CHC,HHC,no,N,13,,10159,1115,HEC
14,,DOUB,CHD,C4C,no,N,14,,10159,1115,HEC
15,,SING,CHD,C1D,no,N,15,,10159,1115,HEC
16,,SING,CHD,HHD,no,N,16,,10159,1115,HEC
17,,SING,NA,C1A,yes,N,17,,10159,1115,HEC
18,,SING,NA,C4A,yes,N,18,,10159,1115,HEC
19,,SING,C1A,C2A,yes,N,19,,10159,1115,HEC
20,,DOUB,C2A,C3A,yes,N,20,,10159,1115,HEC
21,,SING,C2A,CAA,no,N,21,,10159,1115,HEC
22,,SING,C3A,C4A,yes,N,22,,10159,1115,HEC
23,,SING,C3A,CMA,no,N,23,,10159,1115,HEC
24,,SING,CMA,HMA1,no,N,24,,10159,1115,HEC
25,,SING,CMA,HMA2,no,N,25,,10159,1115,HEC
26,,SING,CMA,HMA3,no,N,26,,10159,1115,HEC
27,,SING,CAA,CBA,no,N,27,,10159,1115,HEC
28,,SING,CAA,HAA1,no,N,28,,10159,1115,HEC
29,,SING,CAA,HAA2,no,N,29,,10159,1115,HEC
30,,SING,CBA,CGA,no,N,30,,10159,1115,HEC
31,,SING,CBA,HBA1,no,N,31,,10159,1115,HEC
32,,SING,CBA,HBA2,no,N,32,,10159,1115,HEC
33,,DOUB,CGA,O1A,no,N,33,,10159,1115,HEC
34,,SING,CGA,O2A,no,N,34,,10159,1115,HEC
35,,SING,O2A,H2A,no,N,35,,10159,1115,HEC
36,,SING,NB,C1B,yes,N,36,,10159,1115,HEC
37,,SING,NB,C4B,yes,N,37,,10159,1115,HEC
38,,DOUB,C1B,C2B,yes,N,38,,10159,1115,HEC
39,,SING,C2B,C3B,yes,N,39,,10159,1115,HEC
40,,SING,C2B,CMB,no,N,40,,10159,1115,HEC
41,,SING,C3B,C4B,yes,N,41,,10159,1115,HEC
42,,DOUB,C3B,CAB,no,E,42,,10159,1115,HEC
43,,SING,CMB,HMB1,no,N,43,,10159,1115,HEC
44,,SING,CMB,HMB2,no,N,44,,10159,1115,HEC
45,,SING,CMB,HMB3,no,N,45,,10159,1115,HEC
46,,SING,CAB,CBB,no,N,46,,10159,1115,HEC
47,,SING,CAB,HAB,no,N,47,,10159,1115,HEC
48,,SING,CBB,HBB1,no,N,48,,10159,1115,HEC
49,,SING,CBB,HBB2,no,N,49,,10159,1115,HEC
50,,SING,CBB,HBB3,no,N,50,,10159,1115,HEC
51,,SING,NC,C1C,yes,N,51,,10159,1115,HEC
52,,SING,NC,C4C,yes,N,52,,10159,1115,HEC
53,,DOUB,C1C,C2C,yes,N,53,,10159,1115,HEC
54,,SING,C2C,C3C,yes,N,54,,10159,1115,HEC
55,,SING,C2C,CMC,no,N,55,,10159,1115,HEC
56,,SING,C3C,C4C,yes,N,56,,10159,1115,HEC
57,,DOUB,C3C,CAC,no,E,57,,10159,1115,HEC
58,,SING,CMC,HMC1,no,N,58,,10159,1115,HEC
59,,SING,CMC,HMC2,no,N,59,,10159,1115,HEC
60,,SING,CMC,HMC3,no,N,60,,10159,1115,HEC
61,,SING,CAC,CBC,no,N,61,,10159,1115,HEC
62,,SING,CAC,HAC,no,N,62,,10159,1115,HEC
63,,SING,CBC,HBC1,no,N,63,,10159,1115,HEC
64,,SING,CBC,HBC2,no,N,64,,10159,1115,HEC
65,,SING,CBC,HBC3,no,N,65,,10159,1115,HEC
66,,SING,ND,C1D,yes,N,66,,10159,1115,HEC
67,,SING,ND,C4D,yes,N,67,,10159,1115,HEC
68,,DOUB,C1D,C2D,yes,N,68,,10159,1115,HEC
69,,SING,C2D,C3D,yes,N,69,,10159,1115,HEC
70,,SING,C2D,CMD,no,N,70,,10159,1115,HEC
71,,DOUB,C3D,C4D,yes,N,71,,10159,1115,HEC
72,,SING,C3D,CAD,no,N,72,,10159,1115,HEC
73,,SING,CMD,HMD1,no,N,73,,10159,1115,HEC
74,,SING,CMD,HMD2,no,N,74,,10159,1115,HEC
75,,SING,CMD,HMD3,no,N,75,,10159,1115,HEC
76,,SING,CAD,CBD,no,N,76,,10159,1115,HEC
77,,SING,CAD,HAD1,no,N,77,,10159,1115,HEC
78,,SING,CAD,HAD2,no,N,78,,10159,1115,HEC
79,,SING,CBD,CGD,no,N,79,,10159,1115,HEC
80,,SING,CBD,HBD1,no,N,80,,10159,1115,HEC
81,,SING,CBD,HBD2,no,N,81,,10159,1115,HEC
82,,DOUB,CGD,O1D,no,N,82,,10159,1115,HEC
83,,SING,CGD,O2D,no,N,83,,10159,1115,HEC
84,,SING,O2D,H2D,no,N,84,,10159,1115,HEC
1,,SING,N,CA,no,N,1,,10160,1115,M3L
2,,SING,N,H,no,N,2,,10160,1115,M3L
3,,SING,N,H2,no,N,3,,10160,1115,M3L
4,,SING,CA,CB,no,N,4,,10160,1115,M3L
5,,SING,CA,C,no,N,5,,10160,1115,M3L
6,,SING,CA,HA,no,N,6,,10160,1115,M3L
7,,SING,CB,CG,no,N,7,,10160,1115,M3L
8,,SING,CB,HB2,no,N,8,,10160,1115,M3L
9,,SING,CB,HB3,no,N,9,,10160,1115,M3L
10,,SING,CG,CD,no,N,10,,10160,1115,M3L
11,,SING,CG,HG2,no,N,11,,10160,1115,M3L
12,,SING,CG,HG3,no,N,12,,10160,1115,M3L
13,,SING,CD,CE,no,N,13,,10160,1115,M3L
14,,SING,CD,HD2,no,N,14,,10160,1115,M3L
15,,SING,CD,HD3,no,N,15,,10160,1115,M3L
16,,SING,CE,NZ,no,N,16,,10160,1115,M3L
17,,SING,CE,HE2,no,N,17,,10160,1115,M3L
18,,SING,CE,HE3,no,N,18,,10160,1115,M3L
19,,SING,NZ,CM1,no,N,19,,10160,1115,M3L
20,,SING,NZ,CM2,no,N,20,,10160,1115,M3L
21,,SING,NZ,CM3,no,N,21,,10160,1115,M3L
22,,DOUB,C,O,no,N,22,,10160,1115,M3L
23,,SING,C,OXT,no,N,23,,10160,1115,M3L
24,,SING,OXT,HXT,no,N,24,,10160,1115,M3L
25,,SING,CM1,HM11,no,N,25,,10160,1115,M3L
26,,SING,CM1,HM12,no,N,26,,10160,1115,M3L
27,,SING,CM1,HM13,no,N,27,,10160,1115,M3L
28,,SING,CM2,HM21,no,N,28,,10160,1115,M3L
29,,SING,CM2,HM22,no,N,29,,10160,1115,M3L
30,,SING,CM2,HM23,no,N,30,,10160,1115,M3L
31,,SING,CM3,HM31,no,N,31,,10160,1115,M3L
32,,SING,CM3,HM32,no,N,32,,10160,1115,M3L
33,,SING,CM3,HM33,no,N,33,,10160,1115,M3L
1,,SING,C1,C2,no,N,1,,10360,1116,AAC
2,,SING,C1,O1,no,N,2,,10360,1116,AAC
3,,DOUB,C1,O2,no,N,3,,10360,1116,AAC
4,,SING,C2,N1,no,N,4,,10360,1116,AAC
5,,SING,C2,HC21,no,N,5,,10360,1116,AAC
6,,SING,C2,HC22,no,N,6,,10360,1116,AAC
7,,SING,C3,C4,no,N,7,,10360,1116,AAC
8,,SING,C3,N1,no,N,8,,10360,1116,AAC
9,,DOUB,C3,O3,no,N,9,,10360,1116,AAC
10,,SING,C4,HC41,no,N,10,,10360,1116,AAC
11,,SING,C4,HC42,no,N,11,,10360,1116,AAC
12,,SING,C4,HC43,no,N,12,,10360,1116,AAC
13,,SING,N1,HN1,no,N,13,,10360,1116,AAC
14,,SING,O1,HO1,no,N,14,,10360,1116,AAC
1,,SING,FE,NA,no,N,1,,10361,1116,HEC
2,,SING,FE,NB,no,N,2,,10361,1116,HEC
3,,SING,FE,NC,no,N,3,,10361,1116,HEC
4,,SING,FE,ND,no,N,4,,10361,1116,HEC
5,,DOUB,CHA,C1A,no,N,5,,10361,1116,HEC
6,,SING,CHA,C4D,no,N,6,,10361,1116,HEC
7,,SING,CHA,HHA,no,N,7,,10361,1116,HEC
8,,DOUB,CHB,C4A,no,N,8,,10361,1116,HEC
9,,SING,CHB,C1B,no,N,9,,10361,1116,HEC
10,,SING,CHB,HHB,no,N,10,,10361,1116,HEC
11,,DOUB,CHC,C4B,no,N,11,,10361,1116,HEC
12,,SING,CHC,C1C,no,N,12,,10361,1116,HEC
13,,SING,CHC,HHC,no,N,13,,10361,1116,HEC
14,,DOUB,CHD,C4C,no,N,14,,10361,1116,HEC
15,,SING,CHD,C1D,no,N,15,,10361,1116,HEC
16,,SING,CHD,HHD,no,N,16,,10361,1116,HEC
17,,SING,NA,C1A,yes,N,17,,10361,1116,HEC
18,,SING,NA,C4A,yes,N,18,,10361,1116,HEC
19,,SING,C1A,C2A,yes,N,19,,10361,1116,HEC
20,,DOUB,C2A,C3A,yes,N,20,,10361,1116,HEC
21,,SING,C2A,CAA,no,N,21,,10361,1116,HEC
22,,SING,C3A,C4A,yes,N,22,,10361,1116,HEC
23,,SING,C3A,CMA,no,N,23,,10361,1116,HEC
24,,SING,CMA,HMA1,no,N,24,,10361,1116,HEC
25,,SING,CMA,HMA2,no,N,25,,10361,1116,HEC
26,,SING,CMA,HMA3,no,N,26,,10361,1116,HEC
27,,SING,CAA,CBA,no,N,27,,10361,1116,HEC
28,,SING,CAA,HAA1,no,N,28,,10361,1116,HEC
29,,SING,CAA,HAA2,no,N,29,,10361,1116,HEC
30,,SING,CBA,CGA,no,N,30,,10361,1116,HEC
31,,SING,CBA,HBA1,no,N,31,,10361,1116,HEC
32,,SING,CBA,HBA2,no,N,32,,10361,1116,HEC
33,,DOUB,CGA,O1A,no,N,33,,10361,1116,HEC
34,,SING,CGA,O2A,no,N,34,,10361,1116,HEC
35,,SING,O2A,H2A,no,N,35,,10361,1116,HEC
36,,SING,NB,C1B,yes,N,36,,10361,1116,HEC
37,,SING,NB,C4B,yes,N,37,,10361,1116,HEC
38,,DOUB,C1B,C2B,yes,N,38,,10361,1116,HEC
39,,SING,C2B,C3B,yes,N,39,,10361,1116,HEC
40,,SING,C2B,CMB,no,N,40,,10361,1116,HEC
41,,SING,C3B,C4B,yes,N,41,,10361,1116,HEC
42,,DOUB,C3B,CAB,no,E,42,,10361,1116,HEC
43,,SING,CMB,HMB1,no,N,43,,10361,1116,HEC
44,,SING,CMB,HMB2,no,N,44,,10361,1116,HEC
45,,SING,CMB,HMB3,no,N,45,,10361,1116,HEC
46,,SING,CAB,CBB,no,N,46,,10361,1116,HEC
47,,SING,CAB,HAB,no,N,47,,10361,1116,HEC
48,,SING,CBB,HBB1,no,N,48,,10361,1116,HEC
49,,SING,CBB,HBB2,no,N,49,,10361,1116,HEC
50,,SING,CBB,HBB3,no,N,50,,10361,1116,HEC
51,,SING,NC,C1C,yes,N,51,,10361,1116,HEC
52,,SING,NC,C4C,yes,N,52,,10361,1116,HEC
53,,DOUB,C1C,C2C,yes,N,53,,10361,1116,HEC
54,,SING,C2C,C3C,yes,N,54,,10361,1116,HEC
55,,SING,C2C,CMC,no,N,55,,10361,1116,HEC
56,,SING,C3C,C4C,yes,N,56,,10361,1116,HEC
57,,DOUB,C3C,CAC,no,E,57,,10361,1116,HEC
58,,SING,CMC,HMC1,no,N,58,,10361,1116,HEC
59,,SING,CMC,HMC2,no,N,59,,10361,1116,HEC
60,,SING,CMC,HMC3,no,N,60,,10361,1116,HEC
61,,SING,CAC,CBC,no,N,61,,10361,1116,HEC
62,,SING,CAC,HAC,no,N,62,,10361,1116,HEC
63,,SING,CBC,HBC1,no,N,63,,10361,1116,HEC
64,,SING,CBC,HBC2,no,N,64,,10361,1116,HEC
65,,SING,CBC,HBC3,no,N,65,,10361,1116,HEC
66,,SING,ND,C1D,yes,N,66,,10361,1116,HEC
67,,SING,ND,C4D,yes,N,67,,10361,1116,HEC
68,,DOUB,C1D,C2D,yes,N,68,,10361,1116,HEC
69,,SING,C2D,C3D,yes,N,69,,10361,1116,HEC
70,,SING,C2D,CMD,no,N,70,,10361,1116,HEC
71,,DOUB,C3D,C4D,yes,N,71,,10361,1116,HEC
72,,SING,C3D,CAD,no,N,72,,10361,1116,HEC
73,,SING,CMD,HMD1,no,N,73,,10361,1116,HEC
74,,SING,CMD,HMD2,no,N,74,,10361,1116,HEC
75,,SING,CMD,HMD3,no,N,75,,10361,1116,HEC
76,,SING,CAD,CBD,no,N,76,,10361,1116,HEC
77,,SING,CAD,HAD1,no,N,77,,10361,1116,HEC
78,,SING,CAD,HAD2,no,N,78,,10361,1116,HEC
79,,SING,CBD,CGD,no,N,79,,10361,1116,HEC
80,,SING,CBD,HBD1,no,N,80,,10361,1116,HEC
81,,SING,CBD,HBD2,no,N,81,,10361,1116,HEC
82,,DOUB,CGD,O1D,no,N,82,,10361,1116,HEC
83,,SING,CGD,O2D,no,N,83,,10361,1116,HEC
84,,SING,O2D,H2D,no,N,84,,10361,1116,HEC
1,,SING,FE,NA,no,N,1,,10574,1117,HEC
2,,SING,FE,NB,no,N,2,,10574,1117,HEC
3,,SING,FE,NC,no,N,3,,10574,1117,HEC
4,,SING,FE,ND,no,N,4,,10574,1117,HEC
5,,DOUB,CHA,C1A,no,N,5,,10574,1117,HEC
6,,SING,CHA,C4D,no,N,6,,10574,1117,HEC
7,,SING,CHA,HHA,no,N,7,,10574,1117,HEC
8,,DOUB,CHB,C4A,no,N,8,,10574,1117,HEC
9,,SING,CHB,C1B,no,N,9,,10574,1117,HEC
10,,SING,CHB,HHB,no,N,10,,10574,1117,HEC
11,,DOUB,CHC,C4B,no,N,11,,10574,1117,HEC
12,,SING,CHC,C1C,no,N,12,,10574,1117,HEC
13,,SING,CHC,HHC,no,N,13,,10574,1117,HEC
14,,DOUB,CHD,C4C,no,N,14,,10574,1117,HEC
15,,SING,CHD,C1D,no,N,15,,10574,1117,HEC
16,,SING,CHD,HHD,no,N,16,,10574,1117,HEC
17,,SING,NA,C1A,yes,N,17,,10574,1117,HEC
18,,SING,NA,C4A,yes,N,18,,10574,1117,HEC
19,,SING,C1A,C2A,yes,N,19,,10574,1117,HEC
20,,DOUB,C2A,C3A,yes,N,20,,10574,1117,HEC
21,,SING,C2A,CAA,no,N,21,,10574,1117,HEC
22,,SING,C3A,C4A,yes,N,22,,10574,1117,HEC
23,,SING,C3A,CMA,no,N,23,,10574,1117,HEC
24,,SING,CMA,HMA1,no,N,24,,10574,1117,HEC
25,,SING,CMA,HMA2,no,N,25,,10574,1117,HEC
26,,SING,CMA,HMA3,no,N,26,,10574,1117,HEC
27,,SING,CAA,CBA,no,N,27,,10574,1117,HEC
28,,SING,CAA,HAA1,no,N,28,,10574,1117,HEC
29,,SING,CAA,HAA2,no,N,29,,10574,1117,HEC
30,,SING,CBA,CGA,no,N,30,,10574,1117,HEC
31,,SING,CBA,HBA1,no,N,31,,10574,1117,HEC
32,,SING,CBA,HBA2,no,N,32,,10574,1117,HEC
33,,DOUB,CGA,O1A,no,N,33,,10574,1117,HEC
34,,SING,CGA,O2A,no,N,34,,10574,1117,HEC
35,,SING,O2A,H2A,no,N,35,,10574,1117,HEC
36,,SING,NB,C1B,yes,N,36,,10574,1117,HEC
37,,SING,NB,C4B,yes,N,37,,10574,1117,HEC
38,,DOUB,C1B,C2B,yes,N,38,,10574,1117,HEC
39,,SING,C2B,C3B,yes,N,39,,10574,1117,HEC
40,,SING,C2B,CMB,no,N,40,,10574,1117,HEC
41,,SING,C3B,C4B,yes,N,41,,10574,1117,HEC
42,,DOUB,C3B,CAB,no,E,42,,10574,1117,HEC
43,,SING,CMB,HMB1,no,N,43,,10574,1117,HEC
44,,SING,CMB,HMB2,no,N,44,,10574,1117,HEC
45,,SING,CMB,HMB3,no,N,45,,10574,1117,HEC
46,,SING,CAB,CBB,no,N,46,,10574,1117,HEC
47,,SING,CAB,HAB,no,N,47,,10574,1117,HEC
48,,SING,CBB,HBB1,no,N,48,,10574,1117,HEC
49,,SING,CBB,HBB2,no,N,49,,10574,1117,HEC
50,,SING,CBB,HBB3,no,N,50,,10574,1117,HEC
51,,SING,NC,C1C,yes,N,51,,10574,1117,HEC
52,,SING,NC,C4C,yes,N,52,,10574,1117,HEC
53,,DOUB,C1C,C2C,yes,N,53,,10574,1117,HEC
54,,SING,C2C,C3C,yes,N,54,,10574,1117,HEC
55,,SING,C2C,CMC,no,N,55,,10574,1117,HEC
56,,SING,C3C,C4C,yes,N,56,,10574,1117,HEC
57,,DOUB,C3C,CAC,no,E,57,,10574,1117,HEC
58,,SING,CMC,HMC1,no,N,58,,10574,1117,HEC
59,,SING,CMC,HMC2,no,N,59,,10574,1117,HEC
60,,SING,CMC,HMC3,no,N,60,,10574,1117,HEC
61,,SING,CAC,CBC,no,N,61,,10574,1117,HEC
62,,SING,CAC,HAC,no,N,62,,10574,1117,HEC
63,,SING,CBC,HBC1,no,N,63,,10574,1117,HEC
64,,SING,CBC,HBC2,no,N,64,,10574,1117,HEC
65,,SING,CBC,HBC3,no,N,65,,10574,1117,HEC
66,,SING,ND,C1D,yes,N,66,,10574,1117,HEC
67,,SING,ND,C4D,yes,N,67,,10574,1117,HEC
68,,DOUB,C1D,C2D,yes,N,68,,10574,1117,HEC
69,,SING,C2D,C3D,yes,N,69,,10574,1117,HEC
70,,SING,C2D,CMD,no,N,70,,10574,1117,HEC
71,,DOUB,C3D,C4D,yes,N,71,,10574,1117,HEC
72,,SING,C3D,CAD,no,N,72,,10574,1117,HEC
73,,SING,CMD,HMD1,no,N,73,,10574,1117,HEC
74,,SING,CMD,HMD2,no,N,74,,10574,1117,HEC
75,,SING,CMD,HMD3,no,N,75,,10574,1117,HEC
76,,SING,CAD,CBD,no,N,76,,10574,1117,HEC
77,,SING,CAD,HAD1,no,N,77,,10574,1117,HEC
78,,SING,CAD,HAD2,no,N,78,,10574,1117,HEC
79,,SING,CBD,CGD,no,N,79,,10574,1117,HEC
80,,SING,CBD,HBD1,no,N,80,,10574,1117,HEC
81,,SING,CBD,HBD2,no,N,81,,10574,1117,HEC
82,,DOUB,CGD,O1D,no,N,82,,10574,1117,HEC
83,,SING,CGD,O2D,no,N,83,,10574,1117,HEC
84,,SING,O2D,H2D,no,N,84,,10574,1117,HEC
1,,SING,N,CA,no,N,1,,10575,1117,M3L
2,,SING,N,H,no,N,2,,10575,1117,M3L
3,,SING,N,H2,no,N,3,,10575,1117,M3L
4,,SING,CA,CB,no,N,4,,10575,1117,M3L
5,,SING,CA,C,no,N,5,,10575,1117,M3L
6,,SING,CA,HA,no,N,6,,10575,1117,M3L
7,,SING,CB,CG,no,N,7,,10575,1117,M3L
8,,SING,CB,HB2,no,N,8,,10575,1117,M3L
9,,SING,CB,HB3,no,N,9,,10575,1117,M3L
10,,SING,CG,CD,no,N,10,,10575,1117,M3L
11,,SING,CG,HG2,no,N,11,,10575,1117,M3L
12,,SING,CG,HG3,no,N,12,,10575,1117,M3L
13,,SING,CD,CE,no,N,13,,10575,1117,M3L
14,,SING,CD,HD2,no,N,14,,10575,1117,M3L
15,,SING,CD,HD3,no,N,15,,10575,1117,M3L
16,,SING,CE,NZ,no,N,16,,10575,1117,M3L
17,,SING,CE,HE2,no,N,17,,10575,1117,M3L
18,,SING,CE,HE3,no,N,18,,10575,1117,M3L
19,,SING,NZ,CM1,no,N,19,,10575,1117,M3L
20,,SING,NZ,CM2,no,N,20,,10575,1117,M3L
21,,SING,NZ,CM3,no,N,21,,10575,1117,M3L
22,,DOUB,C,O,no,N,22,,10575,1117,M3L
23,,SING,C,OXT,no,N,23,,10575,1117,M3L
24,,SING,OXT,HXT,no,N,24,,10575,1117,M3L
25,,SING,CM1,HM11,no,N,25,,10575,1117,M3L
26,,SING,CM1,HM12,no,N,26,,10575,1117,M3L
27,,SING,CM1,HM13,no,N,27,,10575,1117,M3L
28,,SING,CM2,HM21,no,N,28,,10575,1117,M3L
29,,SING,CM2,HM22,no,N,29,,10575,1117,M3L
30,,SING,CM2,HM23,no,N,30,,10575,1117,M3L
31,,SING,CM3,HM31,no,N,31,,10575,1117,M3L
32,,SING,CM3,HM32,no,N,32,,10575,1117,M3L
33,,SING,CM3,HM33,no,N,33,,10575,1117,M3L
1,,SING,N1,CA1,,,,,12006,11249,GSH
2,,SING,N1,HN11,,,,,12006,11249,GSH
3,,SING,N1,HN12,,,,,12006,11249,GSH
4,,SING,CA1,C1,,,,,12006,11249,GSH
5,,SING,CA1,CB1,,,,,12006,11249,GSH
6,,SING,CA1,HA1,,,,,12006,11249,GSH
7,,DOUB,C1,O11,,,,,12006,11249,GSH
8,,SING,C1,O12,,,,,12006,11249,GSH
9,,SING,O12,H12,,,,,12006,11249,GSH
10,,SING,CB1,CG1,,,,,12006,11249,GSH
11,,SING,CB1,HB12,,,,,12006,11249,GSH
12,,SING,CB1,HB13,,,,,12006,11249,GSH
13,,SING,CG1,CD1,,,,,12006,11249,GSH
14,,SING,CG1,HG12,,,,,12006,11249,GSH
15,,SING,CG1,HG13,,,,,12006,11249,GSH
16,,DOUB,CD1,OE1,,,,,12006,11249,GSH
17,,SING,CD1,N2,,,,,12006,11249,GSH
18,,SING,N2,CA2,,,,,12006,11249,GSH
19,,SING,N2,HN2,,,,,12006,11249,GSH
20,,SING,CA2,C2,,,,,12006,11249,GSH
21,,SING,CA2,CB2,,,,,12006,11249,GSH
22,,SING,CA2,HA2,,,,,12006,11249,GSH
23,,DOUB,C2,O2,,,,,12006,11249,GSH
24,,SING,C2,N3,,,,,12006,11249,GSH
25,,SING,CB2,SG2,,,,,12006,11249,GSH
26,,SING,CB2,HB22,,,,,12006,11249,GSH
27,,SING,CB2,HB23,,,,,12006,11249,GSH
28,,SING,SG2,HSG,,,,,12006,11249,GSH
29,,SING,N3,CA3,,,,,12006,11249,GSH
30,,SING,N3,HN3,,,,,12006,11249,GSH
31,,SING,CA3,C3,,,,,12006,11249,GSH
32,,SING,CA3,HA31,,,,,12006,11249,GSH
33,,SING,CA3,HA32,,,,,12006,11249,GSH
34,,DOUB,C3,O31,,,,,12006,11249,GSH
35,,SING,C3,O32,,,,,12006,11249,GSH
36,,SING,O32,H32,,,,,12006,11249,GSH
1,,SING,FE1,S1,,,,,12007,11249,FES
2,,SING,FE1,S2,,,,,12007,11249,FES
3,,SING,FE2,S1,,,,,12007,11249,FES
4,,SING,FE2,S2,,,,,12007,11249,FES
1,,SING,N,CA,,,,,14155,11359,MLY
2,,SING,N,H,,,,,14155,11359,MLY
3,,SING,N,H2,,,,,14155,11359,MLY
4,,SING,CA,CB,,,,,14155,11359,MLY
5,,SING,CA,C,,,,,14155,11359,MLY
6,,SING,CA,HA,,,,,14155,11359,MLY
7,,SING,CB,CG,,,,,14155,11359,MLY
8,,SING,CB,HB2,,,,,14155,11359,MLY
9,,SING,CB,HB3,,,,,14155,11359,MLY
10,,SING,CG,CD,,,,,14155,11359,MLY
11,,SING,CG,HG2,,,,,14155,11359,MLY
12,,SING,CG,HG3,,,,,14155,11359,MLY
14,,SING,CD,HD2,,,,,14155,11359,MLY
15,,SING,CD,HD3,,,,,14155,11359,MLY
16,,SING,CE,NZ,,,,,14155,11359,MLY
17,,SING,CE,HE2,,,,,14155,11359,MLY
18,,SING,CE,HE3,,,,,14155,11359,MLY
19,,SING,NZ,CH1,,,,,14155,11359,MLY
20,,SING,NZ,CH2,,,,,14155,11359,MLY
21,,SING,CH1,HH11,,,,,14155,11359,MLY
22,,SING,CH1,HH12,,,,,14155,11359,MLY
23,,SING,CH1,HH13,,,,,14155,11359,MLY
24,,SING,CH2,HH21,,,,,14155,11359,MLY
25,,SING,CH2,HH22,,,,,14155,11359,MLY
26,,SING,CH2,HH23,,,,,14155,11359,MLY
27,,DOUB,C,O,,,,,14155,11359,MLY
28,,SING,C,OXT,,,,,14155,11359,MLY
29,,SING,OXT,HXT,,,,,14155,11359,MLY
1,,SING,N,CA,,,,,14190,11360,M3L
2,,SING,N,H,,,,,14190,11360,M3L
3,,SING,N,H2,,,,,14190,11360,M3L
4,,SING,CA,CB,,,,,14190,11360,M3L
5,,SING,CA,C,,,,,14190,11360,M3L
6,,SING,CA,HA,,,,,14190,11360,M3L
7,,SING,CB,CG,,,,,14190,11360,M3L
8,,SING,CB,HB2,,,,,14190,11360,M3L
9,,SING,CB,HB3,,,,,14190,11360,M3L
10,,SING,CG,CD,,,,,14190,11360,M3L
11,,SING,CG,HG2,,,,,14190,11360,M3L
12,,SING,CG,HG3,,,,,14190,11360,M3L
13,,SING,CD,CE,,,,,14190,11360,M3L
14,,SING,CD,HD2,,,,,14190,11360,M3L
15,,SING,CD,HD3,,,,,14190,11360,M3L
16,,SING,CE,NZ,,,,,14190,11360,M3L
17,,SING,CE,HE2,,,,,14190,11360,M3L
18,,SING,CE,HE3,,,,,14190,11360,M3L
19,,SING,NZ,CM1,,,,,14190,11360,M3L
20,,SING,NZ,CM2,,,,,14190,11360,M3L
21,,SING,NZ,CM3,,,,,14190,11360,M3L
22,,DOUB,C,O,,,,,14190,11360,M3L
23,,SING,C,OXT,,,,,14190,11360,M3L
24,,SING,OXT,HXT,,,,,14190,11360,M3L
25,,SING,CM1,HM11,,,,,14190,11360,M3L
26,,SING,CM1,HM12,,,,,14190,11360,M3L
27,,SING,CM1,HM13,,,,,14190,11360,M3L
28,,SING,CM2,HM21,,,,,14190,11360,M3L
29,,SING,CM2,HM22,,,,,14190,11360,M3L
30,,SING,CM2,HM23,,,,,14190,11360,M3L
31,,SING,CM3,HM31,,,,,14190,11360,M3L
32,,SING,CM3,HM32,,,,,14190,11360,M3L
33,,SING,CM3,HM33,,,,,14190,11360,M3L
1,,SING,N,CA,,,,,14212,11361,M3L
2,,SING,N,H,,,,,14212,11361,M3L
3,,SING,N,H2,,,,,14212,11361,M3L
4,,SING,CA,CB,,,,,14212,11361,M3L
5,,SING,CA,C,,,,,14212,11361,M3L
6,,SING,CA,HA,,,,,14212,11361,M3L
7,,SING,CB,CG,,,,,14212,11361,M3L
8,,SING,CB,HB2,,,,,14212,11361,M3L
9,,SING,CB,HB3,,,,,14212,11361,M3L
10,,SING,CG,CD,,,,,14212,11361,M3L
11,,SING,CG,HG2,,,,,14212,11361,M3L
12,,SING,CG,HG3,,,,,14212,11361,M3L
13,,SING,CD,CE,,,,,14212,11361,M3L
14,,SING,CD,HD2,,,,,14212,11361,M3L
15,,SING,CD,HD3,,,,,14212,11361,M3L
16,,SING,CE,NZ,,,,,14212,11361,M3L
17,,SING,CE,HE2,,,,,14212,11361,M3L
18,,SING,CE,HE3,,,,,14212,11361,M3L
19,,SING,NZ,CM1,,,,,14212,11361,M3L
20,,SING,NZ,CM2,,,,,14212,11361,M3L
21,,SING,NZ,CM3,,,,,14212,11361,M3L
22,,DOUB,C,O,,,,,14212,11361,M3L
23,,SING,C,OXT,,,,,14212,11361,M3L
24,,SING,OXT,HXT,,,,,14212,11361,M3L
25,,SING,CM1,HM11,,,,,14212,11361,M3L
26,,SING,CM1,HM12,,,,,14212,11361,M3L
27,,SING,CM1,HM13,,,,,14212,11361,M3L
28,,SING,CM2,HM21,,,,,14212,11361,M3L
29,,SING,CM2,HM22,,,,,14212,11361,M3L
30,,SING,CM2,HM23,,,,,14212,11361,M3L
31,,SING,CM3,HM31,,,,,14212,11361,M3L
32,,SING,CM3,HM32,,,,,14212,11361,M3L
33,,SING,CM3,HM33,,,,,14212,11361,M3L
1,,SING,P,O5',no,N,1,,15604,11437,JDT
2,,DOUB,P,OP1,no,N,2,,15604,11437,JDT
3,,SING,P,OP2,no,N,3,,15604,11437,JDT
4,,SING,P,OP3,no,N,4,,15604,11437,JDT
5,,SING,N1,C2,no,N,5,,15604,11437,JDT
6,,SING,N1,C6,no,N,6,,15604,11437,JDT
7,,SING,N1,C1',no,N,7,,15604,11437,JDT
8,,DOUB,C2,O2,no,N,8,,15604,11437,JDT
9,,SING,C2,N3,no,N,9,,15604,11437,JDT
10,,SING,N3,C4,no,N,10,,15604,11437,JDT
11,,DOUB,C4,O4,no,N,11,,15604,11437,JDT
12,,SING,C4,C5,no,N,12,,15604,11437,JDT
13,,DOUB,C5,C6,no,N,13,,15604,11437,JDT
14,,SING,C5,C7,no,N,14,,15604,11437,JDT
15,,SING,C7,C72,no,N,15,,15604,11437,JDT
16,,SING,C1',C2',no,N,16,,15604,11437,JDT
17,,SING,C1',O4',no,N,17,,15604,11437,JDT
18,,SING,C2',C3',no,N,18,,15604,11437,JDT
19,,SING,C3',O3',no,N,19,,15604,11437,JDT
20,,SING,C3',C4',no,N,20,,15604,11437,JDT
21,,SING,C4',O4',no,N,21,,15604,11437,JDT
22,,SING,C4',C5',no,N,22,,15604,11437,JDT
23,,SING,C5',O5',no,N,23,,15604,11437,JDT
24,,SING,N3,HN3,no,N,24,,15604,11437,JDT
25,,SING,C6,H6,no,N,25,,15604,11437,JDT
26,,SING,C7,H71,no,N,26,,15604,11437,JDT
27,,SING,C7,H72,no,N,27,,15604,11437,JDT
28,,SING,C1',H1',no,N,28,,15604,11437,JDT
29,,SING,C2',H2',no,N,29,,15604,11437,JDT
30,,SING,C2',H2'',no,N,30,,15604,11437,JDT
31,,SING,C3',H3',no,N,31,,15604,11437,JDT
32,,SING,O3',HO3',no,N,32,,15604,11437,JDT
33,,SING,C4',H4',no,N,33,,15604,11437,JDT
34,,SING,C5',H5',no,N,34,,15604,11437,JDT
35,,SING,C5',H5'',no,N,35,,15604,11437,JDT
36,,SING,C72,H72A,no,N,36,,15604,11437,JDT
37,,SING,C72,H72B,no,N,37,,15604,11437,JDT
38,,SING,C72,H72C,no,N,38,,15604,11437,JDT
39,,SING,OP2,HOP2,no,N,39,,15604,11437,JDT
40,,SING,OP3,HOP3,no,N,40,,15604,11437,JDT
1,,DOUB,OH,CH,no,N,1,,15945,11463,ALY
2,,SING,CH,CH3,no,N,2,,15945,11463,ALY
3,,SING,CH,NZ,no,N,3,,15945,11463,ALY
4,,SING,CH3,HH31,no,N,4,,15945,11463,ALY
5,,SING,CH3,HH32,no,N,5,,15945,11463,ALY
6,,SING,CH3,HH33,no,N,6,,15945,11463,ALY
7,,SING,NZ,CE,no,N,7,,15945,11463,ALY
8,,SING,NZ,HZ,no,N,8,,15945,11463,ALY
9,,SING,CE,CD,no,N,9,,15945,11463,ALY
10,,SING,CE,HE3,no,N,10,,15945,11463,ALY
11,,SING,CE,HE2,no,N,11,,15945,11463,ALY
12,,SING,CD,CG,no,N,12,,15945,11463,ALY
13,,SING,CD,HD3,no,N,13,,15945,11463,ALY
14,,SING,CD,HD2,no,N,14,,15945,11463,ALY
15,,SING,CG,CB,no,N,15,,15945,11463,ALY
16,,SING,CG,HG3,no,N,16,,15945,11463,ALY
17,,SING,CG,HG2,no,N,17,,15945,11463,ALY
18,,SING,CB,CA,no,N,18,,15945,11463,ALY
19,,SING,CB,HB3,no,N,19,,15945,11463,ALY
20,,SING,CB,HB2,no,N,20,,15945,11463,ALY
21,,SING,CA,N,no,N,21,,15945,11463,ALY
22,,SING,CA,C,no,N,22,,15945,11463,ALY
23,,SING,CA,HCA,no,N,23,,15945,11463,ALY
24,,SING,N,H,no,N,24,,15945,11463,ALY
25,,SING,N,H2,no,N,25,,15945,11463,ALY
26,,DOUB,C,O,no,N,26,,15945,11463,ALY
27,,SING,C,OXT,no,N,27,,15945,11463,ALY
28,,SING,OXT,HXT,no,N,28,,15945,11463,ALY
1,,SING,FE,NA,no,N,1,,16035,1147,HEC
2,,SING,FE,NB,no,N,2,,16035,1147,HEC
3,,SING,FE,NC,no,N,3,,16035,1147,HEC
4,,SING,FE,ND,no,N,4,,16035,1147,HEC
5,,DOUB,CHA,C1A,no,N,5,,16035,1147,HEC
6,,SING,CHA,C4D,no,N,6,,16035,1147,HEC
7,,SING,CHA,HHA,no,N,7,,16035,1147,HEC
8,,DOUB,CHB,C4A,no,N,8,,16035,1147,HEC
9,,SING,CHB,C1B,no,N,9,,16035,1147,HEC
10,,SING,CHB,HHB,no,N,10,,16035,1147,HEC
11,,DOUB,CHC,C4B,no,N,11,,16035,1147,HEC
12,,SING,CHC,C1C,no,N,12,,16035,1147,HEC
13,,SING,CHC,HHC,no,N,13,,16035,1147,HEC
14,,DOUB,CHD,C4C,no,N,14,,16035,1147,HEC
15,,SING,CHD,C1D,no,N,15,,16035,1147,HEC
16,,SING,CHD,HHD,no,N,16,,16035,1147,HEC
17,,SING,NA,C1A,yes,N,17,,16035,1147,HEC
18,,SING,NA,C4A,yes,N,18,,16035,1147,HEC
19,,SING,C1A,C2A,yes,N,19,,16035,1147,HEC
20,,DOUB,C2A,C3A,yes,N,20,,16035,1147,HEC
21,,SING,C2A,CAA,no,N,21,,16035,1147,HEC
22,,SING,C3A,C4A,yes,N,22,,16035,1147,HEC
23,,SING,C3A,CMA,no,N,23,,16035,1147,HEC
24,,SING,CMA,HMA1,no,N,24,,16035,1147,HEC
25,,SING,CMA,HMA2,no,N,25,,16035,1147,HEC
26,,SING,CMA,HMA3,no,N,26,,16035,1147,HEC
27,,SING,CAA,CBA,no,N,27,,16035,1147,HEC
28,,SING,CAA,HAA1,no,N,28,,16035,1147,HEC
29,,SING,CAA,HAA2,no,N,29,,16035,1147,HEC
30,,SING,CBA,CGA,no,N,30,,16035,1147,HEC
31,,SING,CBA,HBA1,no,N,31,,16035,1147,HEC
32,,SING,CBA,HBA2,no,N,32,,16035,1147,HEC
33,,DOUB,CGA,O1A,no,N,33,,16035,1147,HEC
34,,SING,CGA,O2A,no,N,34,,16035,1147,HEC
35,,SING,O2A,H2A,no,N,35,,16035,1147,HEC
36,,SING,NB,C1B,yes,N,36,,16035,1147,HEC
37,,SING,NB,C4B,yes,N,37,,16035,1147,HEC
38,,DOUB,C1B,C2B,yes,N,38,,16035,1147,HEC
39,,SING,C2B,C3B,yes,N,39,,16035,1147,HEC
40,,SING,C2B,CMB,no,N,40,,16035,1147,HEC
41,,SING,C3B,C4B,yes,N,41,,16035,1147,HEC
42,,DOUB,C3B,CAB,no,E,42,,16035,1147,HEC
43,,SING,CMB,HMB1,no,N,43,,16035,1147,HEC
44,,SING,CMB,HMB2,no,N,44,,16035,1147,HEC
45,,SING,CMB,HMB3,no,N,45,,16035,1147,HEC
46,,SING,CAB,CBB,no,N,46,,16035,1147,HEC
47,,SING,CAB,HAB,no,N,47,,16035,1147,HEC
48,,SING,CBB,HBB1,no,N,48,,16035,1147,HEC
49,,SING,CBB,HBB2,no,N,49,,16035,1147,HEC
50,,SING,CBB,HBB3,no,N,50,,16035,1147,HEC
51,,SING,NC,C1C,yes,N,51,,16035,1147,HEC
52,,SING,NC,C4C,yes,N,52,,16035,1147,HEC
53,,DOUB,C1C,C2C,yes,N,53,,16035,1147,HEC
54,,SING,C2C,C3C,yes,N,54,,16035,1147,HEC
55,,SING,C2C,CMC,no,N,55,,16035,1147,HEC
56,,SING,C3C,C4C,yes,N,56,,16035,1147,HEC
57,,DOUB,C3C,CAC,no,E,57,,16035,1147,HEC
58,,SING,CMC,HMC1,no,N,58,,16035,1147,HEC
59,,SING,CMC,HMC2,no,N,59,,16035,1147,HEC
60,,SING,CMC,HMC3,no,N,60,,16035,1147,HEC
61,,SING,CAC,CBC,no,N,61,,16035,1147,HEC
62,,SING,CAC,HAC,no,N,62,,16035,1147,HEC
63,,SING,CBC,HBC1,no,N,63,,16035,1147,HEC
64,,SING,CBC,HBC2,no,N,64,,16035,1147,HEC
65,,SING,CBC,HBC3,no,N,65,,16035,1147,HEC
66,,SING,ND,C1D,yes,N,66,,16035,1147,HEC
67,,SING,ND,C4D,yes,N,67,,16035,1147,HEC
68,,DOUB,C1D,C2D,yes,N,68,,16035,1147,HEC
69,,SING,C2D,C3D,yes,N,69,,16035,1147,HEC
70,,SING,C2D,CMD,no,N,70,,16035,1147,HEC
71,,DOUB,C3D,C4D,yes,N,71,,16035,1147,HEC
72,,SING,C3D,CAD,no,N,72,,16035,1147,HEC
73,,SING,CMD,HMD1,no,N,73,,16035,1147,HEC
74,,SING,CMD,HMD2,no,N,74,,16035,1147,HEC
75,,SING,CMD,HMD3,no,N,75,,16035,1147,HEC
76,,SING,CAD,CBD,no,N,76,,16035,1147,HEC
77,,SING,CAD,HAD1,no,N,77,,16035,1147,HEC
78,,SING,CAD,HAD2,no,N,78,,16035,1147,HEC
79,,SING,CBD,CGD,no,N,79,,16035,1147,HEC
80,,SING,CBD,HBD1,no,N,80,,16035,1147,HEC
81,,SING,CBD,HBD2,no,N,81,,16035,1147,HEC
82,,DOUB,CGD,O1D,no,N,82,,16035,1147,HEC
83,,SING,CGD,O2D,no,N,83,,16035,1147,HEC
84,,SING,O2D,H2D,no,N,84,,16035,1147,HEC
1,,DOUB,PG,O1G,no,N,1,,16090,11472,ATP
2,,SING,PG,O2G,no,N,2,,16090,11472,ATP
3,,SING,PG,O3G,no,N,3,,16090,11472,ATP
4,,SING,PG,O3B,no,N,4,,16090,11472,ATP
5,,SING,O2G,HOG2,no,N,5,,16090,11472,ATP
6,,SING,O3G,HOG3,no,N,6,,16090,11472,ATP
7,,DOUB,PB,O1B,no,N,7,,16090,11472,ATP
8,,SING,PB,O2B,no,N,8,,16090,11472,ATP
9,,SING,PB,O3B,no,N,9,,16090,11472,ATP
10,,SING,PB,O3A,no,N,10,,16090,11472,ATP
11,,SING,O2B,HOB2,no,N,11,,16090,11472,ATP
12,,DOUB,PA,O1A,no,N,12,,16090,11472,ATP
13,,SING,PA,O2A,no,N,13,,16090,11472,ATP
14,,SING,PA,O3A,no,N,14,,16090,11472,ATP
15,,SING,PA,O5',no,N,15,,16090,11472,ATP
16,,SING,O2A,HOA2,no,N,16,,16090,11472,ATP
17,,SING,O5',C5',no,N,17,,16090,11472,ATP
18,,SING,C5',C4',no,N,18,,16090,11472,ATP
19,,SING,C5',H5'1,no,N,19,,16090,11472,ATP
20,,SING,C5',H5'2,no,N,20,,16090,11472,ATP
21,,SING,C4',O4',no,N,21,,16090,11472,ATP
22,,SING,C4',C3',no,N,22,,16090,11472,ATP
23,,SING,C4',H4',no,N,23,,16090,11472,ATP
24,,SING,O4',C1',no,N,24,,16090,11472,ATP
25,,SING,C3',O3',no,N,25,,16090,11472,ATP
26,,SING,C3',C2',no,N,26,,16090,11472,ATP
27,,SING,C3',H3',no,N,27,,16090,11472,ATP
28,,SING,O3',HO3',no,N,28,,16090,11472,ATP
29,,SING,C2',O2',no,N,29,,16090,11472,ATP
30,,SING,C2',C1',no,N,30,,16090,11472,ATP
31,,SING,C2',H2',no,N,31,,16090,11472,ATP
32,,SING,O2',HO2',no,N,32,,16090,11472,ATP
33,,SING,C1',N9,no,N,33,,16090,11472,ATP
34,,SING,C1',H1',no,N,34,,16090,11472,ATP
35,,SING,N9,C8,yes,N,35,,16090,11472,ATP
36,,SING,N9,C4,yes,N,36,,16090,11472,ATP
37,,DOUB,C8,N7,yes,N,37,,16090,11472,ATP
38,,SING,C8,H8,no,N,38,,16090,11472,ATP
39,,SING,N7,C5,yes,N,39,,16090,11472,ATP
40,,SING,C5,C6,yes,N,40,,16090,11472,ATP
41,,DOUB,C5,C4,yes,N,41,,16090,11472,ATP
42,,SING,C6,N6,no,N,42,,16090,11472,ATP
43,,DOUB,C6,N1,yes,N,43,,16090,11472,ATP
44,,SING,N6,HN61,no,N,44,,16090,11472,ATP
45,,SING,N6,HN62,no,N,45,,16090,11472,ATP
46,,SING,N1,C2,yes,N,46,,16090,11472,ATP
47,,DOUB,C2,N3,yes,N,47,,16090,11472,ATP
48,,SING,C2,H2,no,N,48,,16090,11472,ATP
49,,SING,N3,C4,yes,N,49,,16090,11472,ATP
1,,SING,FE,NA,no,N,1,,16246,1148,HEC
2,,SING,FE,NB,no,N,2,,16246,1148,HEC
3,,SING,FE,NC,no,N,3,,16246,1148,HEC
4,,SING,FE,ND,no,N,4,,16246,1148,HEC
5,,DOUB,CHA,C1A,no,N,5,,16246,1148,HEC
6,,SING,CHA,C4D,no,N,6,,16246,1148,HEC
7,,SING,CHA,HHA,no,N,7,,16246,1148,HEC
8,,DOUB,CHB,C4A,no,N,8,,16246,1148,HEC
9,,SING,CHB,C1B,no,N,9,,16246,1148,HEC
10,,SING,CHB,HHB,no,N,10,,16246,1148,HEC
11,,DOUB,CHC,C4B,no,N,11,,16246,1148,HEC
12,,SING,CHC,C1C,no,N,12,,16246,1148,HEC
13,,SING,CHC,HHC,no,N,13,,16246,1148,HEC
14,,DOUB,CHD,C4C,no,N,14,,16246,1148,HEC
15,,SING,CHD,C1D,no,N,15,,16246,1148,HEC
16,,SING,CHD,HHD,no,N,16,,16246,1148,HEC
17,,SING,NA,C1A,yes,N,17,,16246,1148,HEC
18,,SING,NA,C4A,yes,N,18,,16246,1148,HEC
19,,SING,C1A,C2A,yes,N,19,,16246,1148,HEC
20,,DOUB,C2A,C3A,yes,N,20,,16246,1148,HEC
21,,SING,C2A,CAA,no,N,21,,16246,1148,HEC
22,,SING,C3A,C4A,yes,N,22,,16246,1148,HEC
23,,SING,C3A,CMA,no,N,23,,16246,1148,HEC
24,,SING,CMA,HMA1,no,N,24,,16246,1148,HEC
25,,SING,CMA,HMA2,no,N,25,,16246,1148,HEC
26,,SING,CMA,HMA3,no,N,26,,16246,1148,HEC
27,,SING,CAA,CBA,no,N,27,,16246,1148,HEC
28,,SING,CAA,HAA1,no,N,28,,16246,1148,HEC
29,,SING,CAA,HAA2,no,N,29,,16246,1148,HEC
30,,SING,CBA,CGA,no,N,30,,16246,1148,HEC
31,,SING,CBA,HBA1,no,N,31,,16246,1148,HEC
32,,SING,CBA,HBA2,no,N,32,,16246,1148,HEC
33,,DOUB,CGA,O1A,no,N,33,,16246,1148,HEC
34,,SING,CGA,O2A,no,N,34,,16246,1148,HEC
35,,SING,O2A,H2A,no,N,35,,16246,1148,HEC
36,,SING,NB,C1B,yes,N,36,,16246,1148,HEC
37,,SING,NB,C4B,yes,N,37,,16246,1148,HEC
38,,DOUB,C1B,C2B,yes,N,38,,16246,1148,HEC
39,,SING,C2B,C3B,yes,N,39,,16246,1148,HEC
40,,SING,C2B,CMB,no,N,40,,16246,1148,HEC
41,,SING,C3B,C4B,yes,N,41,,16246,1148,HEC
42,,DOUB,C3B,CAB,no,E,42,,16246,1148,HEC
43,,SING,CMB,HMB1,no,N,43,,16246,1148,HEC
44,,SING,CMB,HMB2,no,N,44,,16246,1148,HEC
45,,SING,CMB,HMB3,no,N,45,,16246,1148,HEC
46,,SING,CAB,CBB,no,N,46,,16246,1148,HEC
47,,SING,CAB,HAB,no,N,47,,16246,1148,HEC
48,,SING,CBB,HBB1,no,N,48,,16246,1148,HEC
49,,SING,CBB,HBB2,no,N,49,,16246,1148,HEC
50,,SING,CBB,HBB3,no,N,50,,16246,1148,HEC
51,,SING,NC,C1C,yes,N,51,,16246,1148,HEC
52,,SING,NC,C4C,yes,N,52,,16246,1148,HEC
53,,DOUB,C1C,C2C,yes,N,53,,16246,1148,HEC
54,,SING,C2C,C3C,yes,N,54,,16246,1148,HEC
55,,SING,C2C,CMC,no,N,55,,16246,1148,HEC
56,,SING,C3C,C4C,yes,N,56,,16246,1148,HEC
57,,DOUB,C3C,CAC,no,E,57,,16246,1148,HEC
58,,SING,CMC,HMC1,no,N,58,,16246,1148,HEC
59,,SING,CMC,HMC2,no,N,59,,16246,1148,HEC
60,,SING,CMC,HMC3,no,N,60,,16246,1148,HEC
61,,SING,CAC,CBC,no,N,61,,16246,1148,HEC
62,,SING,CAC,HAC,no,N,62,,16246,1148,HEC
63,,SING,CBC,HBC1,no,N,63,,16246,1148,HEC
64,,SING,CBC,HBC2,no,N,64,,16246,1148,HEC
65,,SING,CBC,HBC3,no,N,65,,16246,1148,HEC
66,,SING,ND,C1D,yes,N,66,,16246,1148,HEC
67,,SING,ND,C4D,yes,N,67,,16246,1148,HEC
68,,DOUB,C1D,C2D,yes,N,68,,16246,1148,HEC
69,,SING,C2D,C3D,yes,N,69,,16246,1148,HEC
70,,SING,C2D,CMD,no,N,70,,16246,1148,HEC
71,,DOUB,C3D,C4D,yes,N,71,,16246,1148,HEC
72,,SING,C3D,CAD,no,N,72,,16246,1148,HEC
73,,SING,CMD,HMD1,no,N,73,,16246,1148,HEC
74,,SING,CMD,HMD2,no,N,74,,16246,1148,HEC
75,,SING,CMD,HMD3,no,N,75,,16246,1148,HEC
76,,SING,CAD,CBD,no,N,76,,16246,1148,HEC
77,,SING,CAD,HAD1,no,N,77,,16246,1148,HEC
78,,SING,CAD,HAD2,no,N,78,,16246,1148,HEC
79,,SING,CBD,CGD,no,N,79,,16246,1148,HEC
80,,SING,CBD,HBD1,no,N,80,,16246,1148,HEC
81,,SING,CBD,HBD2,no,N,81,,16246,1148,HEC
82,,DOUB,CGD,O1D,no,N,82,,16246,1148,HEC
83,,SING,CGD,O2D,no,N,83,,16246,1148,HEC
84,,SING,O2D,H2D,no,N,84,,16246,1148,HEC
1,,SING,FE,NA,no,N,1,,16463,1149,HEC
2,,SING,FE,NB,no,N,2,,16463,1149,HEC
3,,SING,FE,NC,no,N,3,,16463,1149,HEC
4,,SING,FE,ND,no,N,4,,16463,1149,HEC
5,,DOUB,CHA,C1A,no,N,5,,16463,1149,HEC
6,,SING,CHA,C4D,no,N,6,,16463,1149,HEC
7,,SING,CHA,HHA,no,N,7,,16463,1149,HEC
8,,DOUB,CHB,C4A,no,N,8,,16463,1149,HEC
9,,SING,CHB,C1B,no,N,9,,16463,1149,HEC
10,,SING,CHB,HHB,no,N,10,,16463,1149,HEC
11,,DOUB,CHC,C4B,no,N,11,,16463,1149,HEC
12,,SING,CHC,C1C,no,N,12,,16463,1149,HEC
13,,SING,CHC,HHC,no,N,13,,16463,1149,HEC
14,,DOUB,CHD,C4C,no,N,14,,16463,1149,HEC
15,,SING,CHD,C1D,no,N,15,,16463,1149,HEC
16,,SING,CHD,HHD,no,N,16,,16463,1149,HEC
17,,SING,NA,C1A,yes,N,17,,16463,1149,HEC
18,,SING,NA,C4A,yes,N,18,,16463,1149,HEC
19,,SING,C1A,C2A,yes,N,19,,16463,1149,HEC
20,,DOUB,C2A,C3A,yes,N,20,,16463,1149,HEC
21,,SING,C2A,CAA,no,N,21,,16463,1149,HEC
22,,SING,C3A,C4A,yes,N,22,,16463,1149,HEC
23,,SING,C3A,CMA,no,N,23,,16463,1149,HEC
24,,SING,CMA,HMA1,no,N,24,,16463,1149,HEC
25,,SING,CMA,HMA2,no,N,25,,16463,1149,HEC
26,,SING,CMA,HMA3,no,N,26,,16463,1149,HEC
27,,SING,CAA,CBA,no,N,27,,16463,1149,HEC
28,,SING,CAA,HAA1,no,N,28,,16463,1149,HEC
29,,SING,CAA,HAA2,no,N,29,,16463,1149,HEC
30,,SING,CBA,CGA,no,N,30,,16463,1149,HEC
31,,SING,CBA,HBA1,no,N,31,,16463,1149,HEC
32,,SING,CBA,HBA2,no,N,32,,16463,1149,HEC
33,,DOUB,CGA,O1A,no,N,33,,16463,1149,HEC
34,,SING,CGA,O2A,no,N,34,,16463,1149,HEC
35,,SING,O2A,H2A,no,N,35,,16463,1149,HEC
36,,SING,NB,C1B,yes,N,36,,16463,1149,HEC
37,,SING,NB,C4B,yes,N,37,,16463,1149,HEC
38,,DOUB,C1B,C2B,yes,N,38,,16463,1149,HEC
39,,SING,C2B,C3B,yes,N,39,,16463,1149,HEC
40,,SING,C2B,CMB,no,N,40,,16463,1149,HEC
41,,SING,C3B,C4B,yes,N,41,,16463,1149,HEC
42,,DOUB,C3B,CAB,no,E,42,,16463,1149,HEC
43,,SING,CMB,HMB1,no,N,43,,16463,1149,HEC
44,,SING,CMB,HMB2,no,N,44,,16463,1149,HEC
45,,SING,CMB,HMB3,no,N,45,,16463,1149,HEC
46,,SING,CAB,CBB,no,N,46,,16463,1149,HEC
47,,SING,CAB,HAB,no,N,47,,16463,1149,HEC
48,,SING,CBB,HBB1,no,N,48,,16463,1149,HEC
49,,SING,CBB,HBB2,no,N,49,,16463,1149,HEC
50,,SING,CBB,HBB3,no,N,50,,16463,1149,HEC
51,,SING,NC,C1C,yes,N,51,,16463,1149,HEC
52,,SING,NC,C4C,yes,N,52,,16463,1149,HEC
53,,DOUB,C1C,C2C,yes,N,53,,16463,1149,HEC
54,,SING,C2C,C3C,yes,N,54,,16463,1149,HEC
55,,SING,C2C,CMC,no,N,55,,16463,1149,HEC
56,,SING,C3C,C4C,yes,N,56,,16463,1149,HEC
57,,DOUB,C3C,CAC,no,E,57,,16463,1149,HEC
58,,SING,CMC,HMC1,no,N,58,,16463,1149,HEC
59,,SING,CMC,HMC2,no,N,59,,16463,1149,HEC
60,,SING,CMC,HMC3,no,N,60,,16463,1149,HEC
61,,SING,CAC,CBC,no,N,61,,16463,1149,HEC
62,,SING,CAC,HAC,no,N,62,,16463,1149,HEC
63,,SING,CBC,HBC1,no,N,63,,16463,1149,HEC
64,,SING,CBC,HBC2,no,N,64,,16463,1149,HEC
65,,SING,CBC,HBC3,no,N,65,,16463,1149,HEC
66,,SING,ND,C1D,yes,N,66,,16463,1149,HEC
67,,SING,ND,C4D,yes,N,67,,16463,1149,HEC
68,,DOUB,C1D,C2D,yes,N,68,,16463,1149,HEC
69,,SING,C2D,C3D,yes,N,69,,16463,1149,HEC
70,,SING,C2D,CMD,no,N,70,,16463,1149,HEC
71,,DOUB,C3D,C4D,yes,N,71,,16463,1149,HEC
72,,SING,C3D,CAD,no,N,72,,16463,1149,HEC
73,,SING,CMD,HMD1,no,N,73,,16463,1149,HEC
74,,SING,CMD,HMD2,no,N,74,,16463,1149,HEC
75,,SING,CMD,HMD3,no,N,75,,16463,1149,HEC
76,,SING,CAD,CBD,no,N,76,,16463,1149,HEC
77,,SING,CAD,HAD1,no,N,77,,16463,1149,HEC
78,,SING,CAD,HAD2,no,N,78,,16463,1149,HEC
79,,SING,CBD,CGD,no,N,79,,16463,1149,HEC
80,,SING,CBD,HBD1,no,N,80,,16463,1149,HEC
81,,SING,CBD,HBD2,no,N,81,,16463,1149,HEC
82,,DOUB,CGD,O1D,no,N,82,,16463,1149,HEC
83,,SING,CGD,O2D,no,N,83,,16463,1149,HEC
84,,SING,O2D,H2D,no,N,84,,16463,1149,HEC
1,,DOUB,PA,O1A,no,N,1,,16515,11492,NAP
2,,SING,PA,O2A,no,N,2,,16515,11492,NAP
3,,SING,PA,O5B,no,N,3,,16515,11492,NAP
4,,SING,PA,O3,no,N,4,,16515,11492,NAP
5,,SING,O2A,HOA2,no,N,5,,16515,11492,NAP
6,,SING,O5B,C5B,no,N,6,,16515,11492,NAP
7,,SING,C5B,C4B,no,N,7,,16515,11492,NAP
8,,SING,C5B,H51A,no,N,8,,16515,11492,NAP
9,,SING,C5B,H52A,no,N,9,,16515,11492,NAP
10,,SING,C4B,O4B,no,N,10,,16515,11492,NAP
11,,SING,C4B,C3B,no,N,11,,16515,11492,NAP
12,,SING,C4B,H4B,no,N,12,,16515,11492,NAP
13,,SING,O4B,C1B,no,N,13,,16515,11492,NAP
14,,SING,C3B,O3B,no,N,14,,16515,11492,NAP
15,,SING,C3B,C2B,no,N,15,,16515,11492,NAP
16,,SING,C3B,H3B,no,N,16,,16515,11492,NAP
17,,SING,O3B,HO3A,no,N,17,,16515,11492,NAP
18,,SING,C2B,O2B,no,N,18,,16515,11492,NAP
19,,SING,C2B,C1B,no,N,19,,16515,11492,NAP
20,,SING,C2B,H2B,no,N,20,,16515,11492,NAP
21,,SING,O2B,P2B,no,N,21,,16515,11492,NAP
22,,SING,C1B,N9A,no,N,22,,16515,11492,NAP
23,,SING,C1B,H1B,no,N,23,,16515,11492,NAP
24,,SING,N9A,C8A,yes,N,24,,16515,11492,NAP
25,,SING,N9A,C4A,yes,N,25,,16515,11492,NAP
26,,DOUB,C8A,N7A,yes,N,26,,16515,11492,NAP
27,,SING,C8A,H8A,no,N,27,,16515,11492,NAP
28,,SING,N7A,C5A,yes,N,28,,16515,11492,NAP
29,,SING,C5A,C6A,yes,N,29,,16515,11492,NAP
30,,DOUB,C5A,C4A,yes,N,30,,16515,11492,NAP
31,,SING,C6A,N6A,no,N,31,,16515,11492,NAP
32,,DOUB,C6A,N1A,yes,N,32,,16515,11492,NAP
33,,SING,N6A,H61A,no,N,33,,16515,11492,NAP
34,,SING,N6A,H62A,no,N,34,,16515,11492,NAP
35,,SING,N1A,C2A,yes,N,35,,16515,11492,NAP
36,,DOUB,C2A,N3A,yes,N,36,,16515,11492,NAP
37,,SING,C2A,H2A,no,N,37,,16515,11492,NAP
38,,SING,N3A,C4A,yes,N,38,,16515,11492,NAP
39,,SING,O3,PN,no,N,39,,16515,11492,NAP
40,,DOUB,PN,O1N,no,N,40,,16515,11492,NAP
41,,SING,PN,O2N,no,N,41,,16515,11492,NAP
42,,SING,PN,O5D,no,N,42,,16515,11492,NAP
43,,SING,O5D,C5D,no,N,43,,16515,11492,NAP
44,,SING,C5D,C4D,no,N,44,,16515,11492,NAP
45,,SING,C5D,H51N,no,N,45,,16515,11492,NAP
46,,SING,C5D,H52N,no,N,46,,16515,11492,NAP
47,,SING,C4D,O4D,no,N,47,,16515,11492,NAP
48,,SING,C4D,C3D,no,N,48,,16515,11492,NAP
49,,SING,C4D,H4D,no,N,49,,16515,11492,NAP
50,,SING,O4D,C1D,no,N,50,,16515,11492,NAP
51,,SING,C3D,O3D,no,N,51,,16515,11492,NAP
52,,SING,C3D,C2D,no,N,52,,16515,11492,NAP
53,,SING,C3D,H3D,no,N,53,,16515,11492,NAP
54,,SING,O3D,HO3N,no,N,54,,16515,11492,NAP
55,,SING,C2D,O2D,no,N,55,,16515,11492,NAP
56,,SING,C2D,C1D,no,N,56,,16515,11492,NAP
57,,SING,C2D,H2D,no,N,57,,16515,11492,NAP
58,,SING,O2D,HO2N,no,N,58,,16515,11492,NAP
59,,SING,C1D,N1N,no,N,59,,16515,11492,NAP
60,,SING,C1D,H1D,no,N,60,,16515,11492,NAP
61,,SING,N1N,C2N,yes,N,61,,16515,11492,NAP
62,,DOUB,N1N,C6N,yes,N,62,,16515,11492,NAP
63,,DOUB,C2N,C3N,yes,N,63,,16515,11492,NAP
64,,SING,C2N,H2N,no,N,64,,16515,11492,NAP
65,,SING,C3N,C7N,no,N,65,,16515,11492,NAP
66,,SING,C3N,C4N,yes,N,66,,16515,11492,NAP
67,,DOUB,C7N,O7N,no,N,67,,16515,11492,NAP
68,,SING,C7N,N7N,no,N,68,,16515,11492,NAP
69,,SING,N7N,H71N,no,N,69,,16515,11492,NAP
70,,SING,N7N,H72N,no,N,70,,16515,11492,NAP
71,,DOUB,C4N,C5N,yes,N,71,,16515,11492,NAP
72,,SING,C4N,H4N,no,N,72,,16515,11492,NAP
73,,SING,C5N,C6N,yes,N,73,,16515,11492,NAP
74,,SING,C5N,H5N,no,N,74,,16515,11492,NAP
75,,SING,C6N,H6N,no,N,75,,16515,11492,NAP
76,,DOUB,P2B,O1X,no,N,76,,16515,11492,NAP
77,,SING,P2B,O2X,no,N,77,,16515,11492,NAP
78,,SING,P2B,O3X,no,N,78,,16515,11492,NAP
79,,SING,O2X,HOP2,no,N,79,,16515,11492,NAP
80,,SING,O3X,HOP3,no,N,80,,16515,11492,NAP
1,,SING,N1,C2,yes,N,1,,16516,11492,FOL
2,,SING,N1,C8A,yes,N,2,,16516,11492,FOL
3,,SING,N1,HN1,no,N,3,,16516,11492,FOL
4,,SING,C2,NA2,no,N,4,,16516,11492,FOL
5,,DOUB,C2,N3,yes,N,5,,16516,11492,FOL
6,,SING,NA2,HN21,no,N,6,,16516,11492,FOL
7,,SING,NA2,HN22,no,N,7,,16516,11492,FOL
8,,SING,N3,C4,yes,N,8,,16516,11492,FOL
9,,DOUB,C4,O4,no,N,9,,16516,11492,FOL
10,,SING,C4,C4A,yes,N,10,,16516,11492,FOL
11,,SING,C4A,N5,yes,N,11,,16516,11492,FOL
12,,DOUB,C4A,C8A,yes,N,12,,16516,11492,FOL
13,,DOUB,N5,C6,yes,N,13,,16516,11492,FOL
14,,SING,C6,C7,yes,N,14,,16516,11492,FOL
15,,SING,C6,C9,no,N,15,,16516,11492,FOL
16,,DOUB,C7,N8,yes,N,16,,16516,11492,FOL
17,,SING,C7,H7,no,N,17,,16516,11492,FOL
18,,SING,N8,C8A,yes,N,18,,16516,11492,FOL
19,,SING,C9,N10,no,N,19,,16516,11492,FOL
20,,SING,C9,H91,no,N,20,,16516,11492,FOL
21,,SING,C9,H92,no,N,21,,16516,11492,FOL
22,,SING,N10,C14,no,N,22,,16516,11492,FOL
23,,SING,N10,HN0,no,N,23,,16516,11492,FOL
24,,DOUB,C11,C12,yes,N,24,,16516,11492,FOL
25,,SING,C11,C16,yes,N,25,,16516,11492,FOL
26,,SING,C11,C,no,N,26,,16516,11492,FOL
27,,SING,C12,C13,yes,N,27,,16516,11492,FOL
28,,SING,C12,H12,no,N,28,,16516,11492,FOL
29,,DOUB,C13,C14,yes,N,29,,16516,11492,FOL
30,,SING,C13,H13,no,N,30,,16516,11492,FOL
31,,SING,C14,C15,yes,N,31,,16516,11492,FOL
32,,DOUB,C15,C16,yes,N,32,,16516,11492,FOL
33,,SING,C15,H15,no,N,33,,16516,11492,FOL
34,,SING,C16,H16,no,N,34,,16516,11492,FOL
35,,DOUB,C,O,no,N,35,,16516,11492,FOL
36,,SING,C,N,no,N,36,,16516,11492,FOL
37,,SING,N,CA,no,N,37,,16516,11492,FOL
38,,SING,N,HN,no,N,38,,16516,11492,FOL
39,,SING,CA,CB,no,N,39,,16516,11492,FOL
40,,SING,CA,CT,no,N,40,,16516,11492,FOL
41,,SING,CA,HA,no,N,41,,16516,11492,FOL
42,,SING,CB,CG,no,N,42,,16516,11492,FOL
43,,SING,CB,HB1,no,N,43,,16516,11492,FOL
44,,SING,CB,HB2,no,N,44,,16516,11492,FOL
45,,SING,CG,CD,no,N,45,,16516,11492,FOL
46,,SING,CG,HG1,no,N,46,,16516,11492,FOL
47,,SING,CG,HG2,no,N,47,,16516,11492,FOL
48,,DOUB,CD,OE1,no,N,48,,16516,11492,FOL
49,,SING,CD,OE2,no,N,49,,16516,11492,FOL
50,,SING,OE2,HOE2,no,N,50,,16516,11492,FOL
51,,DOUB,CT,O1,no,N,51,,16516,11492,FOL
52,,SING,CT,O2,no,N,52,,16516,11492,FOL
53,,SING,O2,HO2,no,N,53,,16516,11492,FOL
1,,SING,N,CA,no,N,1,,16579,11496,M3L
2,,SING,N,H,no,N,2,,16579,11496,M3L
3,,SING,N,H2,no,N,3,,16579,11496,M3L
4,,SING,CA,CB,no,N,4,,16579,11496,M3L
5,,SING,CA,C,no,N,5,,16579,11496,M3L
6,,SING,CA,HA,no,N,6,,16579,11496,M3L
7,,SING,CB,CG,no,N,7,,16579,11496,M3L
8,,SING,CB,HB2,no,N,8,,16579,11496,M3L
9,,SING,CB,HB3,no,N,9,,16579,11496,M3L
10,,SING,CG,CD,no,N,10,,16579,11496,M3L
11,,SING,CG,HG2,no,N,11,,16579,11496,M3L
12,,SING,CG,HG3,no,N,12,,16579,11496,M3L
13,,SING,CD,CE,no,N,13,,16579,11496,M3L
14,,SING,CD,HD2,no,N,14,,16579,11496,M3L
15,,SING,CD,HD3,no,N,15,,16579,11496,M3L
16,,SING,CE,NZ,no,N,16,,16579,11496,M3L
17,,SING,CE,HE2,no,N,17,,16579,11496,M3L
18,,SING,CE,HE3,no,N,18,,16579,11496,M3L
19,,SING,NZ,CM1,no,N,19,,16579,11496,M3L
20,,SING,NZ,CM2,no,N,20,,16579,11496,M3L
21,,SING,NZ,CM3,no,N,21,,16579,11496,M3L
22,,DOUB,C,O,no,N,22,,16579,11496,M3L
23,,SING,C,OXT,no,N,23,,16579,11496,M3L
24,,SING,OXT,HXT,no,N,24,,16579,11496,M3L
25,,SING,CM1,HM11,no,N,25,,16579,11496,M3L
26,,SING,CM1,HM12,no,N,26,,16579,11496,M3L
27,,SING,CM1,HM13,no,N,27,,16579,11496,M3L
28,,SING,CM2,HM21,no,N,28,,16579,11496,M3L
29,,SING,CM2,HM22,no,N,29,,16579,11496,M3L
30,,SING,CM2,HM23,no,N,30,,16579,11496,M3L
31,,SING,CM3,HM31,no,N,31,,16579,11496,M3L
32,,SING,CM3,HM32,no,N,32,,16579,11496,M3L
33,,SING,CM3,HM33,no,N,33,,16579,11496,M3L
1,,SING,FE,NA,no,N,1,,16667,1150,HEC
2,,SING,FE,NB,no,N,2,,16667,1150,HEC
3,,SING,FE,NC,no,N,3,,16667,1150,HEC
4,,SING,FE,ND,no,N,4,,16667,1150,HEC
5,,DOUB,CHA,C1A,no,N,5,,16667,1150,HEC
6,,SING,CHA,C4D,no,N,6,,16667,1150,HEC
7,,SING,CHA,HHA,no,N,7,,16667,1150,HEC
8,,DOUB,CHB,C4A,no,N,8,,16667,1150,HEC
9,,SING,CHB,C1B,no,N,9,,16667,1150,HEC
10,,SING,CHB,HHB,no,N,10,,16667,1150,HEC
11,,DOUB,CHC,C4B,no,N,11,,16667,1150,HEC
12,,SING,CHC,C1C,no,N,12,,16667,1150,HEC
13,,SING,CHC,HHC,no,N,13,,16667,1150,HEC
14,,DOUB,CHD,C4C,no,N,14,,16667,1150,HEC
15,,SING,CHD,C1D,no,N,15,,16667,1150,HEC
16,,SING,CHD,HHD,no,N,16,,16667,1150,HEC
17,,SING,NA,C1A,yes,N,17,,16667,1150,HEC
18,,SING,NA,C4A,yes,N,18,,16667,1150,HEC
19,,SING,C1A,C2A,yes,N,19,,16667,1150,HEC
20,,DOUB,C2A,C3A,yes,N,20,,16667,1150,HEC
21,,SING,C2A,CAA,no,N,21,,16667,1150,HEC
22,,SING,C3A,C4A,yes,N,22,,16667,1150,HEC
23,,SING,C3A,CMA,no,N,23,,16667,1150,HEC
24,,SING,CMA,HMA1,no,N,24,,16667,1150,HEC
25,,SING,CMA,HMA2,no,N,25,,16667,1150,HEC
26,,SING,CMA,HMA3,no,N,26,,16667,1150,HEC
27,,SING,CAA,CBA,no,N,27,,16667,1150,HEC
28,,SING,CAA,HAA1,no,N,28,,16667,1150,HEC
29,,SING,CAA,HAA2,no,N,29,,16667,1150,HEC
30,,SING,CBA,CGA,no,N,30,,16667,1150,HEC
31,,SING,CBA,HBA1,no,N,31,,16667,1150,HEC
32,,SING,CBA,HBA2,no,N,32,,16667,1150,HEC
33,,DOUB,CGA,O1A,no,N,33,,16667,1150,HEC
34,,SING,CGA,O2A,no,N,34,,16667,1150,HEC
35,,SING,O2A,H2A,no,N,35,,16667,1150,HEC
36,,SING,NB,C1B,yes,N,36,,16667,1150,HEC
37,,SING,NB,C4B,yes,N,37,,16667,1150,HEC
38,,DOUB,C1B,C2B,yes,N,38,,16667,1150,HEC
39,,SING,C2B,C3B,yes,N,39,,16667,1150,HEC
40,,SING,C2B,CMB,no,N,40,,16667,1150,HEC
41,,SING,C3B,C4B,yes,N,41,,16667,1150,HEC
42,,DOUB,C3B,CAB,no,E,42,,16667,1150,HEC
43,,SING,CMB,HMB1,no,N,43,,16667,1150,HEC
44,,SING,CMB,HMB2,no,N,44,,16667,1150,HEC
45,,SING,CMB,HMB3,no,N,45,,16667,1150,HEC
46,,SING,CAB,CBB,no,N,46,,16667,1150,HEC
47,,SING,CAB,HAB,no,N,47,,16667,1150,HEC
48,,SING,CBB,HBB1,no,N,48,,16667,1150,HEC
49,,SING,CBB,HBB2,no,N,49,,16667,1150,HEC
50,,SING,CBB,HBB3,no,N,50,,16667,1150,HEC
51,,SING,NC,C1C,yes,N,51,,16667,1150,HEC
52,,SING,NC,C4C,yes,N,52,,16667,1150,HEC
53,,DOUB,C1C,C2C,yes,N,53,,16667,1150,HEC
54,,SING,C2C,C3C,yes,N,54,,16667,1150,HEC
55,,SING,C2C,CMC,no,N,55,,16667,1150,HEC
56,,SING,C3C,C4C,yes,N,56,,16667,1150,HEC
57,,DOUB,C3C,CAC,no,E,57,,16667,1150,HEC
58,,SING,CMC,HMC1,no,N,58,,16667,1150,HEC
59,,SING,CMC,HMC2,no,N,59,,16667,1150,HEC
60,,SING,CMC,HMC3,no,N,60,,16667,1150,HEC
61,,SING,CAC,CBC,no,N,61,,16667,1150,HEC
62,,SING,CAC,HAC,no,N,62,,16667,1150,HEC
63,,SING,CBC,HBC1,no,N,63,,16667,1150,HEC
64,,SING,CBC,HBC2,no,N,64,,16667,1150,HEC
65,,SING,CBC,HBC3,no,N,65,,16667,1150,HEC
66,,SING,ND,C1D,yes,N,66,,16667,1150,HEC
67,,SING,ND,C4D,yes,N,67,,16667,1150,HEC
68,,DOUB,C1D,C2D,yes,N,68,,16667,1150,HEC
69,,SING,C2D,C3D,yes,N,69,,16667,1150,HEC
70,,SING,C2D,CMD,no,N,70,,16667,1150,HEC
71,,DOUB,C3D,C4D,yes,N,71,,16667,1150,HEC
72,,SING,C3D,CAD,no,N,72,,16667,1150,HEC
73,,SING,CMD,HMD1,no,N,73,,16667,1150,HEC
74,,SING,CMD,HMD2,no,N,74,,16667,1150,HEC
75,,SING,CMD,HMD3,no,N,75,,16667,1150,HEC
76,,SING,CAD,CBD,no,N,76,,16667,1150,HEC
77,,SING,CAD,HAD1,no,N,77,,16667,1150,HEC
78,,SING,CAD,HAD2,no,N,78,,16667,1150,HEC
79,,SING,CBD,CGD,no,N,79,,16667,1150,HEC
80,,SING,CBD,HBD1,no,N,80,,16667,1150,HEC
81,,SING,CBD,HBD2,no,N,81,,16667,1150,HEC
82,,DOUB,CGD,O1D,no,N,82,,16667,1150,HEC
83,,SING,CGD,O2D,no,N,83,,16667,1150,HEC
84,,SING,O2D,H2D,no,N,84,,16667,1150,HEC
1,,SING,N,CA,no,N,1,,16746,11504,SEP
2,,SING,N,H,no,N,2,,16746,11504,SEP
3,,SING,N,H2,no,N,3,,16746,11504,SEP
4,,SING,CA,CB,no,N,4,,16746,11504,SEP
5,,SING,CA,C,no,N,5,,16746,11504,SEP
6,,SING,CA,HA,no,N,6,,16746,11504,SEP
7,,SING,CB,OG,no,N,7,,16746,11504,SEP
8,,SING,CB,HB2,no,N,8,,16746,11504,SEP
9,,SING,CB,HB3,no,N,9,,16746,11504,SEP
10,,SING,OG,P,no,N,10,,16746,11504,SEP
11,,DOUB,C,O,no,N,11,,16746,11504,SEP
12,,SING,C,OXT,no,N,12,,16746,11504,SEP
13,,SING,OXT,HXT,no,N,13,,16746,11504,SEP
14,,DOUB,P,O1P,no,N,14,,16746,11504,SEP
15,,SING,P,O2P,no,N,15,,16746,11504,SEP
16,,SING,P,O3P,no,N,16,,16746,11504,SEP
17,,SING,O2P,HOP2,no,N,17,,16746,11504,SEP
18,,SING,O3P,HOP3,no,N,18,,16746,11504,SEP
1,,SING,N,CA,no,N,1,,16821,11508,PTR
2,,SING,N,H,no,N,2,,16821,11508,PTR
3,,SING,N,HN2,no,N,3,,16821,11508,PTR
4,,SING,CA,C,no,N,4,,16821,11508,PTR
5,,SING,CA,CB,no,N,5,,16821,11508,PTR
6,,SING,CA,HA,no,N,6,,16821,11508,PTR
7,,DOUB,C,O,no,N,7,,16821,11508,PTR
8,,SING,C,OXT,no,N,8,,16821,11508,PTR
9,,SING,OXT,HXT,no,N,9,,16821,11508,PTR
10,,SING,CB,CG,no,N,10,,16821,11508,PTR
11,,SING,CB,HB2,no,N,11,,16821,11508,PTR
12,,SING,CB,HB3,no,N,12,,16821,11508,PTR
13,,DOUB,CG,CD1,yes,N,13,,16821,11508,PTR
14,,SING,CG,CD2,yes,N,14,,16821,11508,PTR
15,,SING,CD1,CE1,yes,N,15,,16821,11508,PTR
16,,SING,CD1,HD1,no,N,16,,16821,11508,PTR
17,,DOUB,CD2,CE2,yes,N,17,,16821,11508,PTR
18,,SING,CD2,HD2,no,N,18,,16821,11508,PTR
19,,DOUB,CE1,CZ,yes,N,19,,16821,11508,PTR
20,,SING,CE1,HE1,no,N,20,,16821,11508,PTR
21,,SING,CE2,CZ,yes,N,21,,16821,11508,PTR
22,,SING,CE2,HE2,no,N,22,,16821,11508,PTR
23,,SING,CZ,OH,no,N,23,,16821,11508,PTR
24,,SING,OH,P,no,N,24,,16821,11508,PTR
25,,DOUB,P,O1P,no,N,25,,16821,11508,PTR
26,,SING,P,O2P,no,N,26,,16821,11508,PTR
27,,SING,P,O3P,no,N,27,,16821,11508,PTR
28,,SING,O2P,HO2P,no,N,28,,16821,11508,PTR
13,,SING,O1,C7,,,,,22798,15120,NGH
29,,SING,O3P,HO3P,no,N,29,,16821,11508,PTR
1,,SING,N,HN1,no,N,1,,17296,11538,NH2
2,,SING,N,HN2,no,N,2,,17296,11538,NH2
1,,SING,N,HN1,no,N,1,,17312,11539,NH2
2,,SING,N,HN2,no,N,2,,17312,11539,NH2
1,,SING,N,HN1,no,N,1,,17390,11543,NH2
2,,SING,N,HN2,no,N,2,,17390,11543,NH2
1,,SING,N,HN1,no,N,1,,17551,11551,NH2
2,,SING,N,HN2,no,N,2,,17551,11551,NH2
1,,SING,N,HN1,no,N,1,,17569,11552,NH2
2,,SING,N,HN2,no,N,2,,17569,11552,NH2
1,,SING,N,HN1,no,N,1,,17587,11553,NH2
2,,SING,N,HN2,no,N,2,,17587,11553,NH2
1,,SING,N,HN1,no,N,1,,17605,11554,NH2
2,,SING,N,HN2,no,N,2,,17605,11554,NH2
1,,SING,N1,C2,yes,N,1,,17640,11556,FOL
2,,SING,N1,C8A,yes,N,2,,17640,11556,FOL
3,,SING,N1,HN1,no,N,3,,17640,11556,FOL
4,,SING,C2,NA2,no,N,4,,17640,11556,FOL
5,,DOUB,C2,N3,yes,N,5,,17640,11556,FOL
6,,SING,NA2,HN21,no,N,6,,17640,11556,FOL
7,,SING,NA2,HN22,no,N,7,,17640,11556,FOL
8,,SING,N3,C4,yes,N,8,,17640,11556,FOL
9,,DOUB,C4,O4,no,N,9,,17640,11556,FOL
10,,SING,C4,C4A,yes,N,10,,17640,11556,FOL
11,,SING,C4A,N5,yes,N,11,,17640,11556,FOL
12,,DOUB,C4A,C8A,yes,N,12,,17640,11556,FOL
13,,DOUB,N5,C6,yes,N,13,,17640,11556,FOL
14,,SING,C6,C7,yes,N,14,,17640,11556,FOL
15,,SING,C6,C9,no,N,15,,17640,11556,FOL
16,,DOUB,C7,N8,yes,N,16,,17640,11556,FOL
17,,SING,C7,H7,no,N,17,,17640,11556,FOL
18,,SING,N8,C8A,yes,N,18,,17640,11556,FOL
19,,SING,C9,N10,no,N,19,,17640,11556,FOL
20,,SING,C9,H91,no,N,20,,17640,11556,FOL
21,,SING,C9,H92,no,N,21,,17640,11556,FOL
22,,SING,N10,C14,no,N,22,,17640,11556,FOL
23,,SING,N10,HN0,no,N,23,,17640,11556,FOL
24,,DOUB,C11,C12,yes,N,24,,17640,11556,FOL
25,,SING,C11,C16,yes,N,25,,17640,11556,FOL
26,,SING,C11,C,no,N,26,,17640,11556,FOL
27,,SING,C12,C13,yes,N,27,,17640,11556,FOL
28,,SING,C12,H12,no,N,28,,17640,11556,FOL
29,,DOUB,C13,C14,yes,N,29,,17640,11556,FOL
30,,SING,C13,H13,no,N,30,,17640,11556,FOL
31,,SING,C14,C15,yes,N,31,,17640,11556,FOL
32,,DOUB,C15,C16,yes,N,32,,17640,11556,FOL
33,,SING,C15,H15,no,N,33,,17640,11556,FOL
34,,SING,C16,H16,no,N,34,,17640,11556,FOL
35,,DOUB,C,O,no,N,35,,17640,11556,FOL
36,,SING,C,N,no,N,36,,17640,11556,FOL
37,,SING,N,CA,no,N,37,,17640,11556,FOL
38,,SING,N,HN,no,N,38,,17640,11556,FOL
39,,SING,CA,CB,no,N,39,,17640,11556,FOL
40,,SING,CA,CT,no,N,40,,17640,11556,FOL
41,,SING,CA,HA,no,N,41,,17640,11556,FOL
42,,SING,CB,CG,no,N,42,,17640,11556,FOL
43,,SING,CB,HB1,no,N,43,,17640,11556,FOL
44,,SING,CB,HB2,no,N,44,,17640,11556,FOL
45,,SING,CG,CD,no,N,45,,17640,11556,FOL
46,,SING,CG,HG1,no,N,46,,17640,11556,FOL
47,,SING,CG,HG2,no,N,47,,17640,11556,FOL
48,,DOUB,CD,OE1,no,N,48,,17640,11556,FOL
49,,SING,CD,OE2,no,N,49,,17640,11556,FOL
50,,SING,OE2,HOE2,no,N,50,,17640,11556,FOL
51,,DOUB,CT,O1,no,N,51,,17640,11556,FOL
52,,SING,CT,O2,no,N,52,,17640,11556,FOL
53,,SING,O2,HO2,no,N,53,,17640,11556,FOL
1,,SING,HN,N,no,N,1,,17890,11570,B27
2,,SING,N,CA,no,N,2,,17890,11570,B27
3,,SING,N,HNA,no,N,3,,17890,11570,B27
4,,SING,CX,CA,no,N,4,,17890,11570,B27
5,,SING,CA,CB,no,N,5,,17890,11570,B27
6,,SING,CA,HA,no,N,6,,17890,11570,B27
7,,SING,CG2,CB,no,N,7,,17890,11570,B27
8,,SING,CB,OG1,no,N,8,,17890,11570,B27
9,,SING,CB,HB,no,N,9,,17890,11570,B27
10,,SING,HG2A,CG2,no,N,10,,17890,11570,B27
11,,SING,CG2,HG2B,no,N,11,,17890,11570,B27
12,,SING,CG2,HG2,no,N,12,,17890,11570,B27
13,,SING,HOG1,OG1,no,N,13,,17890,11570,B27
14,,SING,SG,CX,no,N,14,,17890,11570,B27
15,,SING,SG,HSG,no,N,15,,17890,11570,B27
16,,SING,HX,CX,no,N,16,,17890,11570,B27
17,,SING,CX,HXA,no,N,17,,17890,11570,B27
1,,DOUB,O1,C,no,N,1,,17891,11570,BOC
2,,SING,C,O2,no,N,2,,17891,11570,BOC
3,,SING,O2,CT,no,N,3,,17891,11570,BOC
4,,SING,CT,C1,no,N,4,,17891,11570,BOC
5,,SING,CT,C2,no,N,5,,17891,11570,BOC
6,,SING,CT,C3,no,N,6,,17891,11570,BOC
7,,SING,O3,C,no,N,7,,17891,11570,BOC
8,,SING,C1,H11,no,N,8,,17891,11570,BOC
9,,SING,C1,H12,no,N,9,,17891,11570,BOC
10,,SING,C1,H13,no,N,10,,17891,11570,BOC
11,,SING,C2,H21,no,N,11,,17891,11570,BOC
12,,SING,C2,H22,no,N,12,,17891,11570,BOC
13,,SING,C2,H23,no,N,13,,17891,11570,BOC
14,,SING,C3,H31,no,N,14,,17891,11570,BOC
15,,SING,C3,H32,no,N,15,,17891,11570,BOC
16,,SING,C3,H33,no,N,16,,17891,11570,BOC
17,,SING,O3,H3,no,N,17,,17891,11570,BOC
1,,SING,N,CA,no,N,1,,17990,11578,SEP
2,,SING,N,H,no,N,2,,17990,11578,SEP
3,,SING,N,H2,no,N,3,,17990,11578,SEP
4,,SING,CA,CB,no,N,4,,17990,11578,SEP
5,,SING,CA,C,no,N,5,,17990,11578,SEP
6,,SING,CA,HA,no,N,6,,17990,11578,SEP
7,,SING,CB,OG,no,N,7,,17990,11578,SEP
8,,SING,CB,HB2,no,N,8,,17990,11578,SEP
9,,SING,CB,HB3,no,N,9,,17990,11578,SEP
10,,SING,OG,P,no,N,10,,17990,11578,SEP
11,,DOUB,C,O,no,N,11,,17990,11578,SEP
12,,SING,C,OXT,no,N,12,,17990,11578,SEP
13,,SING,OXT,HXT,no,N,13,,17990,11578,SEP
14,,DOUB,P,O1P,no,N,14,,17990,11578,SEP
15,,SING,P,O2P,no,N,15,,17990,11578,SEP
16,,SING,P,O3P,no,N,16,,17990,11578,SEP
17,,SING,O2P,HOP2,no,N,17,,17990,11578,SEP
18,,SING,O3P,HOP3,no,N,18,,17990,11578,SEP
1,,SING,N,CA,no,N,1,,17991,11578,TPO
2,,SING,N,H,no,N,2,,17991,11578,TPO
3,,SING,N,H2,no,N,3,,17991,11578,TPO
4,,SING,CA,CB,no,N,4,,17991,11578,TPO
5,,SING,CA,C,no,N,5,,17991,11578,TPO
6,,SING,CA,HA,no,N,6,,17991,11578,TPO
7,,SING,CB,CG2,no,N,7,,17991,11578,TPO
8,,SING,CB,OG1,no,N,8,,17991,11578,TPO
9,,SING,CB,HB,no,N,9,,17991,11578,TPO
10,,SING,CG2,HG21,no,N,10,,17991,11578,TPO
11,,SING,CG2,HG22,no,N,11,,17991,11578,TPO
12,,SING,CG2,HG23,no,N,12,,17991,11578,TPO
13,,SING,OG1,P,no,N,13,,17991,11578,TPO
14,,DOUB,P,O1P,no,N,14,,17991,11578,TPO
15,,SING,P,O2P,no,N,15,,17991,11578,TPO
16,,SING,P,O3P,no,N,16,,17991,11578,TPO
17,,SING,O2P,HOP2,no,N,17,,17991,11578,TPO
18,,SING,O3P,HOP3,no,N,18,,17991,11578,TPO
19,,DOUB,C,O,no,N,19,,17991,11578,TPO
20,,SING,C,OXT,no,N,20,,17991,11578,TPO
21,,SING,OXT,HXT,no,N,21,,17991,11578,TPO
1,,SING,C1,C2,no,N,1,,18573,1170,AAC
2,,SING,C1,O1,no,N,2,,18573,1170,AAC
3,,DOUB,C1,O2,no,N,3,,18573,1170,AAC
4,,SING,C2,N1,no,N,4,,18573,1170,AAC
5,,SING,C2,HC21,no,N,5,,18573,1170,AAC
6,,SING,C2,HC22,no,N,6,,18573,1170,AAC
7,,SING,C3,C4,no,N,7,,18573,1170,AAC
8,,SING,C3,N1,no,N,8,,18573,1170,AAC
9,,DOUB,C3,O3,no,N,9,,18573,1170,AAC
10,,SING,C4,HC41,no,N,10,,18573,1170,AAC
11,,SING,C4,HC42,no,N,11,,18573,1170,AAC
12,,SING,C4,HC43,no,N,12,,18573,1170,AAC
13,,SING,N1,HN1,no,N,13,,18573,1170,AAC
14,,SING,O1,HO1,no,N,14,,18573,1170,AAC
1,,SING,FE,NA,no,N,1,,18574,1170,HEC
2,,SING,FE,NB,no,N,2,,18574,1170,HEC
3,,SING,FE,NC,no,N,3,,18574,1170,HEC
4,,SING,FE,ND,no,N,4,,18574,1170,HEC
5,,DOUB,CHA,C1A,no,N,5,,18574,1170,HEC
6,,SING,CHA,C4D,no,N,6,,18574,1170,HEC
7,,SING,CHA,HHA,no,N,7,,18574,1170,HEC
8,,DOUB,CHB,C4A,no,N,8,,18574,1170,HEC
9,,SING,CHB,C1B,no,N,9,,18574,1170,HEC
10,,SING,CHB,HHB,no,N,10,,18574,1170,HEC
11,,DOUB,CHC,C4B,no,N,11,,18574,1170,HEC
12,,SING,CHC,C1C,no,N,12,,18574,1170,HEC
13,,SING,CHC,HHC,no,N,13,,18574,1170,HEC
14,,DOUB,CHD,C4C,no,N,14,,18574,1170,HEC
15,,SING,CHD,C1D,no,N,15,,18574,1170,HEC
16,,SING,CHD,HHD,no,N,16,,18574,1170,HEC
17,,SING,NA,C1A,yes,N,17,,18574,1170,HEC
18,,SING,NA,C4A,yes,N,18,,18574,1170,HEC
19,,SING,C1A,C2A,yes,N,19,,18574,1170,HEC
20,,DOUB,C2A,C3A,yes,N,20,,18574,1170,HEC
21,,SING,C2A,CAA,no,N,21,,18574,1170,HEC
22,,SING,C3A,C4A,yes,N,22,,18574,1170,HEC
23,,SING,C3A,CMA,no,N,23,,18574,1170,HEC
24,,SING,CMA,HMA1,no,N,24,,18574,1170,HEC
25,,SING,CMA,HMA2,no,N,25,,18574,1170,HEC
26,,SING,CMA,HMA3,no,N,26,,18574,1170,HEC
27,,SING,CAA,CBA,no,N,27,,18574,1170,HEC
28,,SING,CAA,HAA1,no,N,28,,18574,1170,HEC
29,,SING,CAA,HAA2,no,N,29,,18574,1170,HEC
30,,SING,CBA,CGA,no,N,30,,18574,1170,HEC
31,,SING,CBA,HBA1,no,N,31,,18574,1170,HEC
32,,SING,CBA,HBA2,no,N,32,,18574,1170,HEC
33,,DOUB,CGA,O1A,no,N,33,,18574,1170,HEC
34,,SING,CGA,O2A,no,N,34,,18574,1170,HEC
35,,SING,O2A,H2A,no,N,35,,18574,1170,HEC
36,,SING,NB,C1B,yes,N,36,,18574,1170,HEC
37,,SING,NB,C4B,yes,N,37,,18574,1170,HEC
38,,DOUB,C1B,C2B,yes,N,38,,18574,1170,HEC
39,,SING,C2B,C3B,yes,N,39,,18574,1170,HEC
40,,SING,C2B,CMB,no,N,40,,18574,1170,HEC
41,,SING,C3B,C4B,yes,N,41,,18574,1170,HEC
42,,DOUB,C3B,CAB,no,E,42,,18574,1170,HEC
43,,SING,CMB,HMB1,no,N,43,,18574,1170,HEC
44,,SING,CMB,HMB2,no,N,44,,18574,1170,HEC
45,,SING,CMB,HMB3,no,N,45,,18574,1170,HEC
46,,SING,CAB,CBB,no,N,46,,18574,1170,HEC
47,,SING,CAB,HAB,no,N,47,,18574,1170,HEC
48,,SING,CBB,HBB1,no,N,48,,18574,1170,HEC
49,,SING,CBB,HBB2,no,N,49,,18574,1170,HEC
50,,SING,CBB,HBB3,no,N,50,,18574,1170,HEC
51,,SING,NC,C1C,yes,N,51,,18574,1170,HEC
52,,SING,NC,C4C,yes,N,52,,18574,1170,HEC
53,,DOUB,C1C,C2C,yes,N,53,,18574,1170,HEC
54,,SING,C2C,C3C,yes,N,54,,18574,1170,HEC
55,,SING,C2C,CMC,no,N,55,,18574,1170,HEC
56,,SING,C3C,C4C,yes,N,56,,18574,1170,HEC
57,,DOUB,C3C,CAC,no,E,57,,18574,1170,HEC
58,,SING,CMC,HMC1,no,N,58,,18574,1170,HEC
59,,SING,CMC,HMC2,no,N,59,,18574,1170,HEC
60,,SING,CMC,HMC3,no,N,60,,18574,1170,HEC
61,,SING,CAC,CBC,no,N,61,,18574,1170,HEC
62,,SING,CAC,HAC,no,N,62,,18574,1170,HEC
63,,SING,CBC,HBC1,no,N,63,,18574,1170,HEC
64,,SING,CBC,HBC2,no,N,64,,18574,1170,HEC
65,,SING,CBC,HBC3,no,N,65,,18574,1170,HEC
66,,SING,ND,C1D,yes,N,66,,18574,1170,HEC
67,,SING,ND,C4D,yes,N,67,,18574,1170,HEC
68,,DOUB,C1D,C2D,yes,N,68,,18574,1170,HEC
69,,SING,C2D,C3D,yes,N,69,,18574,1170,HEC
70,,SING,C2D,CMD,no,N,70,,18574,1170,HEC
71,,DOUB,C3D,C4D,yes,N,71,,18574,1170,HEC
72,,SING,C3D,CAD,no,N,72,,18574,1170,HEC
73,,SING,CMD,HMD1,no,N,73,,18574,1170,HEC
74,,SING,CMD,HMD2,no,N,74,,18574,1170,HEC
75,,SING,CMD,HMD3,no,N,75,,18574,1170,HEC
76,,SING,CAD,CBD,no,N,76,,18574,1170,HEC
77,,SING,CAD,HAD1,no,N,77,,18574,1170,HEC
78,,SING,CAD,HAD2,no,N,78,,18574,1170,HEC
79,,SING,CBD,CGD,no,N,79,,18574,1170,HEC
80,,SING,CBD,HBD1,no,N,80,,18574,1170,HEC
81,,SING,CBD,HBD2,no,N,81,,18574,1170,HEC
82,,DOUB,CGD,O1D,no,N,82,,18574,1170,HEC
83,,SING,CGD,O2D,no,N,83,,18574,1170,HEC
84,,SING,O2D,H2D,no,N,84,,18574,1170,HEC
1,,SING,C1,C2,no,N,1,,18588,1171,AAC
2,,SING,C1,O1,no,N,2,,18588,1171,AAC
3,,DOUB,C1,O2,no,N,3,,18588,1171,AAC
4,,SING,C2,N1,no,N,4,,18588,1171,AAC
5,,SING,C2,HC21,no,N,5,,18588,1171,AAC
6,,SING,C2,HC22,no,N,6,,18588,1171,AAC
7,,SING,C3,C4,no,N,7,,18588,1171,AAC
8,,SING,C3,N1,no,N,8,,18588,1171,AAC
9,,DOUB,C3,O3,no,N,9,,18588,1171,AAC
10,,SING,C4,HC41,no,N,10,,18588,1171,AAC
11,,SING,C4,HC42,no,N,11,,18588,1171,AAC
12,,SING,C4,HC43,no,N,12,,18588,1171,AAC
13,,SING,N1,HN1,no,N,13,,18588,1171,AAC
14,,SING,O1,HO1,no,N,14,,18588,1171,AAC
1,,SING,FE,NA,no,N,1,,18589,1171,HEC
2,,SING,FE,NB,no,N,2,,18589,1171,HEC
3,,SING,FE,NC,no,N,3,,18589,1171,HEC
4,,SING,FE,ND,no,N,4,,18589,1171,HEC
5,,DOUB,CHA,C1A,no,N,5,,18589,1171,HEC
6,,SING,CHA,C4D,no,N,6,,18589,1171,HEC
7,,SING,CHA,HHA,no,N,7,,18589,1171,HEC
8,,DOUB,CHB,C4A,no,N,8,,18589,1171,HEC
9,,SING,CHB,C1B,no,N,9,,18589,1171,HEC
10,,SING,CHB,HHB,no,N,10,,18589,1171,HEC
11,,DOUB,CHC,C4B,no,N,11,,18589,1171,HEC
12,,SING,CHC,C1C,no,N,12,,18589,1171,HEC
13,,SING,CHC,HHC,no,N,13,,18589,1171,HEC
14,,DOUB,CHD,C4C,no,N,14,,18589,1171,HEC
15,,SING,CHD,C1D,no,N,15,,18589,1171,HEC
16,,SING,CHD,HHD,no,N,16,,18589,1171,HEC
17,,SING,NA,C1A,yes,N,17,,18589,1171,HEC
18,,SING,NA,C4A,yes,N,18,,18589,1171,HEC
19,,SING,C1A,C2A,yes,N,19,,18589,1171,HEC
20,,DOUB,C2A,C3A,yes,N,20,,18589,1171,HEC
21,,SING,C2A,CAA,no,N,21,,18589,1171,HEC
22,,SING,C3A,C4A,yes,N,22,,18589,1171,HEC
23,,SING,C3A,CMA,no,N,23,,18589,1171,HEC
24,,SING,CMA,HMA1,no,N,24,,18589,1171,HEC
25,,SING,CMA,HMA2,no,N,25,,18589,1171,HEC
26,,SING,CMA,HMA3,no,N,26,,18589,1171,HEC
27,,SING,CAA,CBA,no,N,27,,18589,1171,HEC
28,,SING,CAA,HAA1,no,N,28,,18589,1171,HEC
29,,SING,CAA,HAA2,no,N,29,,18589,1171,HEC
30,,SING,CBA,CGA,no,N,30,,18589,1171,HEC
31,,SING,CBA,HBA1,no,N,31,,18589,1171,HEC
32,,SING,CBA,HBA2,no,N,32,,18589,1171,HEC
33,,DOUB,CGA,O1A,no,N,33,,18589,1171,HEC
34,,SING,CGA,O2A,no,N,34,,18589,1171,HEC
35,,SING,O2A,H2A,no,N,35,,18589,1171,HEC
36,,SING,NB,C1B,yes,N,36,,18589,1171,HEC
37,,SING,NB,C4B,yes,N,37,,18589,1171,HEC
38,,DOUB,C1B,C2B,yes,N,38,,18589,1171,HEC
39,,SING,C2B,C3B,yes,N,39,,18589,1171,HEC
40,,SING,C2B,CMB,no,N,40,,18589,1171,HEC
41,,SING,C3B,C4B,yes,N,41,,18589,1171,HEC
42,,DOUB,C3B,CAB,no,E,42,,18589,1171,HEC
43,,SING,CMB,HMB1,no,N,43,,18589,1171,HEC
44,,SING,CMB,HMB2,no,N,44,,18589,1171,HEC
45,,SING,CMB,HMB3,no,N,45,,18589,1171,HEC
46,,SING,CAB,CBB,no,N,46,,18589,1171,HEC
47,,SING,CAB,HAB,no,N,47,,18589,1171,HEC
48,,SING,CBB,HBB1,no,N,48,,18589,1171,HEC
49,,SING,CBB,HBB2,no,N,49,,18589,1171,HEC
50,,SING,CBB,HBB3,no,N,50,,18589,1171,HEC
51,,SING,NC,C1C,yes,N,51,,18589,1171,HEC
52,,SING,NC,C4C,yes,N,52,,18589,1171,HEC
53,,DOUB,C1C,C2C,yes,N,53,,18589,1171,HEC
54,,SING,C2C,C3C,yes,N,54,,18589,1171,HEC
55,,SING,C2C,CMC,no,N,55,,18589,1171,HEC
56,,SING,C3C,C4C,yes,N,56,,18589,1171,HEC
57,,DOUB,C3C,CAC,no,E,57,,18589,1171,HEC
58,,SING,CMC,HMC1,no,N,58,,18589,1171,HEC
59,,SING,CMC,HMC2,no,N,59,,18589,1171,HEC
60,,SING,CMC,HMC3,no,N,60,,18589,1171,HEC
61,,SING,CAC,CBC,no,N,61,,18589,1171,HEC
62,,SING,CAC,HAC,no,N,62,,18589,1171,HEC
63,,SING,CBC,HBC1,no,N,63,,18589,1171,HEC
64,,SING,CBC,HBC2,no,N,64,,18589,1171,HEC
65,,SING,CBC,HBC3,no,N,65,,18589,1171,HEC
66,,SING,ND,C1D,yes,N,66,,18589,1171,HEC
67,,SING,ND,C4D,yes,N,67,,18589,1171,HEC
68,,DOUB,C1D,C2D,yes,N,68,,18589,1171,HEC
69,,SING,C2D,C3D,yes,N,69,,18589,1171,HEC
70,,SING,C2D,CMD,no,N,70,,18589,1171,HEC
71,,DOUB,C3D,C4D,yes,N,71,,18589,1171,HEC
72,,SING,C3D,CAD,no,N,72,,18589,1171,HEC
73,,SING,CMD,HMD1,no,N,73,,18589,1171,HEC
74,,SING,CMD,HMD2,no,N,74,,18589,1171,HEC
75,,SING,CMD,HMD3,no,N,75,,18589,1171,HEC
76,,SING,CAD,CBD,no,N,76,,18589,1171,HEC
77,,SING,CAD,HAD1,no,N,77,,18589,1171,HEC
78,,SING,CAD,HAD2,no,N,78,,18589,1171,HEC
79,,SING,CBD,CGD,no,N,79,,18589,1171,HEC
80,,SING,CBD,HBD1,no,N,80,,18589,1171,HEC
81,,SING,CBD,HBD2,no,N,81,,18589,1171,HEC
82,,DOUB,CGD,O1D,no,N,82,,18589,1171,HEC
83,,SING,CGD,O2D,no,N,83,,18589,1171,HEC
84,,SING,O2D,H2D,no,N,84,,18589,1171,HEC
1,,SING,FE,NA,no,N,1,,18736,1192,HEC
2,,SING,FE,NB,no,N,2,,18736,1192,HEC
3,,SING,FE,NC,no,N,3,,18736,1192,HEC
4,,SING,FE,ND,no,N,4,,18736,1192,HEC
5,,DOUB,CHA,C1A,no,N,5,,18736,1192,HEC
6,,SING,CHA,C4D,no,N,6,,18736,1192,HEC
7,,SING,CHA,HHA,no,N,7,,18736,1192,HEC
8,,DOUB,CHB,C4A,no,N,8,,18736,1192,HEC
9,,SING,CHB,C1B,no,N,9,,18736,1192,HEC
10,,SING,CHB,HHB,no,N,10,,18736,1192,HEC
11,,DOUB,CHC,C4B,no,N,11,,18736,1192,HEC
12,,SING,CHC,C1C,no,N,12,,18736,1192,HEC
13,,SING,CHC,HHC,no,N,13,,18736,1192,HEC
14,,DOUB,CHD,C4C,no,N,14,,18736,1192,HEC
15,,SING,CHD,C1D,no,N,15,,18736,1192,HEC
16,,SING,CHD,HHD,no,N,16,,18736,1192,HEC
17,,SING,NA,C1A,yes,N,17,,18736,1192,HEC
18,,SING,NA,C4A,yes,N,18,,18736,1192,HEC
19,,SING,C1A,C2A,yes,N,19,,18736,1192,HEC
20,,DOUB,C2A,C3A,yes,N,20,,18736,1192,HEC
21,,SING,C2A,CAA,no,N,21,,18736,1192,HEC
22,,SING,C3A,C4A,yes,N,22,,18736,1192,HEC
23,,SING,C3A,CMA,no,N,23,,18736,1192,HEC
24,,SING,CMA,HMA1,no,N,24,,18736,1192,HEC
25,,SING,CMA,HMA2,no,N,25,,18736,1192,HEC
26,,SING,CMA,HMA3,no,N,26,,18736,1192,HEC
27,,SING,CAA,CBA,no,N,27,,18736,1192,HEC
28,,SING,CAA,HAA1,no,N,28,,18736,1192,HEC
29,,SING,CAA,HAA2,no,N,29,,18736,1192,HEC
30,,SING,CBA,CGA,no,N,30,,18736,1192,HEC
31,,SING,CBA,HBA1,no,N,31,,18736,1192,HEC
32,,SING,CBA,HBA2,no,N,32,,18736,1192,HEC
33,,DOUB,CGA,O1A,no,N,33,,18736,1192,HEC
34,,SING,CGA,O2A,no,N,34,,18736,1192,HEC
35,,SING,O2A,H2A,no,N,35,,18736,1192,HEC
36,,SING,NB,C1B,yes,N,36,,18736,1192,HEC
37,,SING,NB,C4B,yes,N,37,,18736,1192,HEC
38,,DOUB,C1B,C2B,yes,N,38,,18736,1192,HEC
39,,SING,C2B,C3B,yes,N,39,,18736,1192,HEC
40,,SING,C2B,CMB,no,N,40,,18736,1192,HEC
41,,SING,C3B,C4B,yes,N,41,,18736,1192,HEC
42,,DOUB,C3B,CAB,no,E,42,,18736,1192,HEC
43,,SING,CMB,HMB1,no,N,43,,18736,1192,HEC
44,,SING,CMB,HMB2,no,N,44,,18736,1192,HEC
45,,SING,CMB,HMB3,no,N,45,,18736,1192,HEC
46,,SING,CAB,CBB,no,N,46,,18736,1192,HEC
47,,SING,CAB,HAB,no,N,47,,18736,1192,HEC
48,,SING,CBB,HBB1,no,N,48,,18736,1192,HEC
49,,SING,CBB,HBB2,no,N,49,,18736,1192,HEC
50,,SING,CBB,HBB3,no,N,50,,18736,1192,HEC
51,,SING,NC,C1C,yes,N,51,,18736,1192,HEC
52,,SING,NC,C4C,yes,N,52,,18736,1192,HEC
53,,DOUB,C1C,C2C,yes,N,53,,18736,1192,HEC
54,,SING,C2C,C3C,yes,N,54,,18736,1192,HEC
55,,SING,C2C,CMC,no,N,55,,18736,1192,HEC
56,,SING,C3C,C4C,yes,N,56,,18736,1192,HEC
57,,DOUB,C3C,CAC,no,E,57,,18736,1192,HEC
58,,SING,CMC,HMC1,no,N,58,,18736,1192,HEC
59,,SING,CMC,HMC2,no,N,59,,18736,1192,HEC
60,,SING,CMC,HMC3,no,N,60,,18736,1192,HEC
61,,SING,CAC,CBC,no,N,61,,18736,1192,HEC
62,,SING,CAC,HAC,no,N,62,,18736,1192,HEC
63,,SING,CBC,HBC1,no,N,63,,18736,1192,HEC
64,,SING,CBC,HBC2,no,N,64,,18736,1192,HEC
65,,SING,CBC,HBC3,no,N,65,,18736,1192,HEC
66,,SING,ND,C1D,yes,N,66,,18736,1192,HEC
67,,SING,ND,C4D,yes,N,67,,18736,1192,HEC
68,,DOUB,C1D,C2D,yes,N,68,,18736,1192,HEC
69,,SING,C2D,C3D,yes,N,69,,18736,1192,HEC
70,,SING,C2D,CMD,no,N,70,,18736,1192,HEC
71,,DOUB,C3D,C4D,yes,N,71,,18736,1192,HEC
72,,SING,C3D,CAD,no,N,72,,18736,1192,HEC
73,,SING,CMD,HMD1,no,N,73,,18736,1192,HEC
74,,SING,CMD,HMD2,no,N,74,,18736,1192,HEC
75,,SING,CMD,HMD3,no,N,75,,18736,1192,HEC
76,,SING,CAD,CBD,no,N,76,,18736,1192,HEC
77,,SING,CAD,HAD1,no,N,77,,18736,1192,HEC
78,,SING,CAD,HAD2,no,N,78,,18736,1192,HEC
79,,SING,CBD,CGD,no,N,79,,18736,1192,HEC
80,,SING,CBD,HBD1,no,N,80,,18736,1192,HEC
81,,SING,CBD,HBD2,no,N,81,,18736,1192,HEC
82,,DOUB,CGD,O1D,no,N,82,,18736,1192,HEC
83,,SING,CGD,O2D,no,N,83,,18736,1192,HEC
84,,SING,O2D,H2D,no,N,84,,18736,1192,HEC
1,,SING,N,CA,no,N,1,,18737,1192,M3L
2,,SING,N,H,no,N,2,,18737,1192,M3L
3,,SING,N,H2,no,N,3,,18737,1192,M3L
4,,SING,CA,CB,no,N,4,,18737,1192,M3L
5,,SING,CA,C,no,N,5,,18737,1192,M3L
6,,SING,CA,HA,no,N,6,,18737,1192,M3L
7,,SING,CB,CG,no,N,7,,18737,1192,M3L
8,,SING,CB,HB2,no,N,8,,18737,1192,M3L
9,,SING,CB,HB3,no,N,9,,18737,1192,M3L
10,,SING,CG,CD,no,N,10,,18737,1192,M3L
11,,SING,CG,HG2,no,N,11,,18737,1192,M3L
12,,SING,CG,HG3,no,N,12,,18737,1192,M3L
13,,SING,CD,CE,no,N,13,,18737,1192,M3L
14,,SING,CD,HD2,no,N,14,,18737,1192,M3L
15,,SING,CD,HD3,no,N,15,,18737,1192,M3L
16,,SING,CE,NZ,no,N,16,,18737,1192,M3L
17,,SING,CE,HE2,no,N,17,,18737,1192,M3L
18,,SING,CE,HE3,no,N,18,,18737,1192,M3L
19,,SING,NZ,CM1,no,N,19,,18737,1192,M3L
20,,SING,NZ,CM2,no,N,20,,18737,1192,M3L
21,,SING,NZ,CM3,no,N,21,,18737,1192,M3L
22,,DOUB,C,O,no,N,22,,18737,1192,M3L
23,,SING,C,OXT,no,N,23,,18737,1192,M3L
24,,SING,OXT,HXT,no,N,24,,18737,1192,M3L
25,,SING,CM1,HM11,no,N,25,,18737,1192,M3L
26,,SING,CM1,HM12,no,N,26,,18737,1192,M3L
27,,SING,CM1,HM13,no,N,27,,18737,1192,M3L
28,,SING,CM2,HM21,no,N,28,,18737,1192,M3L
29,,SING,CM2,HM22,no,N,29,,18737,1192,M3L
30,,SING,CM2,HM23,no,N,30,,18737,1192,M3L
31,,SING,CM3,HM31,no,N,31,,18737,1192,M3L
32,,SING,CM3,HM32,no,N,32,,18737,1192,M3L
33,,SING,CM3,HM33,no,N,33,,18737,1192,M3L
1,,SING,FE,NA,no,N,1,,18751,1194,HEC
2,,SING,FE,NB,no,N,2,,18751,1194,HEC
3,,SING,FE,NC,no,N,3,,18751,1194,HEC
4,,SING,FE,ND,no,N,4,,18751,1194,HEC
5,,DOUB,CHA,C1A,no,N,5,,18751,1194,HEC
6,,SING,CHA,C4D,no,N,6,,18751,1194,HEC
7,,SING,CHA,HHA,no,N,7,,18751,1194,HEC
8,,DOUB,CHB,C4A,no,N,8,,18751,1194,HEC
9,,SING,CHB,C1B,no,N,9,,18751,1194,HEC
10,,SING,CHB,HHB,no,N,10,,18751,1194,HEC
11,,DOUB,CHC,C4B,no,N,11,,18751,1194,HEC
12,,SING,CHC,C1C,no,N,12,,18751,1194,HEC
13,,SING,CHC,HHC,no,N,13,,18751,1194,HEC
14,,DOUB,CHD,C4C,no,N,14,,18751,1194,HEC
15,,SING,CHD,C1D,no,N,15,,18751,1194,HEC
16,,SING,CHD,HHD,no,N,16,,18751,1194,HEC
17,,SING,NA,C1A,yes,N,17,,18751,1194,HEC
18,,SING,NA,C4A,yes,N,18,,18751,1194,HEC
19,,SING,C1A,C2A,yes,N,19,,18751,1194,HEC
20,,DOUB,C2A,C3A,yes,N,20,,18751,1194,HEC
21,,SING,C2A,CAA,no,N,21,,18751,1194,HEC
22,,SING,C3A,C4A,yes,N,22,,18751,1194,HEC
23,,SING,C3A,CMA,no,N,23,,18751,1194,HEC
24,,SING,CMA,HMA1,no,N,24,,18751,1194,HEC
25,,SING,CMA,HMA2,no,N,25,,18751,1194,HEC
26,,SING,CMA,HMA3,no,N,26,,18751,1194,HEC
27,,SING,CAA,CBA,no,N,27,,18751,1194,HEC
28,,SING,CAA,HAA1,no,N,28,,18751,1194,HEC
29,,SING,CAA,HAA2,no,N,29,,18751,1194,HEC
30,,SING,CBA,CGA,no,N,30,,18751,1194,HEC
31,,SING,CBA,HBA1,no,N,31,,18751,1194,HEC
32,,SING,CBA,HBA2,no,N,32,,18751,1194,HEC
33,,DOUB,CGA,O1A,no,N,33,,18751,1194,HEC
34,,SING,CGA,O2A,no,N,34,,18751,1194,HEC
35,,SING,O2A,H2A,no,N,35,,18751,1194,HEC
36,,SING,NB,C1B,yes,N,36,,18751,1194,HEC
37,,SING,NB,C4B,yes,N,37,,18751,1194,HEC
38,,DOUB,C1B,C2B,yes,N,38,,18751,1194,HEC
39,,SING,C2B,C3B,yes,N,39,,18751,1194,HEC
40,,SING,C2B,CMB,no,N,40,,18751,1194,HEC
41,,SING,C3B,C4B,yes,N,41,,18751,1194,HEC
42,,DOUB,C3B,CAB,no,E,42,,18751,1194,HEC
43,,SING,CMB,HMB1,no,N,43,,18751,1194,HEC
44,,SING,CMB,HMB2,no,N,44,,18751,1194,HEC
45,,SING,CMB,HMB3,no,N,45,,18751,1194,HEC
46,,SING,CAB,CBB,no,N,46,,18751,1194,HEC
47,,SING,CAB,HAB,no,N,47,,18751,1194,HEC
48,,SING,CBB,HBB1,no,N,48,,18751,1194,HEC
49,,SING,CBB,HBB2,no,N,49,,18751,1194,HEC
50,,SING,CBB,HBB3,no,N,50,,18751,1194,HEC
51,,SING,NC,C1C,yes,N,51,,18751,1194,HEC
52,,SING,NC,C4C,yes,N,52,,18751,1194,HEC
53,,DOUB,C1C,C2C,yes,N,53,,18751,1194,HEC
54,,SING,C2C,C3C,yes,N,54,,18751,1194,HEC
55,,SING,C2C,CMC,no,N,55,,18751,1194,HEC
56,,SING,C3C,C4C,yes,N,56,,18751,1194,HEC
57,,DOUB,C3C,CAC,no,E,57,,18751,1194,HEC
58,,SING,CMC,HMC1,no,N,58,,18751,1194,HEC
59,,SING,CMC,HMC2,no,N,59,,18751,1194,HEC
60,,SING,CMC,HMC3,no,N,60,,18751,1194,HEC
61,,SING,CAC,CBC,no,N,61,,18751,1194,HEC
62,,SING,CAC,HAC,no,N,62,,18751,1194,HEC
63,,SING,CBC,HBC1,no,N,63,,18751,1194,HEC
64,,SING,CBC,HBC2,no,N,64,,18751,1194,HEC
65,,SING,CBC,HBC3,no,N,65,,18751,1194,HEC
66,,SING,ND,C1D,yes,N,66,,18751,1194,HEC
67,,SING,ND,C4D,yes,N,67,,18751,1194,HEC
68,,DOUB,C1D,C2D,yes,N,68,,18751,1194,HEC
69,,SING,C2D,C3D,yes,N,69,,18751,1194,HEC
70,,SING,C2D,CMD,no,N,70,,18751,1194,HEC
71,,DOUB,C3D,C4D,yes,N,71,,18751,1194,HEC
72,,SING,C3D,CAD,no,N,72,,18751,1194,HEC
73,,SING,CMD,HMD1,no,N,73,,18751,1194,HEC
74,,SING,CMD,HMD2,no,N,74,,18751,1194,HEC
75,,SING,CMD,HMD3,no,N,75,,18751,1194,HEC
76,,SING,CAD,CBD,no,N,76,,18751,1194,HEC
77,,SING,CAD,HAD1,no,N,77,,18751,1194,HEC
78,,SING,CAD,HAD2,no,N,78,,18751,1194,HEC
79,,SING,CBD,CGD,no,N,79,,18751,1194,HEC
80,,SING,CBD,HBD1,no,N,80,,18751,1194,HEC
81,,SING,CBD,HBD2,no,N,81,,18751,1194,HEC
82,,DOUB,CGD,O1D,no,N,82,,18751,1194,HEC
83,,SING,CGD,O2D,no,N,83,,18751,1194,HEC
84,,SING,O2D,H2D,no,N,84,,18751,1194,HEC
1,,SING,N,CA,no,N,1,,18752,1194,M3L
2,,SING,N,H,no,N,2,,18752,1194,M3L
3,,SING,N,H2,no,N,3,,18752,1194,M3L
4,,SING,CA,CB,no,N,4,,18752,1194,M3L
5,,SING,CA,C,no,N,5,,18752,1194,M3L
6,,SING,CA,HA,no,N,6,,18752,1194,M3L
7,,SING,CB,CG,no,N,7,,18752,1194,M3L
8,,SING,CB,HB2,no,N,8,,18752,1194,M3L
9,,SING,CB,HB3,no,N,9,,18752,1194,M3L
10,,SING,CG,CD,no,N,10,,18752,1194,M3L
11,,SING,CG,HG2,no,N,11,,18752,1194,M3L
12,,SING,CG,HG3,no,N,12,,18752,1194,M3L
13,,SING,CD,CE,no,N,13,,18752,1194,M3L
14,,SING,CD,HD2,no,N,14,,18752,1194,M3L
15,,SING,CD,HD3,no,N,15,,18752,1194,M3L
16,,SING,CE,NZ,no,N,16,,18752,1194,M3L
17,,SING,CE,HE2,no,N,17,,18752,1194,M3L
18,,SING,CE,HE3,no,N,18,,18752,1194,M3L
19,,SING,NZ,CM1,no,N,19,,18752,1194,M3L
20,,SING,NZ,CM2,no,N,20,,18752,1194,M3L
21,,SING,NZ,CM3,no,N,21,,18752,1194,M3L
22,,DOUB,C,O,no,N,22,,18752,1194,M3L
23,,SING,C,OXT,no,N,23,,18752,1194,M3L
24,,SING,OXT,HXT,no,N,24,,18752,1194,M3L
25,,SING,CM1,HM11,no,N,25,,18752,1194,M3L
26,,SING,CM1,HM12,no,N,26,,18752,1194,M3L
27,,SING,CM1,HM13,no,N,27,,18752,1194,M3L
28,,SING,CM2,HM21,no,N,28,,18752,1194,M3L
29,,SING,CM2,HM22,no,N,29,,18752,1194,M3L
30,,SING,CM2,HM23,no,N,30,,18752,1194,M3L
31,,SING,CM3,HM31,no,N,31,,18752,1194,M3L
32,,SING,CM3,HM32,no,N,32,,18752,1194,M3L
33,,SING,CM3,HM33,no,N,33,,18752,1194,M3L
1,,SING,N,CA,no,N,1,,18753,1194,SMC
2,,SING,N,H,no,N,2,,18753,1194,SMC
3,,SING,N,H2,no,N,3,,18753,1194,SMC
4,,SING,CA,CB,no,N,4,,18753,1194,SMC
5,,SING,CA,C,no,N,5,,18753,1194,SMC
6,,SING,CA,HA,no,N,6,,18753,1194,SMC
7,,SING,CB,SG,no,N,7,,18753,1194,SMC
8,,SING,CB,HB2,no,N,8,,18753,1194,SMC
9,,SING,CB,HB3,no,N,9,,18753,1194,SMC
10,,SING,SG,CS,no,N,10,,18753,1194,SMC
11,,SING,CS,HCS1,no,N,11,,18753,1194,SMC
12,,SING,CS,HCS2,no,N,12,,18753,1194,SMC
13,,SING,CS,HCS3,no,N,13,,18753,1194,SMC
14,,DOUB,C,O,no,N,14,,18753,1194,SMC
15,,SING,C,OXT,no,N,15,,18753,1194,SMC
16,,SING,OXT,HXT,no,N,16,,18753,1194,SMC
1,,SING,N,CA,no,N,1,,18953,12018,SAM
2,,SING,N,HN1,no,N,2,,18953,12018,SAM
3,,SING,N,HN2,no,N,3,,18953,12018,SAM
4,,SING,CA,C,no,N,4,,18953,12018,SAM
5,,SING,CA,CB,no,N,5,,18953,12018,SAM
6,,SING,CA,HA,no,N,6,,18953,12018,SAM
7,,DOUB,C,O,no,N,7,,18953,12018,SAM
8,,SING,C,OXT,no,N,8,,18953,12018,SAM
9,,SING,CB,CG,no,N,9,,18953,12018,SAM
10,,SING,CB,HB1,no,N,10,,18953,12018,SAM
11,,SING,CB,HB2,no,N,11,,18953,12018,SAM
12,,SING,CG,SD,no,N,12,,18953,12018,SAM
13,,SING,CG,HG1,no,N,13,,18953,12018,SAM
14,,SING,CG,HG2,no,N,14,,18953,12018,SAM
15,,SING,SD,CE,no,N,15,,18953,12018,SAM
16,,SING,SD,C5',no,N,16,,18953,12018,SAM
17,,SING,CE,HE1,no,N,17,,18953,12018,SAM
18,,SING,CE,HE2,no,N,18,,18953,12018,SAM
19,,SING,CE,HE3,no,N,19,,18953,12018,SAM
20,,SING,C5',C4',no,N,20,,18953,12018,SAM
21,,SING,C5',H5'1,no,N,21,,18953,12018,SAM
22,,SING,C5',H5'2,no,N,22,,18953,12018,SAM
23,,SING,C4',O4',no,N,23,,18953,12018,SAM
24,,SING,C4',C3',no,N,24,,18953,12018,SAM
25,,SING,C4',H4',no,N,25,,18953,12018,SAM
26,,SING,O4',C1',no,N,26,,18953,12018,SAM
27,,SING,C3',O3',no,N,27,,18953,12018,SAM
28,,SING,C3',C2',no,N,28,,18953,12018,SAM
29,,SING,C3',H3',no,N,29,,18953,12018,SAM
30,,SING,O3',HO3',no,N,30,,18953,12018,SAM
31,,SING,C2',O2',no,N,31,,18953,12018,SAM
32,,SING,C2',C1',no,N,32,,18953,12018,SAM
33,,SING,C2',H2',no,N,33,,18953,12018,SAM
34,,SING,O2',HO2',no,N,34,,18953,12018,SAM
35,,SING,C1',N9,no,N,35,,18953,12018,SAM
36,,SING,C1',H1',no,N,36,,18953,12018,SAM
37,,SING,N9,C8,yes,N,37,,18953,12018,SAM
38,,SING,N9,C4,yes,N,38,,18953,12018,SAM
39,,DOUB,C8,N7,yes,N,39,,18953,12018,SAM
40,,SING,C8,H8,no,N,40,,18953,12018,SAM
41,,SING,N7,C5,yes,N,41,,18953,12018,SAM
42,,SING,C5,C6,yes,N,42,,18953,12018,SAM
43,,DOUB,C5,C4,yes,N,43,,18953,12018,SAM
44,,SING,C6,N6,no,N,44,,18953,12018,SAM
45,,DOUB,C6,N1,yes,N,45,,18953,12018,SAM
46,,SING,N6,HN61,no,N,46,,18953,12018,SAM
47,,SING,N6,HN62,no,N,47,,18953,12018,SAM
48,,SING,N1,C2,yes,N,48,,18953,12018,SAM
49,,DOUB,C2,N3,yes,N,49,,18953,12018,SAM
50,,SING,C2,H2,no,N,50,,18953,12018,SAM
51,,SING,N3,C4,yes,N,51,,18953,12018,SAM
1,,SING,N,CN,no,N,1,,18968,12019,FME
2,,SING,N,CA,no,N,2,,18968,12019,FME
3,,SING,N,H,no,N,3,,18968,12019,FME
4,,DOUB,CN,O1,no,N,4,,18968,12019,FME
5,,SING,CN,HCN,no,N,5,,18968,12019,FME
6,,SING,CA,CB,no,N,6,,18968,12019,FME
7,,SING,CA,C,no,N,7,,18968,12019,FME
8,,SING,CA,HA,no,N,8,,18968,12019,FME
9,,SING,CB,CG,no,N,9,,18968,12019,FME
10,,SING,CB,HB2,no,N,10,,18968,12019,FME
11,,SING,CB,HB3,no,N,11,,18968,12019,FME
12,,SING,CG,SD,no,N,12,,18968,12019,FME
13,,SING,CG,HG2,no,N,13,,18968,12019,FME
14,,SING,CG,HG3,no,N,14,,18968,12019,FME
15,,SING,SD,CE,no,N,15,,18968,12019,FME
16,,SING,CE,HE1,no,N,16,,18968,12019,FME
17,,SING,CE,HE2,no,N,17,,18968,12019,FME
18,,SING,CE,HE3,no,N,18,,18968,12019,FME
19,,DOUB,C,O,no,N,19,,18968,12019,FME
20,,SING,C,OXT,no,N,20,,18968,12019,FME
21,,SING,OXT,HXT,no,N,21,,18968,12019,FME
1,,SING,N,CA,no,N,1,,19012,12021,PCA
2,,SING,N,CD,no,N,2,,19012,12021,PCA
3,,SING,N,H,no,N,3,,19012,12021,PCA
4,,SING,CA,CB,no,N,4,,19012,12021,PCA
5,,SING,CA,C,no,N,5,,19012,12021,PCA
6,,SING,CA,HA,no,N,6,,19012,12021,PCA
7,,SING,CB,CG,no,N,7,,19012,12021,PCA
8,,SING,CB,HB2,no,N,8,,19012,12021,PCA
9,,SING,CB,HB3,no,N,9,,19012,12021,PCA
10,,SING,CG,CD,no,N,10,,19012,12021,PCA
11,,SING,CG,HG2,no,N,11,,19012,12021,PCA
12,,SING,CG,HG3,no,N,12,,19012,12021,PCA
13,,DOUB,CD,OE,no,N,13,,19012,12021,PCA
14,,DOUB,C,O,no,N,14,,19012,12021,PCA
15,,SING,C,OXT,no,N,15,,19012,12021,PCA
16,,SING,OXT,HXT,no,N,16,,19012,12021,PCA
1,,SING,C2,C3,no,N,1,,19028,12022,BGC
2,,SING,C2,C1,no,N,2,,19028,12022,BGC
3,,SING,C2,O2,no,N,3,,19028,12022,BGC
4,,SING,C2,H2,no,N,4,,19028,12022,BGC
5,,SING,C3,C4,no,N,5,,19028,12022,BGC
6,,SING,C3,O3,no,N,6,,19028,12022,BGC
7,,SING,C3,H3,no,N,7,,19028,12022,BGC
8,,SING,C4,C5,no,N,8,,19028,12022,BGC
9,,SING,C4,O4,no,N,9,,19028,12022,BGC
10,,SING,C4,H4,no,N,10,,19028,12022,BGC
11,,SING,C5,C6,no,N,11,,19028,12022,BGC
12,,SING,C5,O5,no,N,12,,19028,12022,BGC
13,,SING,C5,H5,no,N,13,,19028,12022,BGC
14,,SING,C6,O6,no,N,14,,19028,12022,BGC
15,,SING,C6,H6C1,no,N,15,,19028,12022,BGC
16,,SING,C6,H6C2,no,N,16,,19028,12022,BGC
17,,SING,C1,O1,no,N,17,,19028,12022,BGC
18,,SING,C1,O5,no,N,18,,19028,12022,BGC
19,,SING,C1,H1,no,N,19,,19028,12022,BGC
20,,SING,O1,HA,no,N,20,,19028,12022,BGC
21,,SING,O2,HB,no,N,21,,19028,12022,BGC
22,,SING,O3,HC,no,N,22,,19028,12022,BGC
23,,SING,O4,HD,no,N,23,,19028,12022,BGC
24,,SING,O6,H6,no,N,24,,19028,12022,BGC
1,,SING,FE,NA,no,N,1,,19596,131,HEC
2,,SING,FE,NB,no,N,2,,19596,131,HEC
3,,SING,FE,NC,no,N,3,,19596,131,HEC
4,,SING,FE,ND,no,N,4,,19596,131,HEC
5,,DOUB,CHA,C1A,no,N,5,,19596,131,HEC
6,,SING,CHA,C4D,no,N,6,,19596,131,HEC
7,,SING,CHA,HHA,no,N,7,,19596,131,HEC
8,,DOUB,CHB,C4A,no,N,8,,19596,131,HEC
9,,SING,CHB,C1B,no,N,9,,19596,131,HEC
10,,SING,CHB,HHB,no,N,10,,19596,131,HEC
11,,DOUB,CHC,C4B,no,N,11,,19596,131,HEC
12,,SING,CHC,C1C,no,N,12,,19596,131,HEC
13,,SING,CHC,HHC,no,N,13,,19596,131,HEC
14,,DOUB,CHD,C4C,no,N,14,,19596,131,HEC
15,,SING,CHD,C1D,no,N,15,,19596,131,HEC
16,,SING,CHD,HHD,no,N,16,,19596,131,HEC
17,,SING,NA,C1A,yes,N,17,,19596,131,HEC
18,,SING,NA,C4A,yes,N,18,,19596,131,HEC
19,,SING,C1A,C2A,yes,N,19,,19596,131,HEC
20,,DOUB,C2A,C3A,yes,N,20,,19596,131,HEC
21,,SING,C2A,CAA,no,N,21,,19596,131,HEC
22,,SING,C3A,C4A,yes,N,22,,19596,131,HEC
23,,SING,C3A,CMA,no,N,23,,19596,131,HEC
24,,SING,CMA,HMA1,no,N,24,,19596,131,HEC
25,,SING,CMA,HMA2,no,N,25,,19596,131,HEC
26,,SING,CMA,HMA3,no,N,26,,19596,131,HEC
27,,SING,CAA,CBA,no,N,27,,19596,131,HEC
28,,SING,CAA,HAA1,no,N,28,,19596,131,HEC
29,,SING,CAA,HAA2,no,N,29,,19596,131,HEC
30,,SING,CBA,CGA,no,N,30,,19596,131,HEC
31,,SING,CBA,HBA1,no,N,31,,19596,131,HEC
32,,SING,CBA,HBA2,no,N,32,,19596,131,HEC
33,,DOUB,CGA,O1A,no,N,33,,19596,131,HEC
34,,SING,CGA,O2A,no,N,34,,19596,131,HEC
35,,SING,O2A,H2A,no,N,35,,19596,131,HEC
36,,SING,NB,C1B,yes,N,36,,19596,131,HEC
37,,SING,NB,C4B,yes,N,37,,19596,131,HEC
38,,DOUB,C1B,C2B,yes,N,38,,19596,131,HEC
39,,SING,C2B,C3B,yes,N,39,,19596,131,HEC
40,,SING,C2B,CMB,no,N,40,,19596,131,HEC
41,,SING,C3B,C4B,yes,N,41,,19596,131,HEC
42,,DOUB,C3B,CAB,no,E,42,,19596,131,HEC
43,,SING,CMB,HMB1,no,N,43,,19596,131,HEC
44,,SING,CMB,HMB2,no,N,44,,19596,131,HEC
45,,SING,CMB,HMB3,no,N,45,,19596,131,HEC
46,,SING,CAB,CBB,no,N,46,,19596,131,HEC
47,,SING,CAB,HAB,no,N,47,,19596,131,HEC
48,,SING,CBB,HBB1,no,N,48,,19596,131,HEC
49,,SING,CBB,HBB2,no,N,49,,19596,131,HEC
50,,SING,CBB,HBB3,no,N,50,,19596,131,HEC
51,,SING,NC,C1C,yes,N,51,,19596,131,HEC
52,,SING,NC,C4C,yes,N,52,,19596,131,HEC
53,,DOUB,C1C,C2C,yes,N,53,,19596,131,HEC
54,,SING,C2C,C3C,yes,N,54,,19596,131,HEC
55,,SING,C2C,CMC,no,N,55,,19596,131,HEC
56,,SING,C3C,C4C,yes,N,56,,19596,131,HEC
57,,DOUB,C3C,CAC,no,E,57,,19596,131,HEC
58,,SING,CMC,HMC1,no,N,58,,19596,131,HEC
59,,SING,CMC,HMC2,no,N,59,,19596,131,HEC
60,,SING,CMC,HMC3,no,N,60,,19596,131,HEC
61,,SING,CAC,CBC,no,N,61,,19596,131,HEC
62,,SING,CAC,HAC,no,N,62,,19596,131,HEC
63,,SING,CBC,HBC1,no,N,63,,19596,131,HEC
64,,SING,CBC,HBC2,no,N,64,,19596,131,HEC
65,,SING,CBC,HBC3,no,N,65,,19596,131,HEC
66,,SING,ND,C1D,yes,N,66,,19596,131,HEC
67,,SING,ND,C4D,yes,N,67,,19596,131,HEC
68,,DOUB,C1D,C2D,yes,N,68,,19596,131,HEC
69,,SING,C2D,C3D,yes,N,69,,19596,131,HEC
70,,SING,C2D,CMD,no,N,70,,19596,131,HEC
71,,DOUB,C3D,C4D,yes,N,71,,19596,131,HEC
72,,SING,C3D,CAD,no,N,72,,19596,131,HEC
73,,SING,CMD,HMD1,no,N,73,,19596,131,HEC
74,,SING,CMD,HMD2,no,N,74,,19596,131,HEC
75,,SING,CMD,HMD3,no,N,75,,19596,131,HEC
76,,SING,CAD,CBD,no,N,76,,19596,131,HEC
77,,SING,CAD,HAD1,no,N,77,,19596,131,HEC
78,,SING,CAD,HAD2,no,N,78,,19596,131,HEC
79,,SING,CBD,CGD,no,N,79,,19596,131,HEC
80,,SING,CBD,HBD1,no,N,80,,19596,131,HEC
81,,SING,CBD,HBD2,no,N,81,,19596,131,HEC
82,,DOUB,CGD,O1D,no,N,82,,19596,131,HEC
83,,SING,CGD,O2D,no,N,83,,19596,131,HEC
84,,SING,O2D,H2D,no,N,84,,19596,131,HEC
1,,SING,N,CA,no,N,1,,19597,131,M3L
2,,SING,N,H,no,N,2,,19597,131,M3L
3,,SING,N,H2,no,N,3,,19597,131,M3L
4,,SING,CA,CB,no,N,4,,19597,131,M3L
5,,SING,CA,C,no,N,5,,19597,131,M3L
6,,SING,CA,HA,no,N,6,,19597,131,M3L
7,,SING,CB,CG,no,N,7,,19597,131,M3L
8,,SING,CB,HB2,no,N,8,,19597,131,M3L
9,,SING,CB,HB3,no,N,9,,19597,131,M3L
10,,SING,CG,CD,no,N,10,,19597,131,M3L
11,,SING,CG,HG2,no,N,11,,19597,131,M3L
12,,SING,CG,HG3,no,N,12,,19597,131,M3L
13,,SING,CD,CE,no,N,13,,19597,131,M3L
14,,SING,CD,HD2,no,N,14,,19597,131,M3L
15,,SING,CD,HD3,no,N,15,,19597,131,M3L
16,,SING,CE,NZ,no,N,16,,19597,131,M3L
17,,SING,CE,HE2,no,N,17,,19597,131,M3L
18,,SING,CE,HE3,no,N,18,,19597,131,M3L
19,,SING,NZ,CM1,no,N,19,,19597,131,M3L
20,,SING,NZ,CM2,no,N,20,,19597,131,M3L
21,,SING,NZ,CM3,no,N,21,,19597,131,M3L
22,,DOUB,C,O,no,N,22,,19597,131,M3L
23,,SING,C,OXT,no,N,23,,19597,131,M3L
24,,SING,OXT,HXT,no,N,24,,19597,131,M3L
25,,SING,CM1,HM11,no,N,25,,19597,131,M3L
26,,SING,CM1,HM12,no,N,26,,19597,131,M3L
27,,SING,CM1,HM13,no,N,27,,19597,131,M3L
28,,SING,CM2,HM21,no,N,28,,19597,131,M3L
29,,SING,CM2,HM22,no,N,29,,19597,131,M3L
30,,SING,CM2,HM23,no,N,30,,19597,131,M3L
31,,SING,CM3,HM31,no,N,31,,19597,131,M3L
32,,SING,CM3,HM32,no,N,32,,19597,131,M3L
33,,SING,CM3,HM33,no,N,33,,19597,131,M3L
1,,SING,C1A,C2A,no,N,1,,19949,1393,SAC
2,,DOUB,C1A,OAC,no,N,2,,19949,1393,SAC
3,,SING,C1A,N,no,N,3,,19949,1393,SAC
4,,SING,C2A,H2A1,no,N,4,,19949,1393,SAC
5,,SING,C2A,H2A2,no,N,5,,19949,1393,SAC
6,,SING,C2A,H2A3,no,N,6,,19949,1393,SAC
7,,SING,N,CA,no,N,7,,19949,1393,SAC
8,,SING,N,H,no,N,8,,19949,1393,SAC
9,,SING,CA,C,no,N,9,,19949,1393,SAC
10,,SING,CA,CB,no,N,10,,19949,1393,SAC
11,,SING,CA,HA,no,N,11,,19949,1393,SAC
12,,DOUB,C,O,no,N,12,,19949,1393,SAC
13,,SING,C,OXT,no,N,13,,19949,1393,SAC
14,,SING,OXT,HXT,no,N,14,,19949,1393,SAC
15,,SING,CB,OG,no,N,15,,19949,1393,SAC
16,,SING,CB,HB2,no,N,16,,19949,1393,SAC
17,,SING,CB,HB3,no,N,17,,19949,1393,SAC
18,,SING,OG,HG,no,N,18,,19949,1393,SAC
1,,SING,C1A,C2A,no,N,1,,19963,1394,SAC
2,,DOUB,C1A,OAC,no,N,2,,19963,1394,SAC
3,,SING,C1A,N,no,N,3,,19963,1394,SAC
4,,SING,C2A,H2A1,no,N,4,,19963,1394,SAC
5,,SING,C2A,H2A2,no,N,5,,19963,1394,SAC
6,,SING,C2A,H2A3,no,N,6,,19963,1394,SAC
7,,SING,N,CA,no,N,7,,19963,1394,SAC
8,,SING,N,H,no,N,8,,19963,1394,SAC
9,,SING,CA,C,no,N,9,,19963,1394,SAC
10,,SING,CA,CB,no,N,10,,19963,1394,SAC
11,,SING,CA,HA,no,N,11,,19963,1394,SAC
12,,DOUB,C,O,no,N,12,,19963,1394,SAC
13,,SING,C,OXT,no,N,13,,19963,1394,SAC
14,,SING,OXT,HXT,no,N,14,,19963,1394,SAC
15,,SING,CB,OG,no,N,15,,19963,1394,SAC
16,,SING,CB,HB2,no,N,16,,19963,1394,SAC
17,,SING,CB,HB3,no,N,17,,19963,1394,SAC
18,,SING,OG,HG,no,N,18,,19963,1394,SAC
1,,SING,N,HN1,no,N,1,,20055,1403,NH2
2,,SING,N,HN2,no,N,2,,20055,1403,NH2
1,,SING,FE,NA,no,N,1,,20068,1404,HEC
2,,SING,FE,NB,no,N,2,,20068,1404,HEC
3,,SING,FE,NC,no,N,3,,20068,1404,HEC
4,,SING,FE,ND,no,N,4,,20068,1404,HEC
5,,DOUB,CHA,C1A,no,N,5,,20068,1404,HEC
6,,SING,CHA,C4D,no,N,6,,20068,1404,HEC
7,,SING,CHA,HHA,no,N,7,,20068,1404,HEC
8,,DOUB,CHB,C4A,no,N,8,,20068,1404,HEC
9,,SING,CHB,C1B,no,N,9,,20068,1404,HEC
10,,SING,CHB,HHB,no,N,10,,20068,1404,HEC
11,,DOUB,CHC,C4B,no,N,11,,20068,1404,HEC
12,,SING,CHC,C1C,no,N,12,,20068,1404,HEC
13,,SING,CHC,HHC,no,N,13,,20068,1404,HEC
14,,DOUB,CHD,C4C,no,N,14,,20068,1404,HEC
15,,SING,CHD,C1D,no,N,15,,20068,1404,HEC
16,,SING,CHD,HHD,no,N,16,,20068,1404,HEC
17,,SING,NA,C1A,yes,N,17,,20068,1404,HEC
18,,SING,NA,C4A,yes,N,18,,20068,1404,HEC
19,,SING,C1A,C2A,yes,N,19,,20068,1404,HEC
20,,DOUB,C2A,C3A,yes,N,20,,20068,1404,HEC
21,,SING,C2A,CAA,no,N,21,,20068,1404,HEC
22,,SING,C3A,C4A,yes,N,22,,20068,1404,HEC
23,,SING,C3A,CMA,no,N,23,,20068,1404,HEC
24,,SING,CMA,HMA1,no,N,24,,20068,1404,HEC
25,,SING,CMA,HMA2,no,N,25,,20068,1404,HEC
26,,SING,CMA,HMA3,no,N,26,,20068,1404,HEC
27,,SING,CAA,CBA,no,N,27,,20068,1404,HEC
28,,SING,CAA,HAA1,no,N,28,,20068,1404,HEC
29,,SING,CAA,HAA2,no,N,29,,20068,1404,HEC
30,,SING,CBA,CGA,no,N,30,,20068,1404,HEC
31,,SING,CBA,HBA1,no,N,31,,20068,1404,HEC
32,,SING,CBA,HBA2,no,N,32,,20068,1404,HEC
33,,DOUB,CGA,O1A,no,N,33,,20068,1404,HEC
34,,SING,CGA,O2A,no,N,34,,20068,1404,HEC
35,,SING,O2A,H2A,no,N,35,,20068,1404,HEC
36,,SING,NB,C1B,yes,N,36,,20068,1404,HEC
37,,SING,NB,C4B,yes,N,37,,20068,1404,HEC
38,,DOUB,C1B,C2B,yes,N,38,,20068,1404,HEC
39,,SING,C2B,C3B,yes,N,39,,20068,1404,HEC
40,,SING,C2B,CMB,no,N,40,,20068,1404,HEC
41,,SING,C3B,C4B,yes,N,41,,20068,1404,HEC
42,,DOUB,C3B,CAB,no,E,42,,20068,1404,HEC
43,,SING,CMB,HMB1,no,N,43,,20068,1404,HEC
44,,SING,CMB,HMB2,no,N,44,,20068,1404,HEC
45,,SING,CMB,HMB3,no,N,45,,20068,1404,HEC
46,,SING,CAB,CBB,no,N,46,,20068,1404,HEC
47,,SING,CAB,HAB,no,N,47,,20068,1404,HEC
48,,SING,CBB,HBB1,no,N,48,,20068,1404,HEC
49,,SING,CBB,HBB2,no,N,49,,20068,1404,HEC
50,,SING,CBB,HBB3,no,N,50,,20068,1404,HEC
51,,SING,NC,C1C,yes,N,51,,20068,1404,HEC
52,,SING,NC,C4C,yes,N,52,,20068,1404,HEC
53,,DOUB,C1C,C2C,yes,N,53,,20068,1404,HEC
54,,SING,C2C,C3C,yes,N,54,,20068,1404,HEC
55,,SING,C2C,CMC,no,N,55,,20068,1404,HEC
56,,SING,C3C,C4C,yes,N,56,,20068,1404,HEC
57,,DOUB,C3C,CAC,no,E,57,,20068,1404,HEC
58,,SING,CMC,HMC1,no,N,58,,20068,1404,HEC
59,,SING,CMC,HMC2,no,N,59,,20068,1404,HEC
60,,SING,CMC,HMC3,no,N,60,,20068,1404,HEC
61,,SING,CAC,CBC,no,N,61,,20068,1404,HEC
62,,SING,CAC,HAC,no,N,62,,20068,1404,HEC
63,,SING,CBC,HBC1,no,N,63,,20068,1404,HEC
64,,SING,CBC,HBC2,no,N,64,,20068,1404,HEC
65,,SING,CBC,HBC3,no,N,65,,20068,1404,HEC
66,,SING,ND,C1D,yes,N,66,,20068,1404,HEC
67,,SING,ND,C4D,yes,N,67,,20068,1404,HEC
68,,DOUB,C1D,C2D,yes,N,68,,20068,1404,HEC
69,,SING,C2D,C3D,yes,N,69,,20068,1404,HEC
70,,SING,C2D,CMD,no,N,70,,20068,1404,HEC
71,,DOUB,C3D,C4D,yes,N,71,,20068,1404,HEC
72,,SING,C3D,CAD,no,N,72,,20068,1404,HEC
73,,SING,CMD,HMD1,no,N,73,,20068,1404,HEC
74,,SING,CMD,HMD2,no,N,74,,20068,1404,HEC
75,,SING,CMD,HMD3,no,N,75,,20068,1404,HEC
76,,SING,CAD,CBD,no,N,76,,20068,1404,HEC
77,,SING,CAD,HAD1,no,N,77,,20068,1404,HEC
78,,SING,CAD,HAD2,no,N,78,,20068,1404,HEC
79,,SING,CBD,CGD,no,N,79,,20068,1404,HEC
80,,SING,CBD,HBD1,no,N,80,,20068,1404,HEC
81,,SING,CBD,HBD2,no,N,81,,20068,1404,HEC
82,,DOUB,CGD,O1D,no,N,82,,20068,1404,HEC
83,,SING,CGD,O2D,no,N,83,,20068,1404,HEC
84,,SING,O2D,H2D,no,N,84,,20068,1404,HEC
1,,SING,C1,C2,no,N,1,,20069,1404,AAC
2,,SING,C1,O1,no,N,2,,20069,1404,AAC
3,,DOUB,C1,O2,no,N,3,,20069,1404,AAC
4,,SING,C2,N1,no,N,4,,20069,1404,AAC
5,,SING,C2,HC21,no,N,5,,20069,1404,AAC
6,,SING,C2,HC22,no,N,6,,20069,1404,AAC
7,,SING,C3,C4,no,N,7,,20069,1404,AAC
8,,SING,C3,N1,no,N,8,,20069,1404,AAC
9,,DOUB,C3,O3,no,N,9,,20069,1404,AAC
10,,SING,C4,HC41,no,N,10,,20069,1404,AAC
11,,SING,C4,HC42,no,N,11,,20069,1404,AAC
12,,SING,C4,HC43,no,N,12,,20069,1404,AAC
13,,SING,N1,HN1,no,N,13,,20069,1404,AAC
14,,SING,O1,HO1,no,N,14,,20069,1404,AAC
1,,SING,FE,NA,no,N,1,,20122,1416,HEC
2,,SING,FE,NB,no,N,2,,20122,1416,HEC
3,,SING,FE,NC,no,N,3,,20122,1416,HEC
4,,SING,FE,ND,no,N,4,,20122,1416,HEC
5,,DOUB,CHA,C1A,no,N,5,,20122,1416,HEC
6,,SING,CHA,C4D,no,N,6,,20122,1416,HEC
7,,SING,CHA,HHA,no,N,7,,20122,1416,HEC
8,,DOUB,CHB,C4A,no,N,8,,20122,1416,HEC
9,,SING,CHB,C1B,no,N,9,,20122,1416,HEC
10,,SING,CHB,HHB,no,N,10,,20122,1416,HEC
11,,DOUB,CHC,C4B,no,N,11,,20122,1416,HEC
12,,SING,CHC,C1C,no,N,12,,20122,1416,HEC
13,,SING,CHC,HHC,no,N,13,,20122,1416,HEC
14,,DOUB,CHD,C4C,no,N,14,,20122,1416,HEC
15,,SING,CHD,C1D,no,N,15,,20122,1416,HEC
16,,SING,CHD,HHD,no,N,16,,20122,1416,HEC
17,,SING,NA,C1A,yes,N,17,,20122,1416,HEC
18,,SING,NA,C4A,yes,N,18,,20122,1416,HEC
19,,SING,C1A,C2A,yes,N,19,,20122,1416,HEC
20,,DOUB,C2A,C3A,yes,N,20,,20122,1416,HEC
21,,SING,C2A,CAA,no,N,21,,20122,1416,HEC
22,,SING,C3A,C4A,yes,N,22,,20122,1416,HEC
23,,SING,C3A,CMA,no,N,23,,20122,1416,HEC
24,,SING,CMA,HMA1,no,N,24,,20122,1416,HEC
25,,SING,CMA,HMA2,no,N,25,,20122,1416,HEC
26,,SING,CMA,HMA3,no,N,26,,20122,1416,HEC
27,,SING,CAA,CBA,no,N,27,,20122,1416,HEC
28,,SING,CAA,HAA1,no,N,28,,20122,1416,HEC
29,,SING,CAA,HAA2,no,N,29,,20122,1416,HEC
30,,SING,CBA,CGA,no,N,30,,20122,1416,HEC
31,,SING,CBA,HBA1,no,N,31,,20122,1416,HEC
32,,SING,CBA,HBA2,no,N,32,,20122,1416,HEC
33,,DOUB,CGA,O1A,no,N,33,,20122,1416,HEC
34,,SING,CGA,O2A,no,N,34,,20122,1416,HEC
35,,SING,O2A,H2A,no,N,35,,20122,1416,HEC
36,,SING,NB,C1B,yes,N,36,,20122,1416,HEC
37,,SING,NB,C4B,yes,N,37,,20122,1416,HEC
38,,DOUB,C1B,C2B,yes,N,38,,20122,1416,HEC
39,,SING,C2B,C3B,yes,N,39,,20122,1416,HEC
40,,SING,C2B,CMB,no,N,40,,20122,1416,HEC
41,,SING,C3B,C4B,yes,N,41,,20122,1416,HEC
42,,DOUB,C3B,CAB,no,E,42,,20122,1416,HEC
43,,SING,CMB,HMB1,no,N,43,,20122,1416,HEC
44,,SING,CMB,HMB2,no,N,44,,20122,1416,HEC
45,,SING,CMB,HMB3,no,N,45,,20122,1416,HEC
46,,SING,CAB,CBB,no,N,46,,20122,1416,HEC
47,,SING,CAB,HAB,no,N,47,,20122,1416,HEC
48,,SING,CBB,HBB1,no,N,48,,20122,1416,HEC
49,,SING,CBB,HBB2,no,N,49,,20122,1416,HEC
50,,SING,CBB,HBB3,no,N,50,,20122,1416,HEC
51,,SING,NC,C1C,yes,N,51,,20122,1416,HEC
52,,SING,NC,C4C,yes,N,52,,20122,1416,HEC
53,,DOUB,C1C,C2C,yes,N,53,,20122,1416,HEC
54,,SING,C2C,C3C,yes,N,54,,20122,1416,HEC
55,,SING,C2C,CMC,no,N,55,,20122,1416,HEC
56,,SING,C3C,C4C,yes,N,56,,20122,1416,HEC
57,,DOUB,C3C,CAC,no,E,57,,20122,1416,HEC
58,,SING,CMC,HMC1,no,N,58,,20122,1416,HEC
59,,SING,CMC,HMC2,no,N,59,,20122,1416,HEC
60,,SING,CMC,HMC3,no,N,60,,20122,1416,HEC
61,,SING,CAC,CBC,no,N,61,,20122,1416,HEC
62,,SING,CAC,HAC,no,N,62,,20122,1416,HEC
63,,SING,CBC,HBC1,no,N,63,,20122,1416,HEC
64,,SING,CBC,HBC2,no,N,64,,20122,1416,HEC
65,,SING,CBC,HBC3,no,N,65,,20122,1416,HEC
66,,SING,ND,C1D,yes,N,66,,20122,1416,HEC
67,,SING,ND,C4D,yes,N,67,,20122,1416,HEC
68,,DOUB,C1D,C2D,yes,N,68,,20122,1416,HEC
69,,SING,C2D,C3D,yes,N,69,,20122,1416,HEC
70,,SING,C2D,CMD,no,N,70,,20122,1416,HEC
71,,DOUB,C3D,C4D,yes,N,71,,20122,1416,HEC
72,,SING,C3D,CAD,no,N,72,,20122,1416,HEC
73,,SING,CMD,HMD1,no,N,73,,20122,1416,HEC
74,,SING,CMD,HMD2,no,N,74,,20122,1416,HEC
75,,SING,CMD,HMD3,no,N,75,,20122,1416,HEC
76,,SING,CAD,CBD,no,N,76,,20122,1416,HEC
77,,SING,CAD,HAD1,no,N,77,,20122,1416,HEC
78,,SING,CAD,HAD2,no,N,78,,20122,1416,HEC
79,,SING,CBD,CGD,no,N,79,,20122,1416,HEC
80,,SING,CBD,HBD1,no,N,80,,20122,1416,HEC
81,,SING,CBD,HBD2,no,N,81,,20122,1416,HEC
82,,DOUB,CGD,O1D,no,N,82,,20122,1416,HEC
83,,SING,CGD,O2D,no,N,83,,20122,1416,HEC
84,,SING,O2D,H2D,no,N,84,,20122,1416,HEC
1,,SING,N,CA,no,N,1,,20162,144,AYA
2,,SING,N,CT,no,N,2,,20162,144,AYA
3,,SING,N,H,no,N,3,,20162,144,AYA
4,,SING,CA,CB,no,N,4,,20162,144,AYA
5,,SING,CA,C,no,N,5,,20162,144,AYA
6,,SING,CA,HA,no,N,6,,20162,144,AYA
7,,SING,CB,HB1,no,N,7,,20162,144,AYA
8,,SING,CB,HB2,no,N,8,,20162,144,AYA
9,,SING,CB,HB3,no,N,9,,20162,144,AYA
10,,DOUB,C,O,no,N,10,,20162,144,AYA
11,,SING,C,OXT,no,N,11,,20162,144,AYA
12,,SING,OXT,HXT,no,N,12,,20162,144,AYA
13,,DOUB,CT,OT,no,N,13,,20162,144,AYA
14,,SING,CT,CM,no,N,14,,20162,144,AYA
15,,SING,CM,HM1,no,N,15,,20162,144,AYA
16,,SING,CM,HM2,no,N,16,,20162,144,AYA
17,,SING,CM,HM3,no,N,17,,20162,144,AYA
1,,DOUB,C,O,no,N,1,,20241,1445,ACE
2,,SING,C,CH3,no,N,2,,20241,1445,ACE
3,,SING,C,H,no,N,3,,20241,1445,ACE
4,,SING,CH3,H1,no,N,4,,20241,1445,ACE
5,,SING,CH3,H2,no,N,5,,20241,1445,ACE
6,,SING,CH3,H3,no,N,6,,20241,1445,ACE
1,,SING,N,HN1,no,N,1,,20242,1445,NH2
2,,SING,N,HN2,no,N,2,,20242,1445,NH2
1,,DOUB,C,O,no,N,1,,20256,1446,ACE
2,,SING,C,CH3,no,N,2,,20256,1446,ACE
3,,SING,C,H,no,N,3,,20256,1446,ACE
4,,SING,CH3,H1,no,N,4,,20256,1446,ACE
5,,SING,CH3,H2,no,N,5,,20256,1446,ACE
6,,SING,CH3,H3,no,N,6,,20256,1446,ACE
1,,SING,N,HN1,no,N,1,,20257,1446,NH2
2,,SING,N,HN2,no,N,2,,20257,1446,NH2
1,,SING,N,CA,no,N,1,,20414,146,PCA
2,,SING,N,CD,no,N,2,,20414,146,PCA
3,,SING,N,H,no,N,3,,20414,146,PCA
4,,SING,CA,CB,no,N,4,,20414,146,PCA
5,,SING,CA,C,no,N,5,,20414,146,PCA
6,,SING,CA,HA,no,N,6,,20414,146,PCA
7,,SING,CB,CG,no,N,7,,20414,146,PCA
8,,SING,CB,HB2,no,N,8,,20414,146,PCA
9,,SING,CB,HB3,no,N,9,,20414,146,PCA
10,,SING,CG,CD,no,N,10,,20414,146,PCA
11,,SING,CG,HG2,no,N,11,,20414,146,PCA
12,,SING,CG,HG3,no,N,12,,20414,146,PCA
13,,DOUB,CD,OE,no,N,13,,20414,146,PCA
14,,DOUB,C,O,no,N,14,,20414,146,PCA
15,,SING,C,OXT,no,N,15,,20414,146,PCA
16,,SING,OXT,HXT,no,N,16,,20414,146,PCA
1,,DOUB,O,C,no,N,1,,20611,1481,LPD
2,,SING,C,N2,no,N,2,,20611,1481,LPD
3,,SING,C,CA,no,N,3,,20611,1481,LPD
4,,SING,N2,HN21,no,N,4,,20611,1481,LPD
5,,SING,N2,HN22,no,N,5,,20611,1481,LPD
6,,SING,CA,N,no,N,6,,20611,1481,LPD
7,,SING,CA,CB,no,N,7,,20611,1481,LPD
8,,SING,CA,HA,no,N,8,,20611,1481,LPD
9,,SING,N,CD,no,N,9,,20611,1481,LPD
10,,SING,N,H,no,N,10,,20611,1481,LPD
11,,SING,CD,CG,no,N,11,,20611,1481,LPD
12,,SING,CD,HD3,no,N,12,,20611,1481,LPD
13,,SING,CD,HD2,no,N,13,,20611,1481,LPD
14,,SING,CG,CB,no,N,14,,20611,1481,LPD
15,,SING,CG,HG3,no,N,15,,20611,1481,LPD
16,,SING,CG,HG2,no,N,16,,20611,1481,LPD
17,,SING,CB,HB2,no,N,17,,20611,1481,LPD
18,,SING,CB,HB3,no,N,18,,20611,1481,LPD
1,,DOUB,O,C,no,N,1,,20625,1482,LPD
2,,SING,C,N2,no,N,2,,20625,1482,LPD
3,,SING,C,CA,no,N,3,,20625,1482,LPD
4,,SING,N2,HN21,no,N,4,,20625,1482,LPD
5,,SING,N2,HN22,no,N,5,,20625,1482,LPD
6,,SING,CA,N,no,N,6,,20625,1482,LPD
7,,SING,CA,CB,no,N,7,,20625,1482,LPD
8,,SING,CA,HA,no,N,8,,20625,1482,LPD
9,,SING,N,CD,no,N,9,,20625,1482,LPD
10,,SING,N,H,no,N,10,,20625,1482,LPD
11,,SING,CD,CG,no,N,11,,20625,1482,LPD
12,,SING,CD,HD3,no,N,12,,20625,1482,LPD
13,,SING,CD,HD2,no,N,13,,20625,1482,LPD
14,,SING,CG,CB,no,N,14,,20625,1482,LPD
15,,SING,CG,HG3,no,N,15,,20625,1482,LPD
16,,SING,CG,HG2,no,N,16,,20625,1482,LPD
17,,SING,CB,HB2,no,N,17,,20625,1482,LPD
18,,SING,CB,HB3,no,N,18,,20625,1482,LPD
1,,SING,HFA,O01,no,N,1,,20797,15000,PHF
2,,SING,HFA,O02,no,N,2,,20797,15000,PHF
3,,SING,HFA,OAE,no,N,3,,20797,15000,PHF
4,,SING,HFA,OA1,no,N,4,,20797,15000,PHF
5,,SING,HFA,OAB,no,N,5,,20797,15000,PHF
6,,SING,HFA,O3,no,N,6,,20797,15000,PHF
7,,SING,O01,HFD,no,N,7,,20797,15000,PHF
8,,SING,O01,HFE,no,N,8,,20797,15000,PHF
9,,SING,O02,HFB,no,N,9,,20797,15000,PHF
10,,SING,O02,HFC,no,N,10,,20797,15000,PHF
11,,SING,O02,HFD,no,N,11,,20797,15000,PHF
12,,SING,OAE,HFE,no,N,12,,20797,15000,PHF
13,,SING,OA1,HA11,no,N,13,,20797,15000,PHF
14,,SING,OAB,HFB,no,N,14,,20797,15000,PHF
15,,SING,HFB,OBC,no,N,15,,20797,15000,PHF
16,,SING,HFB,OBD,no,N,16,,20797,15000,PHF
17,,SING,HFB,OB1,no,N,17,,20797,15000,PHF
18,,SING,HFB,OB2,no,N,18,,20797,15000,PHF
19,,SING,HFB,OB3,no,N,19,,20797,15000,PHF
20,,SING,OBC,HFC,no,N,20,,20797,15000,PHF
21,,SING,OBD,HFD,no,N,21,,20797,15000,PHF
22,,SING,OB1,HB11,no,N,22,,20797,15000,PHF
23,,SING,OB2,HB21,no,N,23,,20797,15000,PHF
24,,SING,OB3,HB31,no,N,24,,20797,15000,PHF
25,,SING,HFC,OCD,no,N,25,,20797,15000,PHF
26,,SING,HFC,OC1,no,N,26,,20797,15000,PHF
27,,SING,HFC,OC2,no,N,27,,20797,15000,PHF
28,,SING,HFC,OC3,no,N,28,,20797,15000,PHF
29,,SING,OCD,HFD,no,N,29,,20797,15000,PHF
30,,SING,OC1,HC11,no,N,30,,20797,15000,PHF
31,,SING,OC2,HC21,no,N,31,,20797,15000,PHF
32,,SING,OC3,HC31,no,N,32,,20797,15000,PHF
33,,SING,HFD,ODE,no,N,33,,20797,15000,PHF
34,,SING,HFD,OD1,no,N,34,,20797,15000,PHF
35,,SING,HFD,O2,no,N,35,,20797,15000,PHF
36,,SING,ODE,HFE,no,N,36,,20797,15000,PHF
37,,SING,OD1,HD11,no,N,37,,20797,15000,PHF
38,,SING,HFE,OE1,no,N,38,,20797,15000,PHF
39,,SING,HFE,OE2,no,N,39,,20797,15000,PHF
40,,SING,HFE,OE3,no,N,40,,20797,15000,PHF
41,,SING,HFE,O1,no,N,41,,20797,15000,PHF
42,,SING,OE1,HE11,no,N,42,,20797,15000,PHF
43,,SING,OE2,HE21,no,N,43,,20797,15000,PHF
44,,SING,OE3,HE31,no,N,44,,20797,15000,PHF
45,,SING,P,O1,no,N,45,,20797,15000,PHF
46,,SING,P,O2,no,N,46,,20797,15000,PHF
47,,SING,P,O3,no,N,47,,20797,15000,PHF
48,,DOUB,P,O4,no,N,48,,20797,15000,PHF
1,,SING,N3A,C3A,yes,N,1,,21133,15026,GIQ
2,,SING,N3A,C,no,N,2,,21133,15026,GIQ
3,,SING,N3A,C2A,yes,N,3,,21133,15026,GIQ
4,,DOUB,C3A,C1A,yes,N,4,,21133,15026,GIQ
5,,SING,C3A,C4A,yes,N,5,,21133,15026,GIQ
6,,SING,C1A,N1A,yes,N,6,,21133,15026,GIQ
7,,SING,C1A,C10,yes,N,7,,21133,15026,GIQ
8,,DOUB,N1A,C2A,yes,N,8,,21133,15026,GIQ
9,,SING,C,H1,no,N,9,,21133,15026,GIQ
10,,SING,C,H2,no,N,10,,21133,15026,GIQ
11,,SING,C,H3,no,N,11,,21133,15026,GIQ
12,,DOUB,C4A,C5A,yes,N,12,,21133,15026,GIQ
13,,SING,C4A,H4A,no,N,13,,21133,15026,GIQ
14,,SING,C5A,C6A,yes,N,14,,21133,15026,GIQ
15,,SING,C5A,H5A,no,N,15,,21133,15026,GIQ
16,,SING,C6A,C10,yes,N,16,,21133,15026,GIQ
17,,DOUB,C6A,N6A,yes,N,17,,21133,15026,GIQ
18,,DOUB,C10,C9A,yes,N,18,,21133,15026,GIQ
19,,SING,N6A,C7A,yes,N,19,,21133,15026,GIQ
20,,DOUB,C7A,C8A,yes,N,20,,21133,15026,GIQ
21,,SING,C7A,H7A,no,N,21,,21133,15026,GIQ
22,,SING,C8A,C9A,yes,N,22,,21133,15026,GIQ
23,,SING,C8A,H8A,no,N,23,,21133,15026,GIQ
24,,SING,C9A,H9A,no,N,24,,21133,15026,GIQ
25,,SING,N10,C2A,no,N,25,,21133,15026,GIQ
26,,SING,N10,H101,no,N,26,,21133,15026,GIQ
27,,SING,N10,H102,no,N,27,,21133,15026,GIQ
1,,SING,N,HN1,no,N,1,,21210,15031,NH2
2,,SING,N,HN2,no,N,2,,21210,15031,NH2
1,,SING,N,HN1,no,N,1,,21354,15040,NH2
2,,SING,N,HN2,no,N,2,,21354,15040,NH2
1,,SING,N,HN1,no,N,1,,21369,15041,NH2
2,,SING,N,HN2,no,N,2,,21369,15041,NH2
1,,SING,N,HN1,no,N,1,,21384,15042,NH2
2,,SING,N,HN2,no,N,2,,21384,15042,NH2
1,,SING,N,HN1,no,N,1,,21399,15043,NH2
2,,SING,N,HN2,no,N,2,,21399,15043,NH2
1,,SING,N,HN1,no,N,1,,21414,15044,NH2
2,,SING,N,HN2,no,N,2,,21414,15044,NH2
1,,DOUB,PB,O1B,no,N,1,,21478,15048,GDP
2,,SING,PB,O2B,no,N,2,,21478,15048,GDP
3,,SING,PB,O3B,no,N,3,,21478,15048,GDP
4,,SING,PB,O3A,no,N,4,,21478,15048,GDP
5,,SING,O2B,HOB2,no,N,5,,21478,15048,GDP
6,,SING,O3B,HOB3,no,N,6,,21478,15048,GDP
7,,SING,O3A,PA,no,N,7,,21478,15048,GDP
8,,DOUB,PA,O1A,no,N,8,,21478,15048,GDP
9,,SING,PA,O2A,no,N,9,,21478,15048,GDP
10,,SING,PA,O5',no,N,10,,21478,15048,GDP
11,,SING,O2A,HOA2,no,N,11,,21478,15048,GDP
12,,SING,O5',C5',no,N,12,,21478,15048,GDP
13,,SING,C5',C4',no,N,13,,21478,15048,GDP
14,,SING,C5',H5',no,N,14,,21478,15048,GDP
15,,SING,C5',H5'',no,N,15,,21478,15048,GDP
16,,SING,C4',O4',no,N,16,,21478,15048,GDP
17,,SING,C4',C3',no,N,17,,21478,15048,GDP
18,,SING,C4',H4',no,N,18,,21478,15048,GDP
19,,SING,O4',C1',no,N,19,,21478,15048,GDP
20,,SING,C3',O3',no,N,20,,21478,15048,GDP
21,,SING,C3',C2',no,N,21,,21478,15048,GDP
22,,SING,C3',H3',no,N,22,,21478,15048,GDP
23,,SING,O3',HO3',no,N,23,,21478,15048,GDP
24,,SING,C2',O2',no,N,24,,21478,15048,GDP
25,,SING,C2',C1',no,N,25,,21478,15048,GDP
26,,SING,C2',H2',no,N,26,,21478,15048,GDP
27,,SING,O2',HO2',no,N,27,,21478,15048,GDP
28,,SING,C1',N9,no,N,28,,21478,15048,GDP
29,,SING,C1',H1',no,N,29,,21478,15048,GDP
30,,SING,N9,C8,yes,N,30,,21478,15048,GDP
31,,SING,N9,C4,yes,N,31,,21478,15048,GDP
32,,DOUB,C8,N7,yes,N,32,,21478,15048,GDP
33,,SING,C8,H8,no,N,33,,21478,15048,GDP
34,,SING,N7,C5,yes,N,34,,21478,15048,GDP
35,,SING,C5,C6,no,N,35,,21478,15048,GDP
36,,DOUB,C5,C4,yes,N,36,,21478,15048,GDP
37,,DOUB,C6,O6,no,N,37,,21478,15048,GDP
38,,SING,C6,N1,no,N,38,,21478,15048,GDP
39,,SING,N1,C2,no,N,39,,21478,15048,GDP
40,,SING,N1,HN1,no,N,40,,21478,15048,GDP
41,,SING,C2,N2,no,N,41,,21478,15048,GDP
42,,DOUB,C2,N3,no,N,42,,21478,15048,GDP
43,,SING,N2,HN21,no,N,43,,21478,15048,GDP
44,,SING,N2,HN22,no,N,44,,21478,15048,GDP
45,,SING,N3,C4,no,N,45,,21478,15048,GDP
1,,SING,N,HN1,no,N,1,,21511,15050,NH2
2,,SING,N,HN2,no,N,2,,21511,15050,NH2
1,,SING,N,HN1,no,N,1,,21528,15051,NH2
2,,SING,N,HN2,no,N,2,,21528,15051,NH2
1,,DOUB,C,O,no,N,1,,21611,15056,ACE
2,,SING,C,CH3,no,N,2,,21611,15056,ACE
3,,SING,C,H,no,N,3,,21611,15056,ACE
4,,SING,CH3,H1,no,N,4,,21611,15056,ACE
5,,SING,CH3,H2,no,N,5,,21611,15056,ACE
6,,SING,CH3,H3,no,N,6,,21611,15056,ACE
1,,SING,N,CA,no,N,1,,21612,15056,AIB
2,,SING,N,H,no,N,2,,21612,15056,AIB
3,,SING,N,H2,no,N,3,,21612,15056,AIB
4,,SING,CA,C,no,N,4,,21612,15056,AIB
5,,SING,CA,CB1,no,N,5,,21612,15056,AIB
6,,SING,CA,CB2,no,N,6,,21612,15056,AIB
7,,DOUB,C,O,no,N,7,,21612,15056,AIB
8,,SING,C,OXT,no,N,8,,21612,15056,AIB
9,,SING,OXT,HO2,no,N,9,,21612,15056,AIB
10,,SING,CB1,HB11,no,N,10,,21612,15056,AIB
11,,SING,CB1,HB12,no,N,11,,21612,15056,AIB
12,,SING,CB1,HB13,no,N,12,,21612,15056,AIB
13,,SING,CB2,HB21,no,N,13,,21612,15056,AIB
14,,SING,CB2,HB22,no,N,14,,21612,15056,AIB
15,,SING,CB2,HB23,no,N,15,,21612,15056,AIB
1,,SING,N,CA,no,N,1,,21613,15056,DIV
2,,SING,N,H,no,N,2,,21613,15056,DIV
3,,SING,N,H2,no,N,3,,21613,15056,DIV
4,,SING,CA,CB1,no,N,4,,21613,15056,DIV
5,,SING,CA,CB2,no,N,5,,21613,15056,DIV
6,,SING,CA,C,no,N,6,,21613,15056,DIV
7,,SING,CB1,CG1,no,N,7,,21613,15056,DIV
8,,SING,CB1,HB11,no,N,8,,21613,15056,DIV
9,,SING,CB1,HB12,no,N,9,,21613,15056,DIV
10,,SING,CG1,HG11,no,N,10,,21613,15056,DIV
11,,SING,CG1,HG12,no,N,11,,21613,15056,DIV
12,,SING,CG1,HG13,no,N,12,,21613,15056,DIV
13,,SING,CB2,HB21,no,N,13,,21613,15056,DIV
14,,SING,CB2,HB22,no,N,14,,21613,15056,DIV
15,,SING,CB2,HB23,no,N,15,,21613,15056,DIV
16,,DOUB,C,O,no,N,16,,21613,15056,DIV
17,,SING,C,OXT,no,N,17,,21613,15056,DIV
18,,SING,OXT,HXT,no,N,18,,21613,15056,DIV
1,,SING,N,CA,no,N,1,,21614,15056,HYP
2,,SING,N,CD,no,N,2,,21614,15056,HYP
3,,SING,N,H,no,N,3,,21614,15056,HYP
4,,SING,CA,C,no,N,4,,21614,15056,HYP
5,,SING,CA,CB,no,N,5,,21614,15056,HYP
6,,SING,CA,HA,no,N,6,,21614,15056,HYP
7,,DOUB,C,O,no,N,7,,21614,15056,HYP
8,,SING,C,OXT,no,N,8,,21614,15056,HYP
9,,SING,CB,CG,no,N,9,,21614,15056,HYP
10,,SING,CB,HB2,no,N,10,,21614,15056,HYP
11,,SING,CB,HB3,no,N,11,,21614,15056,HYP
12,,SING,CG,CD,no,N,12,,21614,15056,HYP
13,,SING,CG,OD1,no,N,13,,21614,15056,HYP
14,,SING,CG,HG,no,N,14,,21614,15056,HYP
15,,SING,CD,HD22,no,N,15,,21614,15056,HYP
16,,SING,CD,HD23,no,N,16,,21614,15056,HYP
17,,SING,OD1,HD1,no,N,17,,21614,15056,HYP
18,,SING,OXT,HXT,no,N,18,,21614,15056,HYP
1,,SING,N,CA,no,N,1,,21615,15056,PHL
2,,SING,N,H,no,N,2,,21615,15056,PHL
3,,SING,N,H2,no,N,3,,21615,15056,PHL
4,,SING,CA,C,no,N,4,,21615,15056,PHL
5,,SING,CA,CB,no,N,5,,21615,15056,PHL
6,,SING,CA,HA,no,N,6,,21615,15056,PHL
7,,SING,C,O,no,N,7,,21615,15056,PHL
8,,SING,C,HC1,no,N,8,,21615,15056,PHL
9,,SING,C,HC2,no,N,9,,21615,15056,PHL
10,,SING,O,HO,no,N,10,,21615,15056,PHL
11,,SING,CB,CG,no,N,11,,21615,15056,PHL
12,,SING,CB,HB2,no,N,12,,21615,15056,PHL
13,,SING,CB,HB3,no,N,13,,21615,15056,PHL
14,,DOUB,CG,CD1,yes,N,14,,21615,15056,PHL
15,,SING,CG,CD2,yes,N,15,,21615,15056,PHL
16,,SING,CD1,CE1,yes,N,16,,21615,15056,PHL
17,,SING,CD1,HD1,no,N,17,,21615,15056,PHL
18,,DOUB,CD2,CE2,yes,N,18,,21615,15056,PHL
19,,SING,CD2,HD2,no,N,19,,21615,15056,PHL
20,,DOUB,CE1,CZ,yes,N,20,,21615,15056,PHL
21,,SING,CE1,HE1,no,N,21,,21615,15056,PHL
22,,SING,CE2,CZ,yes,N,22,,21615,15056,PHL
23,,SING,CE2,HE2,no,N,23,,21615,15056,PHL
24,,SING,CZ,HZ,no,N,24,,21615,15056,PHL
1,,SING,P,O1P,no,N,1,,21775,15065,PGA
2,,DOUB,P,O2P,no,N,2,,21775,15065,PGA
3,,SING,P,O3P,no,N,3,,21775,15065,PGA
4,,SING,P,O4P,no,N,4,,21775,15065,PGA
5,,SING,O1P,C2,no,N,5,,21775,15065,PGA
6,,SING,O3P,HOP3,no,N,6,,21775,15065,PGA
7,,SING,O4P,HOP4,no,N,7,,21775,15065,PGA
8,,SING,C2,C1,no,N,8,,21775,15065,PGA
9,,SING,C2,H21,no,N,9,,21775,15065,PGA
10,,SING,C2,H22,no,N,10,,21775,15065,PGA
11,,DOUB,C1,O1,no,N,11,,21775,15065,PGA
12,,SING,C1,O2,no,N,12,,21775,15065,PGA
13,,SING,O2,HO2,no,N,13,,21775,15065,PGA
1,,SING,P,O1P,no,N,1,,21827,15067,PGA
2,,DOUB,P,O2P,no,N,2,,21827,15067,PGA
3,,SING,P,O3P,no,N,3,,21827,15067,PGA
4,,SING,P,O4P,no,N,4,,21827,15067,PGA
5,,SING,O1P,C2,no,N,5,,21827,15067,PGA
6,,SING,O3P,HOP3,no,N,6,,21827,15067,PGA
7,,SING,O4P,HOP4,no,N,7,,21827,15067,PGA
8,,SING,C2,C1,no,N,8,,21827,15067,PGA
9,,SING,C2,H21,no,N,9,,21827,15067,PGA
10,,SING,C2,H22,no,N,10,,21827,15067,PGA
11,,DOUB,C1,O1,no,N,11,,21827,15067,PGA
12,,SING,C1,O2,no,N,12,,21827,15067,PGA
13,,SING,O2,HO2,no,N,13,,21827,15067,PGA
1,,SING,N,HN1,no,N,1,,21848,15068,NH2
2,,SING,N,HN2,no,N,2,,21848,15068,NH2
1,,SING,N,HN1,no,N,1,,21865,15069,NH2
2,,SING,N,HN2,no,N,2,,21865,15069,NH2
1,,SING,CHA,C1A,yes,N,1,,21932,15073,HEM
2,,DOUB,CHA,C4D,yes,N,2,,21932,15073,HEM
3,,SING,CHA,HHA,no,N,3,,21932,15073,HEM
4,,SING,CHB,C4A,yes,N,4,,21932,15073,HEM
5,,DOUB,CHB,C1B,yes,N,5,,21932,15073,HEM
6,,SING,CHB,HHB,no,N,6,,21932,15073,HEM
7,,SING,CHC,C4B,yes,N,7,,21932,15073,HEM
8,,DOUB,CHC,C1C,yes,N,8,,21932,15073,HEM
9,,SING,CHC,HHC,no,N,9,,21932,15073,HEM
10,,DOUB,CHD,C4C,yes,N,10,,21932,15073,HEM
11,,SING,CHD,C1D,yes,N,11,,21932,15073,HEM
12,,SING,CHD,HHD,no,N,12,,21932,15073,HEM
13,,DOUB,C1A,C2A,yes,N,13,,21932,15073,HEM
14,,SING,C1A,NA,yes,N,14,,21932,15073,HEM
15,,SING,C2A,C3A,yes,N,15,,21932,15073,HEM
16,,SING,C2A,CAA,no,N,16,,21932,15073,HEM
17,,DOUB,C3A,C4A,yes,N,17,,21932,15073,HEM
18,,SING,C3A,CMA,no,N,18,,21932,15073,HEM
19,,SING,C4A,NA,yes,N,19,,21932,15073,HEM
20,,SING,CMA,HMA,no,N,20,,21932,15073,HEM
21,,SING,CMA,HMAA,no,N,21,,21932,15073,HEM
22,,SING,CMA,HMAB,no,N,22,,21932,15073,HEM
23,,SING,CAA,CBA,no,N,23,,21932,15073,HEM
24,,SING,CAA,HAA,no,N,24,,21932,15073,HEM
25,,SING,CAA,HAAA,no,N,25,,21932,15073,HEM
26,,SING,CBA,CGA,no,N,26,,21932,15073,HEM
27,,SING,CBA,HBA,no,N,27,,21932,15073,HEM
28,,SING,CBA,HBAA,no,N,28,,21932,15073,HEM
29,,DOUB,CGA,O1A,no,N,29,,21932,15073,HEM
30,,SING,CGA,O2A,no,N,30,,21932,15073,HEM
31,,SING,C1B,C2B,no,N,31,,21932,15073,HEM
32,,SING,C1B,NB,yes,N,32,,21932,15073,HEM
33,,DOUB,C2B,C3B,yes,N,33,,21932,15073,HEM
34,,SING,C2B,CMB,yes,N,34,,21932,15073,HEM
35,,SING,C3B,C4B,no,N,35,,21932,15073,HEM
36,,SING,C3B,CAB,yes,N,36,,21932,15073,HEM
37,,DOUB,C4B,NB,no,N,37,,21932,15073,HEM
38,,SING,CMB,HMB,yes,N,38,,21932,15073,HEM
39,,SING,CMB,HMBA,no,N,39,,21932,15073,HEM
40,,SING,CMB,HMBB,no,N,40,,21932,15073,HEM
41,,DOUB,CAB,CBB,no,N,41,,21932,15073,HEM
42,,SING,CAB,HAB,no,N,42,,21932,15073,HEM
43,,SING,CBB,HBB,no,N,43,,21932,15073,HEM
44,,SING,CBB,HBBA,no,N,44,,21932,15073,HEM
45,,SING,C1C,C2C,no,N,45,,21932,15073,HEM
46,,SING,C1C,NC,yes,N,46,,21932,15073,HEM
47,,DOUB,C2C,C3C,yes,N,47,,21932,15073,HEM
48,,SING,C2C,CMC,yes,N,48,,21932,15073,HEM
49,,SING,C3C,C4C,no,N,49,,21932,15073,HEM
50,,SING,C3C,CAC,yes,N,50,,21932,15073,HEM
51,,SING,C4C,NC,no,N,51,,21932,15073,HEM
52,,SING,CMC,HMC,yes,N,52,,21932,15073,HEM
53,,SING,CMC,HMCA,no,N,53,,21932,15073,HEM
54,,SING,CMC,HMCB,no,N,54,,21932,15073,HEM
55,,DOUB,CAC,CBC,no,N,55,,21932,15073,HEM
56,,SING,CAC,HAC,no,N,56,,21932,15073,HEM
57,,SING,CBC,HBC,no,N,57,,21932,15073,HEM
58,,SING,CBC,HBCA,no,N,58,,21932,15073,HEM
59,,SING,C1D,C2D,no,N,59,,21932,15073,HEM
60,,DOUB,C1D,ND,yes,N,60,,21932,15073,HEM
61,,DOUB,C2D,C3D,yes,N,61,,21932,15073,HEM
62,,SING,C2D,CMD,yes,N,62,,21932,15073,HEM
63,,SING,C3D,C4D,no,N,63,,21932,15073,HEM
64,,SING,C3D,CAD,yes,N,64,,21932,15073,HEM
65,,SING,C4D,ND,no,N,65,,21932,15073,HEM
66,,SING,CMD,HMD,yes,N,66,,21932,15073,HEM
67,,SING,CMD,HMDA,no,N,67,,21932,15073,HEM
68,,SING,CMD,HMDB,no,N,68,,21932,15073,HEM
69,,SING,CAD,CBD,no,N,69,,21932,15073,HEM
70,,SING,CAD,HAD,no,N,70,,21932,15073,HEM
71,,SING,CAD,HADA,no,N,71,,21932,15073,HEM
72,,SING,CBD,CGD,no,N,72,,21932,15073,HEM
73,,SING,CBD,HBD,no,N,73,,21932,15073,HEM
74,,SING,CBD,HBDA,no,N,74,,21932,15073,HEM
75,,DOUB,CGD,O1D,no,N,75,,21932,15073,HEM
76,,SING,CGD,O2D,no,N,76,,21932,15073,HEM
77,,SING,O2A,H2A,no,N,77,,21932,15073,HEM
78,,SING,O2D,H2D,no,N,78,,21932,15073,HEM
79,,SING,FE,NA,no,N,79,,21932,15073,HEM
80,,SING,FE,NB,no,N,80,,21932,15073,HEM
81,,SING,FE,NC,no,N,81,,21932,15073,HEM
82,,SING,FE,ND,no,N,82,,21932,15073,HEM
1,,SING,N1,C2,no,N,1,,22078,15081,PSU
2,,SING,N1,C6,no,N,2,,22078,15081,PSU
3,,SING,N1,HN1,no,N,3,,22078,15081,PSU
4,,SING,C2,N3,no,N,4,,22078,15081,PSU
5,,DOUB,C2,O2,no,N,5,,22078,15081,PSU
6,,SING,N3,C4,no,N,6,,22078,15081,PSU
7,,SING,N3,HN3,no,N,7,,22078,15081,PSU
8,,SING,C4,C5,no,N,8,,22078,15081,PSU
9,,DOUB,C4,O4,no,N,9,,22078,15081,PSU
10,,DOUB,C5,C6,no,N,10,,22078,15081,PSU
11,,SING,C5,C1',no,N,11,,22078,15081,PSU
12,,SING,C6,H6,no,N,12,,22078,15081,PSU
13,,SING,C1',C2',no,N,13,,22078,15081,PSU
14,,SING,C1',O4',no,N,14,,22078,15081,PSU
15,,SING,C1',H1',no,N,15,,22078,15081,PSU
16,,SING,C2',O2',no,N,16,,22078,15081,PSU
17,,SING,C2',C3',no,N,17,,22078,15081,PSU
18,,SING,C2',H2',no,N,18,,22078,15081,PSU
19,,SING,O2',HO2',no,N,19,,22078,15081,PSU
20,,SING,C3',C4',no,N,20,,22078,15081,PSU
21,,SING,C3',O3',no,N,21,,22078,15081,PSU
22,,SING,C3',H3',no,N,22,,22078,15081,PSU
23,,SING,C4',O4',no,N,23,,22078,15081,PSU
24,,SING,C4',C5',no,N,24,,22078,15081,PSU
25,,SING,C4',H4',no,N,25,,22078,15081,PSU
26,,SING,O3',HO3',no,N,26,,22078,15081,PSU
27,,SING,C5',O5',no,N,27,,22078,15081,PSU
28,,SING,C5',H5',no,N,28,,22078,15081,PSU
29,,SING,C5',H5'',no,N,29,,22078,15081,PSU
30,,SING,O5',P,no,N,30,,22078,15081,PSU
31,,DOUB,P,OP1,no,N,31,,22078,15081,PSU
32,,SING,P,OP2,no,N,32,,22078,15081,PSU
33,,SING,P,OP3,no,N,33,,22078,15081,PSU
34,,SING,OP2,HOP2,no,N,34,,22078,15081,PSU
35,,SING,OP3,HOP3,no,N,35,,22078,15081,PSU
1,,DOUB,P,OP1,no,N,1,,22079,15081,OMG
2,,SING,P,OP2,no,N,2,,22079,15081,OMG
3,,SING,P,OP3,no,N,3,,22079,15081,OMG
4,,SING,P,O5',no,N,4,,22079,15081,OMG
5,,SING,OP2,HOP2,no,N,5,,22079,15081,OMG
6,,SING,OP3,HOP3,no,N,6,,22079,15081,OMG
7,,SING,O5',C5',no,N,7,,22079,15081,OMG
8,,SING,C5',C4',no,N,8,,22079,15081,OMG
9,,SING,C5',H5',no,N,9,,22079,15081,OMG
10,,SING,C5',H5'',no,N,10,,22079,15081,OMG
11,,SING,C4',O4',no,N,11,,22079,15081,OMG
12,,SING,C4',C3',no,N,12,,22079,15081,OMG
13,,SING,C4',H4',no,N,13,,22079,15081,OMG
14,,SING,O4',C1',no,N,14,,22079,15081,OMG
15,,SING,C3',O3',no,N,15,,22079,15081,OMG
16,,SING,C3',C2',no,N,16,,22079,15081,OMG
17,,SING,C3',H3',no,N,17,,22079,15081,OMG
18,,SING,O3',HO3',no,N,18,,22079,15081,OMG
19,,SING,C2',O2',no,N,19,,22079,15081,OMG
20,,SING,C2',C1',no,N,20,,22079,15081,OMG
21,,SING,C2',H2',no,N,21,,22079,15081,OMG
22,,SING,O2',CM2,no,N,22,,22079,15081,OMG
23,,SING,CM2,HM21,no,N,23,,22079,15081,OMG
24,,SING,CM2,HM22,no,N,24,,22079,15081,OMG
25,,SING,CM2,HM23,no,N,25,,22079,15081,OMG
26,,SING,C1',N9,no,N,26,,22079,15081,OMG
27,,SING,C1',H1',no,N,27,,22079,15081,OMG
28,,SING,N9,C8,yes,N,28,,22079,15081,OMG
29,,SING,N9,C4,yes,N,29,,22079,15081,OMG
30,,DOUB,C8,N7,yes,N,30,,22079,15081,OMG
31,,SING,C8,H8,no,N,31,,22079,15081,OMG
32,,SING,N7,C5,yes,N,32,,22079,15081,OMG
33,,SING,C5,C6,no,N,33,,22079,15081,OMG
34,,DOUB,C5,C4,yes,N,34,,22079,15081,OMG
35,,DOUB,C6,O6,no,N,35,,22079,15081,OMG
36,,SING,C6,N1,no,N,36,,22079,15081,OMG
37,,SING,N1,C2,no,N,37,,22079,15081,OMG
38,,SING,N1,HN1,no,N,38,,22079,15081,OMG
39,,SING,C2,N2,no,N,39,,22079,15081,OMG
40,,DOUB,C2,N3,no,N,40,,22079,15081,OMG
41,,SING,N2,HN21,no,N,41,,22079,15081,OMG
42,,SING,N2,HN22,no,N,42,,22079,15081,OMG
43,,SING,N3,C4,no,N,43,,22079,15081,OMG
1,,SING,C1,C2,no,N,1,,22140,15084,JN3
2,,SING,C1,C10,no,N,2,,22140,15084,JN3
3,,SING,C1,H11,no,N,3,,22140,15084,JN3
4,,SING,C1,H12,no,N,4,,22140,15084,JN3
5,,SING,C2,C3,no,N,5,,22140,15084,JN3
6,,SING,C2,H21,no,N,6,,22140,15084,JN3
7,,SING,C2,H22,no,N,7,,22140,15084,JN3
8,,SING,C3,O3,no,N,8,,22140,15084,JN3
9,,SING,C3,C4,no,N,9,,22140,15084,JN3
10,,SING,C3,H3,no,N,10,,22140,15084,JN3
11,,SING,O3,HO3,no,N,11,,22140,15084,JN3
12,,SING,C4,C5,no,N,12,,22140,15084,JN3
13,,SING,C4,H41,no,N,13,,22140,15084,JN3
14,,SING,C4,H42,no,N,14,,22140,15084,JN3
15,,SING,C5,C10,no,N,15,,22140,15084,JN3
16,,SING,C5,C6,no,N,16,,22140,15084,JN3
17,,SING,C5,H5,no,N,17,,22140,15084,JN3
18,,SING,C6,C7,no,N,18,,22140,15084,JN3
19,,SING,C6,H61,no,N,19,,22140,15084,JN3
20,,SING,C6,H62,no,N,20,,22140,15084,JN3
21,,SING,C7,C8,no,N,21,,22140,15084,JN3
22,,SING,C7,O7,no,N,22,,22140,15084,JN3
23,,SING,C7,H7,no,N,23,,22140,15084,JN3
24,,SING,O7,HO7,no,N,24,,22140,15084,JN3
25,,SING,C8,C9,no,N,25,,22140,15084,JN3
26,,SING,C8,C14,no,N,26,,22140,15084,JN3
27,,SING,C8,H8,no,N,27,,22140,15084,JN3
28,,SING,C9,C11,no,N,28,,22140,15084,JN3
29,,SING,C9,C10,no,N,29,,22140,15084,JN3
30,,SING,C9,H9,no,N,30,,22140,15084,JN3
31,,SING,C10,C19,no,N,31,,22140,15084,JN3
32,,SING,C11,C12,no,N,32,,22140,15084,JN3
33,,SING,C11,H111,no,N,33,,22140,15084,JN3
34,,SING,C11,H112,no,N,34,,22140,15084,JN3
35,,SING,C12,C13,no,N,35,,22140,15084,JN3
36,,SING,C12,H121,no,N,36,,22140,15084,JN3
37,,SING,C12,H122,no,N,37,,22140,15084,JN3
38,,SING,C13,C18,no,N,38,,22140,15084,JN3
39,,SING,C13,C17,no,N,39,,22140,15084,JN3
40,,SING,C13,C14,no,N,40,,22140,15084,JN3
41,,SING,C14,C15,no,N,41,,22140,15084,JN3
42,,SING,C14,H14,no,N,42,,22140,15084,JN3
43,,SING,C15,C16,no,N,43,,22140,15084,JN3
44,,SING,C15,H151,no,N,44,,22140,15084,JN3
45,,SING,C15,H152,no,N,45,,22140,15084,JN3
46,,SING,C16,C17,no,N,46,,22140,15084,JN3
47,,SING,C16,H161,no,N,47,,22140,15084,JN3
48,,SING,C16,H162,no,N,48,,22140,15084,JN3
49,,SING,C17,C20,no,N,49,,22140,15084,JN3
50,,SING,C17,H17,no,N,50,,22140,15084,JN3
51,,SING,C18,H181,no,N,51,,22140,15084,JN3
52,,SING,C18,H182,no,N,52,,22140,15084,JN3
53,,SING,C18,H183,no,N,53,,22140,15084,JN3
54,,SING,C19,H191,no,N,54,,22140,15084,JN3
55,,SING,C19,H192,no,N,55,,22140,15084,JN3
56,,SING,C19,H193,no,N,56,,22140,15084,JN3
57,,SING,C20,C21,no,N,57,,22140,15084,JN3
58,,SING,C20,C22,no,N,58,,22140,15084,JN3
59,,SING,C20,H20,no,N,59,,22140,15084,JN3
60,,SING,C21,H211,no,N,60,,22140,15084,JN3
61,,SING,C21,H212,no,N,61,,22140,15084,JN3
62,,SING,C21,H213,no,N,62,,22140,15084,JN3
63,,SING,C22,C23,no,N,63,,22140,15084,JN3
64,,SING,C22,H221,no,N,64,,22140,15084,JN3
65,,SING,C22,H222,no,N,65,,22140,15084,JN3
14,,SING,C7,H71,,,,,22798,15120,NGH
66,,SING,C23,C24,no,N,66,,22140,15084,JN3
67,,SING,C23,H231,no,N,67,,22140,15084,JN3
68,,SING,C23,H232,no,N,68,,22140,15084,JN3
69,,DOUB,O25,C24,no,N,69,,22140,15084,JN3
70,,SING,C24,O26,no,N,70,,22140,15084,JN3
71,,SING,O26,HO26,no,N,71,,22140,15084,JN3
1,,SING,,,,,1,,22362,15095,Synphilin
2,,DOUB,,,,,2,,22362,15095,Synphilin
1,,DOUB,C1,O1,no,N,1,,22704,15114,MYR
2,,SING,C1,O2,no,N,2,,22704,15114,MYR
3,,SING,C1,C2,no,N,3,,22704,15114,MYR
4,,SING,O2,HO2,no,N,4,,22704,15114,MYR
5,,SING,C2,C3,no,N,5,,22704,15114,MYR
6,,SING,C2,H21,no,N,6,,22704,15114,MYR
7,,SING,C2,H22,no,N,7,,22704,15114,MYR
8,,SING,C3,C4,no,N,8,,22704,15114,MYR
9,,SING,C3,H31,no,N,9,,22704,15114,MYR
10,,SING,C3,H32,no,N,10,,22704,15114,MYR
11,,SING,C4,C5,no,N,11,,22704,15114,MYR
12,,SING,C4,H41,no,N,12,,22704,15114,MYR
13,,SING,C4,H42,no,N,13,,22704,15114,MYR
14,,SING,C5,C6,no,N,14,,22704,15114,MYR
15,,SING,C5,H51,no,N,15,,22704,15114,MYR
16,,SING,C5,H52,no,N,16,,22704,15114,MYR
17,,SING,C6,C7,no,N,17,,22704,15114,MYR
18,,SING,C6,H61,no,N,18,,22704,15114,MYR
19,,SING,C6,H62,no,N,19,,22704,15114,MYR
20,,SING,C7,C8,no,N,20,,22704,15114,MYR
21,,SING,C7,H71,no,N,21,,22704,15114,MYR
22,,SING,C7,H72,no,N,22,,22704,15114,MYR
23,,SING,C8,C9,no,N,23,,22704,15114,MYR
24,,SING,C8,H81,no,N,24,,22704,15114,MYR
25,,SING,C8,H82,no,N,25,,22704,15114,MYR
26,,SING,C9,C10,no,N,26,,22704,15114,MYR
27,,SING,C9,H91,no,N,27,,22704,15114,MYR
28,,SING,C9,H92,no,N,28,,22704,15114,MYR
29,,SING,C10,C11,no,N,29,,22704,15114,MYR
30,,SING,C10,H101,no,N,30,,22704,15114,MYR
31,,SING,C10,H102,no,N,31,,22704,15114,MYR
32,,SING,C11,C12,no,N,32,,22704,15114,MYR
33,,SING,C11,H111,no,N,33,,22704,15114,MYR
34,,SING,C11,H112,no,N,34,,22704,15114,MYR
35,,SING,C12,C13,no,N,35,,22704,15114,MYR
36,,SING,C12,H121,no,N,36,,22704,15114,MYR
37,,SING,C12,H122,no,N,37,,22704,15114,MYR
38,,SING,C13,C14,no,N,38,,22704,15114,MYR
39,,SING,C13,H131,no,N,39,,22704,15114,MYR
40,,SING,C13,H132,no,N,40,,22704,15114,MYR
41,,SING,C14,H141,no,N,41,,22704,15114,MYR
42,,SING,C14,H142,no,N,42,,22704,15114,MYR
43,,SING,C14,H143,no,N,43,,22704,15114,MYR
1,,DOUB,C1,O1,no,N,1,,22741,15116,MYR
2,,SING,C1,O2,no,N,2,,22741,15116,MYR
3,,SING,C1,C2,no,N,3,,22741,15116,MYR
4,,SING,O2,HO2,no,N,4,,22741,15116,MYR
5,,SING,C2,C3,no,N,5,,22741,15116,MYR
6,,SING,C2,H21,no,N,6,,22741,15116,MYR
7,,SING,C2,H22,no,N,7,,22741,15116,MYR
8,,SING,C3,C4,no,N,8,,22741,15116,MYR
9,,SING,C3,H31,no,N,9,,22741,15116,MYR
10,,SING,C3,H32,no,N,10,,22741,15116,MYR
11,,SING,C4,C5,no,N,11,,22741,15116,MYR
12,,SING,C4,H41,no,N,12,,22741,15116,MYR
13,,SING,C4,H42,no,N,13,,22741,15116,MYR
14,,SING,C5,C6,no,N,14,,22741,15116,MYR
15,,SING,C5,H51,no,N,15,,22741,15116,MYR
16,,SING,C5,H52,no,N,16,,22741,15116,MYR
17,,SING,C6,C7,no,N,17,,22741,15116,MYR
18,,SING,C6,H61,no,N,18,,22741,15116,MYR
19,,SING,C6,H62,no,N,19,,22741,15116,MYR
20,,SING,C7,C8,no,N,20,,22741,15116,MYR
21,,SING,C7,H71,no,N,21,,22741,15116,MYR
22,,SING,C7,H72,no,N,22,,22741,15116,MYR
23,,SING,C8,C9,no,N,23,,22741,15116,MYR
24,,SING,C8,H81,no,N,24,,22741,15116,MYR
25,,SING,C8,H82,no,N,25,,22741,15116,MYR
26,,SING,C9,C10,no,N,26,,22741,15116,MYR
27,,SING,C9,H91,no,N,27,,22741,15116,MYR
28,,SING,C9,H92,no,N,28,,22741,15116,MYR
29,,SING,C10,C11,no,N,29,,22741,15116,MYR
30,,SING,C10,H101,no,N,30,,22741,15116,MYR
31,,SING,C10,H102,no,N,31,,22741,15116,MYR
32,,SING,C11,C12,no,N,32,,22741,15116,MYR
33,,SING,C11,H111,no,N,33,,22741,15116,MYR
34,,SING,C11,H112,no,N,34,,22741,15116,MYR
35,,SING,C12,C13,no,N,35,,22741,15116,MYR
36,,SING,C12,H121,no,N,36,,22741,15116,MYR
37,,SING,C12,H122,no,N,37,,22741,15116,MYR
38,,SING,C13,C14,no,N,38,,22741,15116,MYR
39,,SING,C13,H131,no,N,39,,22741,15116,MYR
40,,SING,C13,H132,no,N,40,,22741,15116,MYR
41,,SING,C14,H141,no,N,41,,22741,15116,MYR
42,,SING,C14,H142,no,N,42,,22741,15116,MYR
43,,SING,C14,H143,no,N,43,,22741,15116,MYR
1,,DOUB,C1,C2,,,,,22798,15120,NGH
2,,SING,C1,C6,,,,,22798,15120,NGH
3,,SING,C1,H1,,,,,22798,15120,NGH
4,,SING,C2,C3,,,,,22798,15120,NGH
5,,SING,C2,H2,,,,,22798,15120,NGH
6,,DOUB,C3,C4,,,,,22798,15120,NGH
7,,SING,C3,O1,,,,,22798,15120,NGH
8,,SING,C4,C5,,,,,22798,15120,NGH
9,,SING,C4,H4,,,,,22798,15120,NGH
10,,DOUB,C5,C6,,,,,22798,15120,NGH
11,,SING,C5,H5,,,,,22798,15120,NGH
12,,SING,C6,S1,,,,,22798,15120,NGH
15,,SING,C7,H72,,,,,22798,15120,NGH
16,,SING,C7,H73,,,,,22798,15120,NGH
17,,DOUB,S1,O2,,,,,22798,15120,NGH
18,,DOUB,S1,O3,,,,,22798,15120,NGH
19,,SING,S1,N,,,,,22798,15120,NGH
20,,SING,N,C9,,,,,22798,15120,NGH
21,,SING,N,C10,,,,,22798,15120,NGH
22,,SING,C9,C12,,,,,22798,15120,NGH
23,,SING,C9,H91,,,,,22798,15120,NGH
24,,SING,C9,H92,,,,,22798,15120,NGH
25,,SING,C10,C11,,,,,22798,15120,NGH
26,,SING,C10,H101,,,,,22798,15120,NGH
27,,SING,C10,H102,,,,,22798,15120,NGH
28,,SING,C11,N1,,,,,22798,15120,NGH
29,,DOUB,C11,O5,,,,,22798,15120,NGH
30,,SING,N1,O4,,,,,22798,15120,NGH
31,,SING,N1,HN1,,,,,22798,15120,NGH
32,,SING,O4,HO4,,,,,22798,15120,NGH
33,,SING,C12,C13,,,,,22798,15120,NGH
34,,SING,C12,C14,,,,,22798,15120,NGH
35,,SING,C12,H12,,,,,22798,15120,NGH
36,,SING,C13,H131,,,,,22798,15120,NGH
37,,SING,C13,H132,,,,,22798,15120,NGH
38,,SING,C13,H133,,,,,22798,15120,NGH
39,,SING,C14,H141,,,,,22798,15120,NGH
40,,SING,C14,H142,,,,,22798,15120,NGH
41,,SING,C14,H143,,,,,22798,15120,NGH
1,,SING,C,CA,no,N,1,,22838,15122,BFC
2,,DOUB,C,O,no,N,2,,22838,15122,BFC
3,,SING,C,H,no,N,3,,22838,15122,BFC
4,,SING,CA,CB,no,N,4,,22838,15122,BFC
5,,SING,CA,HA1,no,N,5,,22838,15122,BFC
6,,SING,CA,HA2,no,N,6,,22838,15122,BFC
7,,SING,CB,OB,no,N,7,,22838,15122,BFC
8,,SING,CB,CC,no,N,8,,22838,15122,BFC
9,,SING,CB,HB,no,N,9,,22838,15122,BFC
10,,SING,OB,HOB,no,N,10,,22838,15122,BFC
11,,SING,CC,CD,no,N,11,,22838,15122,BFC
12,,SING,CC,HC1,no,N,12,,22838,15122,BFC
13,,SING,CC,HC2,no,N,13,,22838,15122,BFC
14,,SING,CD,CE,no,N,14,,22838,15122,BFC
15,,SING,CD,HD1,no,N,15,,22838,15122,BFC
16,,SING,CD,HD2,no,N,16,,22838,15122,BFC
17,,SING,CE,CF,no,N,17,,22838,15122,BFC
18,,SING,CE,HE1,no,N,18,,22838,15122,BFC
19,,SING,CE,HE2,no,N,19,,22838,15122,BFC
20,,SING,CF,CG,no,N,20,,22838,15122,BFC
21,,SING,CF,HF1,no,N,21,,22838,15122,BFC
22,,SING,CF,HF2,no,N,22,,22838,15122,BFC
23,,SING,CG,CH,no,N,23,,22838,15122,BFC
24,,SING,CG,HG1,no,N,24,,22838,15122,BFC
25,,SING,CG,HG2,no,N,25,,22838,15122,BFC
26,,SING,CH,CI,no,N,26,,22838,15122,BFC
27,,SING,CH,HH1,no,N,27,,22838,15122,BFC
28,,SING,CH,HH2,no,N,28,,22838,15122,BFC
29,,SING,CI,CJ,no,N,29,,22838,15122,BFC
30,,SING,CI,HI1,no,N,30,,22838,15122,BFC
31,,SING,CI,HI2,no,N,31,,22838,15122,BFC
32,,SING,CJ,CK,no,N,32,,22838,15122,BFC
33,,SING,CJ,HJ1,no,N,33,,22838,15122,BFC
34,,SING,CJ,HJ2,no,N,34,,22838,15122,BFC
35,,SING,CK,CL,no,N,35,,22838,15122,BFC
36,,SING,CK,HK1,no,N,36,,22838,15122,BFC
37,,SING,CK,HK2,no,N,37,,22838,15122,BFC
38,,SING,CL,CM,no,N,38,,22838,15122,BFC
39,,SING,CL,HL1,no,N,39,,22838,15122,BFC
40,,SING,CL,HL2,no,N,40,,22838,15122,BFC
41,,SING,CM,HM1,no,N,41,,22838,15122,BFC
42,,SING,CM,HM2,no,N,42,,22838,15122,BFC
43,,SING,CM,HM3,no,N,43,,22838,15122,BFC
1,,SING,N,CA,no,N,1,,22839,15122,DLE
2,,SING,N,H,no,N,2,,22839,15122,DLE
3,,SING,N,H2,no,N,3,,22839,15122,DLE
4,,SING,CA,CB,no,N,4,,22839,15122,DLE
5,,SING,CA,C,no,N,5,,22839,15122,DLE
6,,SING,CA,HA,no,N,6,,22839,15122,DLE
7,,SING,CB,CG,no,N,7,,22839,15122,DLE
8,,SING,CB,HB2,no,N,8,,22839,15122,DLE
9,,SING,CB,HB3,no,N,9,,22839,15122,DLE
10,,SING,CG,CD1,no,N,10,,22839,15122,DLE
11,,SING,CG,CD2,no,N,11,,22839,15122,DLE
12,,SING,CG,HG,no,N,12,,22839,15122,DLE
13,,SING,CD1,HD11,no,N,13,,22839,15122,DLE
14,,SING,CD1,HD12,no,N,14,,22839,15122,DLE
15,,SING,CD1,HD13,no,N,15,,22839,15122,DLE
16,,SING,CD2,HD21,no,N,16,,22839,15122,DLE
17,,SING,CD2,HD22,no,N,17,,22839,15122,DLE
18,,SING,CD2,HD23,no,N,18,,22839,15122,DLE
19,,DOUB,C,O,no,N,19,,22839,15122,DLE
20,,SING,C,OXT,no,N,20,,22839,15122,DLE
21,,SING,OXT,HXT,no,N,21,,22839,15122,DLE
1,,SING,,,,,,,23235,15143,CHDA
1,,SING,N,CA,,,,,23297,15145,PCA
2,,SING,N,CD,,,,,23297,15145,PCA
3,,SING,N,HN,,,,,23297,15145,PCA
4,,SING,CA,CB,,,,,23297,15145,PCA
5,,SING,CA,C,,,,,23297,15145,PCA
6,,SING,CA,HA,,,,,23297,15145,PCA
7,,SING,CB,CG,,,,,23297,15145,PCA
8,,SING,CB,HB1,,,,,23297,15145,PCA
9,,SING,CB,HB2,,,,,23297,15145,PCA
10,,SING,CG,CD,,,,,23297,15145,PCA
11,,SING,CG,HG1,,,,,23297,15145,PCA
12,,SING,CG,HG2,,,,,23297,15145,PCA
13,,DOUB,CD,OE,,,,,23297,15145,PCA
14,,DOUB,C,O,,,,,23297,15145,PCA
15,,SING,C,OXT,,,,,23297,15145,PCA
16,,SING,OXT,HXT,,,,,23297,15145,PCA
1,,SING,N,CA,,,,,23519,15159,TPO
2,,SING,N,H,,,,,23519,15159,TPO
3,,SING,N,H2,,,,,23519,15159,TPO
4,,SING,CA,CB,,,,,23519,15159,TPO
5,,SING,CA,C,,,,,23519,15159,TPO
6,,SING,CA,HA,,,,,23519,15159,TPO
7,,SING,CB,CG2,,,,,23519,15159,TPO
8,,SING,CB,OG1,,,,,23519,15159,TPO
9,,SING,CB,HB,,,,,23519,15159,TPO
10,,SING,CG2,HG21,,,,,23519,15159,TPO
11,,SING,CG2,HG22,,,,,23519,15159,TPO
12,,SING,CG2,HG23,,,,,23519,15159,TPO
13,,SING,OG1,P,,,,,23519,15159,TPO
14,,DOUB,P,O1P,,,,,23519,15159,TPO
15,,SING,P,O2P,,,,,23519,15159,TPO
16,,SING,P,O3P,,,,,23519,15159,TPO
17,,SING,O2P,HOP2,,,,,23519,15159,TPO
18,,SING,O3P,HOP3,,,,,23519,15159,TPO
19,,DOUB,C,O,,,,,23519,15159,TPO
20,,SING,C,OXT,,,,,23519,15159,TPO
21,,SING,OXT,HXT,,,,,23519,15159,TPO
1,,SING,N,CA,,,,,23759,15170,SAH
2,,SING,N,HN1,,,,,23759,15170,SAH
3,,SING,N,HN2,,,,,23759,15170,SAH
4,,SING,CA,CB,,,,,23759,15170,SAH
5,,SING,CA,C,,,,,23759,15170,SAH
6,,SING,CA,HA,,,,,23759,15170,SAH
7,,SING,CB,CG,,,,,23759,15170,SAH
8,,SING,CB,HB1,,,,,23759,15170,SAH
9,,SING,CB,HB2,,,,,23759,15170,SAH
10,,SING,CG,SD,,,,,23759,15170,SAH
11,,SING,CG,HG1,,,,,23759,15170,SAH
12,,SING,CG,HG2,,,,,23759,15170,SAH
13,,SING,SD,C5',,,,,23759,15170,SAH
14,,DOUB,C,O,,,,,23759,15170,SAH
15,,SING,C,OXT,,,,,23759,15170,SAH
16,,SING,OXT,HXT,,,,,23759,15170,SAH
17,,SING,C5',C4',,,,,23759,15170,SAH
18,,SING,C5',H5'1,,,,,23759,15170,SAH
19,,SING,C5',H5'2,,,,,23759,15170,SAH
20,,SING,C4',O4',,,,,23759,15170,SAH
21,,SING,C4',C3',,,,,23759,15170,SAH
22,,SING,C4',H4',,,,,23759,15170,SAH
23,,SING,O4',C1',,,,,23759,15170,SAH
24,,SING,C3',O3',,,,,23759,15170,SAH
25,,SING,C3',C2',,,,,23759,15170,SAH
26,,SING,C3',H3',,,,,23759,15170,SAH
27,,SING,O3',HO3',,,,,23759,15170,SAH
28,,SING,C2',O2',,,,,23759,15170,SAH
29,,SING,C2',C1',,,,,23759,15170,SAH
30,,SING,C2',H2',,,,,23759,15170,SAH
31,,SING,O2',HO2',,,,,23759,15170,SAH
32,,SING,C1',N9,,,,,23759,15170,SAH
33,,SING,C1',H1',,,,,23759,15170,SAH
34,,SING,N9,C8,,,,,23759,15170,SAH
35,,SING,N9,C4,,,,,23759,15170,SAH
36,,DOUB,C8,N7,,,,,23759,15170,SAH
37,,SING,C8,H8,,,,,23759,15170,SAH
38,,SING,N7,C5,,,,,23759,15170,SAH
39,,SING,C5,C6,,,,,23759,15170,SAH
40,,DOUB,C5,C4,,,,,23759,15170,SAH
41,,SING,C6,N6,,,,,23759,15170,SAH
42,,DOUB,C6,N1,,,,,23759,15170,SAH
43,,SING,N6,HN61,,,,,23759,15170,SAH
44,,SING,N6,HN62,,,,,23759,15170,SAH
45,,SING,N1,C2,,,,,23759,15170,SAH
46,,DOUB,C2,N3,,,,,23759,15170,SAH
47,,SING,C2,H2,,,,,23759,15170,SAH
48,,SING,N3,C4,,,,,23759,15170,SAH
1,,SING,N,CA,,,,,23833,15174,HYP
2,,SING,N,CD,,,,,23833,15174,HYP
3,,SING,N,H,,,,,23833,15174,HYP
4,,SING,CA,C,,,,,23833,15174,HYP
5,,SING,CA,CB,,,,,23833,15174,HYP
6,,SING,CA,HA,,,,,23833,15174,HYP
7,,DOUB,C,O,,,,,23833,15174,HYP
8,,SING,C,OXT,,,,,23833,15174,HYP
9,,SING,CB,CG,,,,,23833,15174,HYP
10,,SING,CB,HB2,,,,,23833,15174,HYP
11,,SING,CB,HB3,,,,,23833,15174,HYP
12,,SING,CG,CD,,,,,23833,15174,HYP
13,,SING,CG,OD1,,,,,23833,15174,HYP
14,,SING,CG,HG,,,,,23833,15174,HYP
15,,SING,CD,HD22,,,,,23833,15174,HYP
16,,SING,CD,HD23,,,,,23833,15174,HYP
17,,SING,OD1,HD1,,,,,23833,15174,HYP
18,,SING,OXT,HXT,,,,,23833,15174,HYP
1,,SING,N,CA,,,,,23851,15175,HYP
2,,SING,N,CD,,,,,23851,15175,HYP
3,,SING,N,H,,,,,23851,15175,HYP
4,,SING,CA,C,,,,,23851,15175,HYP
5,,SING,CA,CB,,,,,23851,15175,HYP
6,,SING,CA,HA,,,,,23851,15175,HYP
7,,DOUB,C,O,,,,,23851,15175,HYP
8,,SING,C,OXT,,,,,23851,15175,HYP
9,,SING,CB,CG,,,,,23851,15175,HYP
10,,SING,CB,HB2,,,,,23851,15175,HYP
11,,SING,CB,HB3,,,,,23851,15175,HYP
12,,SING,CG,CD,,,,,23851,15175,HYP
13,,SING,CG,OD1,,,,,23851,15175,HYP
14,,SING,CG,HG,,,,,23851,15175,HYP
15,,SING,CD,HD22,,,,,23851,15175,HYP
16,,SING,CD,HD23,,,,,23851,15175,HYP
17,,SING,OD1,HD1,,,,,23851,15175,HYP
18,,SING,OXT,HXT,,,,,23851,15175,HYP
1,,DOUB,O,C,no,N,1,,23934,1518,LPD
2,,SING,C,N2,no,N,2,,23934,1518,LPD
3,,SING,C,CA,no,N,3,,23934,1518,LPD
4,,SING,N2,HN21,no,N,4,,23934,1518,LPD
5,,SING,N2,HN22,no,N,5,,23934,1518,LPD
6,,SING,CA,N,no,N,6,,23934,1518,LPD
7,,SING,CA,CB,no,N,7,,23934,1518,LPD
8,,SING,CA,HA,no,N,8,,23934,1518,LPD
9,,SING,N,CD,no,N,9,,23934,1518,LPD
10,,SING,N,H,no,N,10,,23934,1518,LPD
11,,SING,CD,CG,no,N,11,,23934,1518,LPD
12,,SING,CD,HD3,no,N,12,,23934,1518,LPD
13,,SING,CD,HD2,no,N,13,,23934,1518,LPD
14,,SING,CG,CB,no,N,14,,23934,1518,LPD
15,,SING,CG,HG3,no,N,15,,23934,1518,LPD
16,,SING,CG,HG2,no,N,16,,23934,1518,LPD
17,,SING,CB,HB2,no,N,17,,23934,1518,LPD
18,,SING,CB,HB3,no,N,18,,23934,1518,LPD
1,,DOUB,O,C,no,N,1,,24106,1519,LPD
2,,SING,C,N2,no,N,2,,24106,1519,LPD
3,,SING,C,CA,no,N,3,,24106,1519,LPD
4,,SING,N2,HN21,no,N,4,,24106,1519,LPD
5,,SING,N2,HN22,no,N,5,,24106,1519,LPD
6,,SING,CA,N,no,N,6,,24106,1519,LPD
7,,SING,CA,CB,no,N,7,,24106,1519,LPD
8,,SING,CA,HA,no,N,8,,24106,1519,LPD
9,,SING,N,CD,no,N,9,,24106,1519,LPD
10,,SING,N,H,no,N,10,,24106,1519,LPD
11,,SING,CD,CG,no,N,11,,24106,1519,LPD
12,,SING,CD,HD3,no,N,12,,24106,1519,LPD
13,,SING,CD,HD2,no,N,13,,24106,1519,LPD
14,,SING,CG,CB,no,N,14,,24106,1519,LPD
15,,SING,CG,HG3,no,N,15,,24106,1519,LPD
16,,SING,CG,HG2,no,N,16,,24106,1519,LPD
17,,SING,CB,HB2,no,N,17,,24106,1519,LPD
18,,SING,CB,HB3,no,N,18,,24106,1519,LPD
1,,DOUB,PG,O1G,,,,,24338,15202,GNP
2,,SING,PG,O2G,,,,,24338,15202,GNP
3,,SING,PG,O3G,,,,,24338,15202,GNP
4,,SING,PG,N3B,,,,,24338,15202,GNP
5,,SING,O2G,HOG2,,,,,24338,15202,GNP
6,,SING,O3G,HOG3,,,,,24338,15202,GNP
7,,SING,N3B,PB,,,,,24338,15202,GNP
8,,SING,N3B,HNB3,,,,,24338,15202,GNP
9,,DOUB,PB,O1B,,,,,24338,15202,GNP
10,,SING,PB,O2B,,,,,24338,15202,GNP
11,,SING,PB,O3A,,,,,24338,15202,GNP
12,,SING,O2B,HOB2,,,,,24338,15202,GNP
13,,SING,O3A,PA,,,,,24338,15202,GNP
14,,DOUB,PA,O1A,,,,,24338,15202,GNP
15,,SING,PA,O2A,,,,,24338,15202,GNP
16,,SING,PA,O5',,,,,24338,15202,GNP
17,,SING,O2A,HOA2,,,,,24338,15202,GNP
18,,SING,O5',C5',,,,,24338,15202,GNP
19,,SING,C5',C4',,,,,24338,15202,GNP
20,,SING,C5',H5'2,,,,,24338,15202,GNP
21,,SING,C5',H5'1,,,,,24338,15202,GNP
22,,SING,C4',O4',,,,,24338,15202,GNP
23,,SING,C4',C3',,,,,24338,15202,GNP
24,,SING,C4',H4',,,,,24338,15202,GNP
25,,SING,O4',C1',,,,,24338,15202,GNP
26,,SING,C3',O3',,,,,24338,15202,GNP
27,,SING,C3',C2',,,,,24338,15202,GNP
28,,SING,C3',H3',,,,,24338,15202,GNP
29,,SING,O3',HO3',,,,,24338,15202,GNP
30,,SING,C2',O2',,,,,24338,15202,GNP
31,,SING,C2',C1',,,,,24338,15202,GNP
32,,SING,C2',H2',,,,,24338,15202,GNP
33,,SING,O2',HO2',,,,,24338,15202,GNP
34,,SING,C1',N9,,,,,24338,15202,GNP
35,,SING,C1',H1',,,,,24338,15202,GNP
36,,SING,N9,C8,,,,,24338,15202,GNP
37,,SING,N9,C4,,,,,24338,15202,GNP
38,,DOUB,C8,N7,,,,,24338,15202,GNP
39,,SING,C8,H8,,,,,24338,15202,GNP
40,,SING,N7,C5,,,,,24338,15202,GNP
41,,SING,C5,C6,,,,,24338,15202,GNP
42,,DOUB,C5,C4,,,,,24338,15202,GNP
43,,DOUB,C6,O6,,,,,24338,15202,GNP
44,,SING,C6,N1,,,,,24338,15202,GNP
45,,SING,N1,C2,,,,,24338,15202,GNP
46,,SING,N1,HN1,,,,,24338,15202,GNP
47,,SING,C2,N2,,,,,24338,15202,GNP
48,,DOUB,C2,N3,,,,,24338,15202,GNP
49,,SING,N2,HN21,,,,,24338,15202,GNP
50,,SING,N2,HN22,,,,,24338,15202,GNP
51,,SING,N3,C4,,,,,24338,15202,GNP
1,,SING,C1,C2,,,,,24655,15219,REA
2,,SING,C1,C6,,,,,24655,15219,REA
3,,SING,C1,C16,,,,,24655,15219,REA
4,,SING,C1,C17,,,,,24655,15219,REA
5,,SING,C2,C3,,,,,24655,15219,REA
6,,SING,C2,H21,,,,,24655,15219,REA
7,,SING,C2,H22,,,,,24655,15219,REA
8,,SING,C3,C4,,,,,24655,15219,REA
9,,SING,C3,H31,,,,,24655,15219,REA
10,,SING,C3,H32,,,,,24655,15219,REA
11,,SING,C4,C5,,,,,24655,15219,REA
12,,SING,C4,H41,,,,,24655,15219,REA
13,,SING,C4,H42,,,,,24655,15219,REA
14,,DOUB,C5,C6,,,,,24655,15219,REA
15,,SING,C5,C18,,,,,24655,15219,REA
16,,SING,C6,C7,,,,,24655,15219,REA
17,,DOUB,C7,C8,,,,,24655,15219,REA
18,,SING,C7,H7,,,,,24655,15219,REA
19,,SING,C8,C9,,,,,24655,15219,REA
20,,SING,C8,H8,,,,,24655,15219,REA
21,,DOUB,C9,C10,,,,,24655,15219,REA
22,,SING,C9,C19,,,,,24655,15219,REA
23,,SING,C10,C11,,,,,24655,15219,REA
24,,SING,C10,H10,,,,,24655,15219,REA
25,,DOUB,C11,C12,,,,,24655,15219,REA
26,,SING,C11,H11,,,,,24655,15219,REA
27,,SING,C12,C13,,,,,24655,15219,REA
28,,SING,C12,H12,,,,,24655,15219,REA
29,,DOUB,C13,C14,,,,,24655,15219,REA
30,,SING,C13,C20,,,,,24655,15219,REA
31,,SING,C14,C15,,,,,24655,15219,REA
32,,SING,C14,H14,,,,,24655,15219,REA
33,,DOUB,C15,O1,,,,,24655,15219,REA
34,,SING,C15,O2,,,,,24655,15219,REA
35,,SING,C16,H161,,,,,24655,15219,REA
36,,SING,C16,H162,,,,,24655,15219,REA
37,,SING,C16,H163,,,,,24655,15219,REA
38,,SING,C17,H171,,,,,24655,15219,REA
39,,SING,C17,H172,,,,,24655,15219,REA
40,,SING,C17,H173,,,,,24655,15219,REA
41,,SING,C18,H181,,,,,24655,15219,REA
42,,SING,C18,H182,,,,,24655,15219,REA
43,,SING,C18,H183,,,,,24655,15219,REA
44,,SING,C19,H191,,,,,24655,15219,REA
45,,SING,C19,H192,,,,,24655,15219,REA
46,,SING,C19,H193,,,,,24655,15219,REA
47,,SING,C20,H201,,,,,24655,15219,REA
48,,SING,C20,H202,,,,,24655,15219,REA
49,,SING,C20,H203,,,,,24655,15219,REA
50,,SING,O2,HO2,,,,,24655,15219,REA
1,,SING,C1,O1,no,N,1,,24708,15223,ORP
2,,SING,C1,C2,no,N,2,,24708,15223,ORP
3,,SING,C1,O4,no,N,3,,24708,15223,ORP
4,,SING,C1,H1,no,N,4,,24708,15223,ORP
5,,SING,O1,HO1,no,N,5,,24708,15223,ORP
6,,SING,C2,C3,no,N,6,,24708,15223,ORP
7,,SING,C2,H21,no,N,7,,24708,15223,ORP
8,,SING,C2,H22,no,N,8,,24708,15223,ORP
9,,SING,C3,O3,no,N,9,,24708,15223,ORP
10,,SING,C3,C4,no,N,10,,24708,15223,ORP
11,,SING,C3,H3,no,N,11,,24708,15223,ORP
12,,SING,O3,HO3,no,N,12,,24708,15223,ORP
13,,SING,C4,O4,no,N,13,,24708,15223,ORP
14,,SING,C4,C5,no,N,14,,24708,15223,ORP
15,,SING,C4,H4,no,N,15,,24708,15223,ORP
16,,SING,C5,O5,no,N,16,,24708,15223,ORP
17,,SING,C5,H51,no,N,17,,24708,15223,ORP
18,,SING,C5,H52,no,N,18,,24708,15223,ORP
19,,SING,O5,P,no,N,19,,24708,15223,ORP
20,,DOUB,P,O1P,no,N,20,,24708,15223,ORP
21,,SING,P,O2P,no,N,21,,24708,15223,ORP
22,,SING,P,O3P,no,N,22,,24708,15223,ORP
23,,SING,O2P,HOP2,no,N,23,,24708,15223,ORP
24,,SING,O3P,HOP3,no,N,24,,24708,15223,ORP
1,,SING,C1,O1,no,N,1,,24725,15224,ORP
2,,SING,C1,C2,no,N,2,,24725,15224,ORP
3,,SING,C1,O4,no,N,3,,24725,15224,ORP
4,,SING,C1,H1,no,N,4,,24725,15224,ORP
5,,SING,O1,HO1,no,N,5,,24725,15224,ORP
6,,SING,C2,C3,no,N,6,,24725,15224,ORP
7,,SING,C2,H21,no,N,7,,24725,15224,ORP
8,,SING,C2,H22,no,N,8,,24725,15224,ORP
9,,SING,C3,O3,no,N,9,,24725,15224,ORP
10,,SING,C3,C4,no,N,10,,24725,15224,ORP
11,,SING,C3,H3,no,N,11,,24725,15224,ORP
12,,SING,O3,HO3,no,N,12,,24725,15224,ORP
13,,SING,C4,O4,no,N,13,,24725,15224,ORP
14,,SING,C4,C5,no,N,14,,24725,15224,ORP
15,,SING,C4,H4,no,N,15,,24725,15224,ORP
16,,SING,C5,O5,no,N,16,,24725,15224,ORP
17,,SING,C5,H51,no,N,17,,24725,15224,ORP
18,,SING,C5,H52,no,N,18,,24725,15224,ORP
19,,SING,O5,P,no,N,19,,24725,15224,ORP
20,,DOUB,P,O1P,no,N,20,,24725,15224,ORP
21,,SING,P,O2P,no,N,21,,24725,15224,ORP
22,,SING,P,O3P,no,N,22,,24725,15224,ORP
23,,SING,O2P,HOP2,no,N,23,,24725,15224,ORP
24,,SING,O3P,HOP3,no,N,24,,24725,15224,ORP
1,,SING,C1,O1,,,,,24775,15227,ORP
2,,SING,C1,C2,,,,,24775,15227,ORP
3,,SING,C1,O4,,,,,24775,15227,ORP
4,,SING,C1,H1,,,,,24775,15227,ORP
5,,SING,O1,HO1,,,,,24775,15227,ORP
6,,SING,C2,C3,,,,,24775,15227,ORP
7,,SING,C2,H21,,,,,24775,15227,ORP
8,,SING,C2,H22,,,,,24775,15227,ORP
9,,SING,C3,O3,,,,,24775,15227,ORP
10,,SING,C3,C4,,,,,24775,15227,ORP
11,,SING,C3,H3,,,,,24775,15227,ORP
12,,SING,O3,HO3,,,,,24775,15227,ORP
13,,SING,C4,O4,,,,,24775,15227,ORP
14,,SING,C4,C5,,,,,24775,15227,ORP
15,,SING,C4,H4,,,,,24775,15227,ORP
16,,SING,C5,O5,,,,,24775,15227,ORP
17,,SING,C5,H51,,,,,24775,15227,ORP
18,,SING,C5,H52,,,,,24775,15227,ORP
19,,SING,O5,P,,,,,24775,15227,ORP
20,,DOUB,P,O1P,,,,,24775,15227,ORP
21,,SING,P,O2P,,,,,24775,15227,ORP
22,,SING,P,O3P,,,,,24775,15227,ORP
23,,SING,O2P,HOP2,,,,,24775,15227,ORP
24,,SING,O3P,HOP3,,,,,24775,15227,ORP
1,,DOUB,PG,O1G,,,,,24831,15230,GNP
2,,SING,PG,O2G,,,,,24831,15230,GNP
3,,SING,PG,O3G,,,,,24831,15230,GNP
4,,SING,PG,N3B,,,,,24831,15230,GNP
5,,SING,O2G,HOG2,,,,,24831,15230,GNP
6,,SING,O3G,HOG3,,,,,24831,15230,GNP
7,,SING,N3B,PB,,,,,24831,15230,GNP
8,,SING,N3B,HNB3,,,,,24831,15230,GNP
9,,DOUB,PB,O1B,,,,,24831,15230,GNP
10,,SING,PB,O2B,,,,,24831,15230,GNP
11,,SING,PB,O3A,,,,,24831,15230,GNP
12,,SING,O2B,HOB2,,,,,24831,15230,GNP
13,,SING,O3A,PA,,,,,24831,15230,GNP
14,,DOUB,PA,O1A,,,,,24831,15230,GNP
15,,SING,PA,O2A,,,,,24831,15230,GNP
16,,SING,PA,O5',,,,,24831,15230,GNP
17,,SING,O2A,HOA2,,,,,24831,15230,GNP
18,,SING,O5',C5',,,,,24831,15230,GNP
19,,SING,C5',C4',,,,,24831,15230,GNP
20,,SING,C5',H5'2,,,,,24831,15230,GNP
21,,SING,C5',H5'1,,,,,24831,15230,GNP
22,,SING,C4',O4',,,,,24831,15230,GNP
23,,SING,C4',C3',,,,,24831,15230,GNP
24,,SING,C4',H4',,,,,24831,15230,GNP
25,,SING,O4',C1',,,,,24831,15230,GNP
26,,SING,C3',O3',,,,,24831,15230,GNP
27,,SING,C3',C2',,,,,24831,15230,GNP
28,,SING,C3',H3',,,,,24831,15230,GNP
29,,SING,O3',HO3',,,,,24831,15230,GNP
30,,SING,C2',O2',,,,,24831,15230,GNP
31,,SING,C2',C1',,,,,24831,15230,GNP
32,,SING,C2',H2',,,,,24831,15230,GNP
33,,SING,O2',HO2',,,,,24831,15230,GNP
34,,SING,C1',N9,,,,,24831,15230,GNP
35,,SING,C1',H1',,,,,24831,15230,GNP
36,,SING,N9,C8,,,,,24831,15230,GNP
37,,SING,N9,C4,,,,,24831,15230,GNP
38,,DOUB,C8,N7,,,,,24831,15230,GNP
39,,SING,C8,H8,,,,,24831,15230,GNP
40,,SING,N7,C5,,,,,24831,15230,GNP
41,,SING,C5,C6,,,,,24831,15230,GNP
42,,DOUB,C5,C4,,,,,24831,15230,GNP
43,,DOUB,C6,O6,,,,,24831,15230,GNP
44,,SING,C6,N1,,,,,24831,15230,GNP
45,,SING,N1,C2,,,,,24831,15230,GNP
46,,SING,N1,HN1,,,,,24831,15230,GNP
47,,SING,C2,N2,,,,,24831,15230,GNP
48,,DOUB,C2,N3,,,,,24831,15230,GNP
49,,SING,N2,HN21,,,,,24831,15230,GNP
50,,SING,N2,HN22,,,,,24831,15230,GNP
51,,SING,N3,C4,,,,,24831,15230,GNP
1,,SING,O,H1,no,N,1,,24833,15230,HOH
2,,SING,O,H2,no,N,2,,24833,15230,HOH
1,,SING,C1,O1,no,N,1,,24972,15238,ORP
2,,SING,C1,C2,no,N,2,,24972,15238,ORP
3,,SING,C1,O4,no,N,3,,24972,15238,ORP
4,,SING,C1,H1,no,N,4,,24972,15238,ORP
5,,SING,O1,HO1,no,N,5,,24972,15238,ORP
6,,SING,C2,C3,no,N,6,,24972,15238,ORP
7,,SING,C2,H21,no,N,7,,24972,15238,ORP
8,,SING,C2,H22,no,N,8,,24972,15238,ORP
9,,SING,C3,O3,no,N,9,,24972,15238,ORP
10,,SING,C3,C4,no,N,10,,24972,15238,ORP
11,,SING,C3,H3,no,N,11,,24972,15238,ORP
12,,SING,O3,HO3,no,N,12,,24972,15238,ORP
13,,SING,C4,O4,no,N,13,,24972,15238,ORP
14,,SING,C4,C5,no,N,14,,24972,15238,ORP
15,,SING,C4,H4,no,N,15,,24972,15238,ORP
16,,SING,C5,O5,no,N,16,,24972,15238,ORP
17,,SING,C5,H51,no,N,17,,24972,15238,ORP
18,,SING,C5,H52,no,N,18,,24972,15238,ORP
19,,SING,O5,P,no,N,19,,24972,15238,ORP
20,,DOUB,P,O1P,no,N,20,,24972,15238,ORP
21,,SING,P,O2P,no,N,21,,24972,15238,ORP
22,,SING,P,O3P,no,N,22,,24972,15238,ORP
23,,SING,O2P,HOP2,no,N,23,,24972,15238,ORP
24,,SING,O3P,HOP3,no,N,24,,24972,15238,ORP
1,,SING,N,CA,no,N,1,,25028,15241,PCA
2,,SING,N,CD,no,N,2,,25028,15241,PCA
3,,SING,N,H,no,N,3,,25028,15241,PCA
4,,SING,CA,CB,no,N,4,,25028,15241,PCA
5,,SING,CA,C,no,N,5,,25028,15241,PCA
6,,SING,CA,HA,no,N,6,,25028,15241,PCA
7,,SING,CB,CG,no,N,7,,25028,15241,PCA
8,,SING,CB,HB2,no,N,8,,25028,15241,PCA
9,,SING,CB,HB3,no,N,9,,25028,15241,PCA
10,,SING,CG,CD,no,N,10,,25028,15241,PCA
11,,SING,CG,HG2,no,N,11,,25028,15241,PCA
12,,SING,CG,HG3,no,N,12,,25028,15241,PCA
13,,DOUB,CD,OE,no,N,13,,25028,15241,PCA
14,,DOUB,C,O,no,N,14,,25028,15241,PCA
15,,SING,C,OXT,no,N,15,,25028,15241,PCA
16,,SING,OXT,HXT,no,N,16,,25028,15241,PCA
1,,SING,N,CA,no,N,1,,25029,15241,NLE
2,,SING,N,H,no,N,2,,25029,15241,NLE
3,,SING,N,HN2,no,N,3,,25029,15241,NLE
4,,SING,CA,C,no,N,4,,25029,15241,NLE
5,,SING,CA,CB,no,N,5,,25029,15241,NLE
6,,SING,CA,HA,no,N,6,,25029,15241,NLE
7,,DOUB,C,O,no,N,7,,25029,15241,NLE
8,,SING,C,OXT,no,N,8,,25029,15241,NLE
9,,SING,OXT,HXT,no,N,9,,25029,15241,NLE
10,,SING,CB,CG,no,N,10,,25029,15241,NLE
11,,SING,CB,HB2,no,N,11,,25029,15241,NLE
12,,SING,CB,HB3,no,N,12,,25029,15241,NLE
13,,SING,CG,CD,no,N,13,,25029,15241,NLE
14,,SING,CG,HG2,no,N,14,,25029,15241,NLE
15,,SING,CG,HG3,no,N,15,,25029,15241,NLE
16,,SING,CD,CE,no,N,16,,25029,15241,NLE
17,,SING,CD,HD2,no,N,17,,25029,15241,NLE
18,,SING,CD,HD3,no,N,18,,25029,15241,NLE
19,,SING,CE,HE1,no,N,19,,25029,15241,NLE
20,,SING,CE,HE2,no,N,20,,25029,15241,NLE
21,,SING,CE,HE3,no,N,21,,25029,15241,NLE
1,,SING,N,HN1,no,N,1,,25030,15241,NH2
2,,SING,N,HN2,no,N,2,,25030,15241,NH2
1,,DOUB,P,O1P,,,,,25160,15249,CMP
2,,SING,P,O2P,,,,,25160,15249,CMP
3,,SING,P,O5',,,,,25160,15249,CMP
4,,SING,P,O3',,,,,25160,15249,CMP
5,,SING,O2P,HOP2,,,,,25160,15249,CMP
6,,SING,O5',C5',,,,,25160,15249,CMP
7,,SING,C5',C4',,,,,25160,15249,CMP
8,,SING,C5',H5'1,,,,,25160,15249,CMP
9,,SING,C5',H5'2,,,,,25160,15249,CMP
10,,SING,C4',O4',,,,,25160,15249,CMP
11,,SING,C4',C3',,,,,25160,15249,CMP
12,,SING,C4',H4',,,,,25160,15249,CMP
13,,SING,O4',C1',,,,,25160,15249,CMP
14,,SING,C3',O3',,,,,25160,15249,CMP
15,,SING,C3',C2',,,,,25160,15249,CMP
16,,SING,C3',H3',,,,,25160,15249,CMP
17,,SING,C2',O2',,,,,25160,15249,CMP
18,,SING,C2',C1',,,,,25160,15249,CMP
19,,SING,C2',H2',,,,,25160,15249,CMP
20,,SING,O2',HO2',,,,,25160,15249,CMP
21,,SING,C1',N9,,,,,25160,15249,CMP
22,,SING,C1',H1',,,,,25160,15249,CMP
23,,SING,N9,C8,,,,,25160,15249,CMP
24,,SING,N9,C4,,,,,25160,15249,CMP
25,,DOUB,C8,N7,,,,,25160,15249,CMP
26,,SING,C8,H8,,,,,25160,15249,CMP
27,,SING,N7,C5,,,,,25160,15249,CMP
28,,SING,C5,C6,,,,,25160,15249,CMP
29,,DOUB,C5,C4,,,,,25160,15249,CMP
30,,SING,C6,N6,,,,,25160,15249,CMP
31,,DOUB,C6,N1,,,,,25160,15249,CMP
32,,SING,N6,HN61,,,,,25160,15249,CMP
33,,SING,N6,HN62,,,,,25160,15249,CMP
34,,SING,N1,C2,,,,,25160,15249,CMP
35,,DOUB,C2,N3,,,,,25160,15249,CMP
36,,SING,C2,H2,,,,,25160,15249,CMP
37,,SING,N3,C4,,,,,25160,15249,CMP
1,,SING,N1,C2,,,,,25213,15253,FOL
2,,SING,N1,C8A,,,,,25213,15253,FOL
3,,SING,N1,HN1,,,,,25213,15253,FOL
4,,SING,C2,NA2,,,,,25213,15253,FOL
5,,DOUB,C2,N3,,,,,25213,15253,FOL
6,,SING,NA2,HN21,,,,,25213,15253,FOL
7,,SING,NA2,HN22,,,,,25213,15253,FOL
8,,SING,N3,C4,,,,,25213,15253,FOL
9,,DOUB,C4,O4,,,,,25213,15253,FOL
10,,SING,C4,C4A,,,,,25213,15253,FOL
11,,SING,C4A,N5,,,,,25213,15253,FOL
12,,DOUB,C4A,C8A,,,,,25213,15253,FOL
13,,DOUB,N5,C6,,,,,25213,15253,FOL
14,,SING,C6,C7,,,,,25213,15253,FOL
15,,SING,C6,C9,,,,,25213,15253,FOL
16,,DOUB,C7,N8,,,,,25213,15253,FOL
17,,SING,C7,H7,,,,,25213,15253,FOL
18,,SING,N8,C8A,,,,,25213,15253,FOL
19,,SING,C9,N10,,,,,25213,15253,FOL
20,,SING,C9,H91,,,,,25213,15253,FOL
21,,SING,C9,H92,,,,,25213,15253,FOL
22,,SING,N10,C14,,,,,25213,15253,FOL
23,,SING,N10,HN0,,,,,25213,15253,FOL
24,,DOUB,C11,C12,,,,,25213,15253,FOL
25,,SING,C11,C16,,,,,25213,15253,FOL
26,,SING,C11,C,,,,,25213,15253,FOL
27,,SING,C12,C13,,,,,25213,15253,FOL
28,,SING,C12,H12,,,,,25213,15253,FOL
29,,DOUB,C13,C14,,,,,25213,15253,FOL
30,,SING,C13,H13,,,,,25213,15253,FOL
31,,SING,C14,C15,,,,,25213,15253,FOL
32,,DOUB,C15,C16,,,,,25213,15253,FOL
33,,SING,C15,H15,,,,,25213,15253,FOL
34,,SING,C16,H16,,,,,25213,15253,FOL
35,,DOUB,C,O,,,,,25213,15253,FOL
36,,SING,C,N,,,,,25213,15253,FOL
37,,SING,N,CA,,,,,25213,15253,FOL
38,,SING,N,HN,,,,,25213,15253,FOL
39,,SING,CA,CB,,,,,25213,15253,FOL
40,,SING,CA,CT,,,,,25213,15253,FOL
41,,SING,CA,HA,,,,,25213,15253,FOL
42,,SING,CB,CG,,,,,25213,15253,FOL
43,,SING,CB,HB1,,,,,25213,15253,FOL
44,,SING,CB,HB2,,,,,25213,15253,FOL
45,,SING,CG,CD,,,,,25213,15253,FOL
46,,SING,CG,HG1,,,,,25213,15253,FOL
47,,SING,CG,HG2,,,,,25213,15253,FOL
48,,DOUB,CD,OE1,,,,,25213,15253,FOL
49,,SING,CD,OE2,,,,,25213,15253,FOL
50,,SING,OE2,HOE2,,,,,25213,15253,FOL
51,,DOUB,CT,O1,,,,,25213,15253,FOL
52,,SING,CT,O2,,,,,25213,15253,FOL
53,,SING,O2,HO2,,,,,25213,15253,FOL
1,,SING,N,CA,no,N,1,,25591,15272,HYP
2,,SING,N,CD,no,N,2,,25591,15272,HYP
3,,SING,N,H,no,N,3,,25591,15272,HYP
4,,SING,CA,C,no,N,4,,25591,15272,HYP
5,,SING,CA,CB,no,N,5,,25591,15272,HYP
6,,SING,CA,HA,no,N,6,,25591,15272,HYP
7,,DOUB,C,O,no,N,7,,25591,15272,HYP
8,,SING,C,OXT,no,N,8,,25591,15272,HYP
9,,SING,CB,CG,no,N,9,,25591,15272,HYP
10,,SING,CB,HB2,no,N,10,,25591,15272,HYP
11,,SING,CB,HB3,no,N,11,,25591,15272,HYP
12,,SING,CG,CD,no,N,12,,25591,15272,HYP
13,,SING,CG,OD1,no,N,13,,25591,15272,HYP
14,,SING,CG,HG,no,N,14,,25591,15272,HYP
15,,SING,CD,HD22,no,N,15,,25591,15272,HYP
16,,SING,CD,HD23,no,N,16,,25591,15272,HYP
17,,SING,OD1,HD1,no,N,17,,25591,15272,HYP
18,,SING,OXT,HXT,no,N,18,,25591,15272,HYP
1,,SING,N,CA,no,N,1,,25592,15272,DPN
2,,SING,N,H,no,N,2,,25592,15272,DPN
3,,SING,N,H2,no,N,3,,25592,15272,DPN
4,,SING,CA,C,no,N,4,,25592,15272,DPN
5,,SING,CA,CB,no,N,5,,25592,15272,DPN
6,,SING,CA,HA,no,N,6,,25592,15272,DPN
7,,DOUB,C,O,no,N,7,,25592,15272,DPN
8,,SING,C,OXT,no,N,8,,25592,15272,DPN
9,,SING,OXT,HXT,no,N,9,,25592,15272,DPN
10,,SING,CB,CG,no,N,10,,25592,15272,DPN
11,,SING,CB,HB2,no,N,11,,25592,15272,DPN
12,,SING,CB,HB3,no,N,12,,25592,15272,DPN
13,,DOUB,CG,CD1,yes,N,13,,25592,15272,DPN
14,,SING,CG,CD2,yes,N,14,,25592,15272,DPN
15,,SING,CD1,CE1,yes,N,15,,25592,15272,DPN
16,,SING,CD1,HD1,no,N,16,,25592,15272,DPN
17,,DOUB,CD2,CE2,yes,N,17,,25592,15272,DPN
18,,SING,CD2,HD2,no,N,18,,25592,15272,DPN
19,,DOUB,CE1,CZ,yes,N,19,,25592,15272,DPN
20,,SING,CE1,HE1,no,N,20,,25592,15272,DPN
21,,SING,CE2,CZ,yes,N,21,,25592,15272,DPN
22,,SING,CE2,HE2,no,N,22,,25592,15272,DPN
23,,SING,CZ,HZ,no,N,23,,25592,15272,DPN
1,,SING,N,CA,,,,,25612,15273,HYP
2,,SING,N,CD,,,,,25612,15273,HYP
3,,SING,N,H,,,,,25612,15273,HYP
4,,SING,CA,C,,,,,25612,15273,HYP
5,,SING,CA,CB,,,,,25612,15273,HYP
6,,SING,CA,HA,,,,,25612,15273,HYP
7,,DOUB,C,O,,,,,25612,15273,HYP
8,,SING,C,OXT,,,,,25612,15273,HYP
9,,SING,CB,CG,,,,,25612,15273,HYP
10,,SING,CB,HB1,,,,,25612,15273,HYP
11,,SING,CB,HB2,,,,,25612,15273,HYP
12,,SING,CG,CD,,,,,25612,15273,HYP
13,,SING,CG,OD,,,,,25612,15273,HYP
14,,SING,CG,HG,,,,,25612,15273,HYP
15,,SING,CD,HD1,,,,,25612,15273,HYP
16,,SING,CD,HD2,,,,,25612,15273,HYP
17,,SING,OD,HOD,,,,,25612,15273,HYP
18,,SING,OXT,HXT,,,,,25612,15273,HYP
1,,SING,C1,N,,,,,25810,15282,MEA
2,,SING,C1,H1C1,,,,,25810,15282,MEA
3,,SING,C1,H1C2,,,,,25810,15282,MEA
4,,SING,C1,H1C3,,,,,25810,15282,MEA
5,,SING,N,C3,,,,,25810,15282,MEA
6,,SING,N,H,,,,,25810,15282,MEA
7,,SING,C3,C,,,,,25810,15282,MEA
8,,SING,C3,C',,,,,25810,15282,MEA
9,,SING,C3,H3,,,,,25810,15282,MEA
10,,DOUB,C,O,,,,,25810,15282,MEA
11,,SING,C,OXT,,,,,25810,15282,MEA
12,,SING,C',C1',,,,,25810,15282,MEA
13,,SING,C',H'C1,,,,,25810,15282,MEA
14,,SING,C',H'C2,,,,,25810,15282,MEA
15,,DOUB,C1',C2',,,,,25810,15282,MEA
16,,SING,C1',C6',,,,,25810,15282,MEA
17,,SING,C2',C3',,,,,25810,15282,MEA
18,,SING,C2',H2',,,,,25810,15282,MEA
19,,DOUB,C3',C4',,,,,25810,15282,MEA
20,,SING,C3',H3',,,,,25810,15282,MEA
21,,SING,C4',C5',,,,,25810,15282,MEA
22,,SING,C4',H4',,,,,25810,15282,MEA
23,,DOUB,C5',C6',,,,,25810,15282,MEA
24,,SING,C5',H5',,,,,25810,15282,MEA
25,,SING,C6',H6',,,,,25810,15282,MEA
26,,SING,OXT,HXT,,,,,25810,15282,MEA
1,,SING,N,CA,,,,,25841,15284,2ML
2,,SING,N,HN2,,,,,25841,15284,2ML
3,,SING,N,H,,,,,25841,15284,2ML
4,,SING,CA,CB1,,,,,25841,15284,2ML
5,,SING,CA,CB2,,,,,25841,15284,2ML
6,,SING,CA,C,,,,,25841,15284,2ML
7,,SING,CB1,CG,,,,,25841,15284,2ML
8,,SING,CB1,HB11,,,,,25841,15284,2ML
9,,SING,CB1,HB12,,,,,25841,15284,2ML
10,,SING,CB2,HB21,,,,,25841,15284,2ML
11,,SING,CB2,HB22,,,,,25841,15284,2ML
12,,SING,CB2,HB23,,,,,25841,15284,2ML
13,,SING,CG,CD1,,,,,25841,15284,2ML
14,,SING,CG,CD2,,,,,25841,15284,2ML
15,,SING,CG,HG,,,,,25841,15284,2ML
16,,SING,CD1,HD11,,,,,25841,15284,2ML
17,,SING,CD1,HD12,,,,,25841,15284,2ML
18,,SING,CD1,HD13,,,,,25841,15284,2ML
19,,SING,CD2,HD21,,,,,25841,15284,2ML
20,,SING,CD2,HD22,,,,,25841,15284,2ML
21,,SING,CD2,HD23,,,,,25841,15284,2ML
22,,DOUB,C,O,,,,,25841,15284,2ML
23,,SING,C,OXT,,,,,25841,15284,2ML
24,,SING,OXT,HXT,,,,,25841,15284,2ML
1,,SING,N,CA,,,,,25857,15285,MLZ
2,,SING,N,HN1,,,,,25857,15285,MLZ
3,,SING,N,HN2,,,,,25857,15285,MLZ
4,,SING,CA,CB,,,,,25857,15285,MLZ
5,,SING,CA,C,,,,,25857,15285,MLZ
6,,SING,CA,HA,,,,,25857,15285,MLZ
7,,SING,CB,CG,,,,,25857,15285,MLZ
8,,SING,CB,HB1,,,,,25857,15285,MLZ
9,,SING,CB,HB2,,,,,25857,15285,MLZ
10,,SING,CG,CD,,,,,25857,15285,MLZ
11,,SING,CG,HG1,,,,,25857,15285,MLZ
12,,SING,CG,HG2,,,,,25857,15285,MLZ
13,,SING,CD,CE,,,,,25857,15285,MLZ
14,,SING,CD,HD1,,,,,25857,15285,MLZ
15,,SING,CD,HD2,,,,,25857,15285,MLZ
16,,SING,CE,NZ,,,,,25857,15285,MLZ
17,,SING,CE,HE1,,,,,25857,15285,MLZ
18,,SING,CE,HE2,,,,,25857,15285,MLZ
19,,SING,NZ,CM,,,,,25857,15285,MLZ
20,,SING,NZ,HZ,,,,,25857,15285,MLZ
21,,SING,CM,HCM1,,,,,25857,15285,MLZ
22,,SING,CM,HCM2,,,,,25857,15285,MLZ
23,,SING,CM,HCM3,,,,,25857,15285,MLZ
24,,DOUB,C,O,,,,,25857,15285,MLZ
25,,SING,C,OXT,,,,,25857,15285,MLZ
26,,SING,OXT,HXT,,,,,25857,15285,MLZ
1,,SING,C1,N,,,,,25887,15287,MEA
2,,SING,C1,H1C1,,,,,25887,15287,MEA
3,,SING,C1,H1C2,,,,,25887,15287,MEA
4,,SING,C1,H1C3,,,,,25887,15287,MEA
5,,SING,N,C3,,,,,25887,15287,MEA
6,,SING,N,H,,,,,25887,15287,MEA
7,,SING,C3,C,,,,,25887,15287,MEA
8,,SING,C3,C',,,,,25887,15287,MEA
9,,SING,C3,H3,,,,,25887,15287,MEA
10,,DOUB,C,O,,,,,25887,15287,MEA
11,,SING,C,OXT,,,,,25887,15287,MEA
12,,SING,C',C1',,,,,25887,15287,MEA
13,,SING,C',H'C1,,,,,25887,15287,MEA
14,,SING,C',H'C2,,,,,25887,15287,MEA
15,,DOUB,C1',C2',,,,,25887,15287,MEA
16,,SING,C1',C6',,,,,25887,15287,MEA
17,,SING,C2',C3',,,,,25887,15287,MEA
18,,SING,C2',H2',,,,,25887,15287,MEA
19,,DOUB,C3',C4',,,,,25887,15287,MEA
20,,SING,C3',H3',,,,,25887,15287,MEA
21,,SING,C4',C5',,,,,25887,15287,MEA
22,,SING,C4',H4',,,,,25887,15287,MEA
23,,DOUB,C5',C6',,,,,25887,15287,MEA
24,,SING,C5',H5',,,,,25887,15287,MEA
25,,SING,C6',H6',,,,,25887,15287,MEA
26,,SING,OXT,HXT,,,,,25887,15287,MEA
1,,SING,N,CA,no,N,1,,25968,15291,SAR
2,,SING,N,CN,no,N,2,,25968,15291,SAR
3,,SING,N,H,no,N,3,,25968,15291,SAR
4,,SING,CA,C,no,N,4,,25968,15291,SAR
5,,SING,CA,HA2,no,N,5,,25968,15291,SAR
6,,SING,CA,HA3,no,N,6,,25968,15291,SAR
7,,DOUB,C,O,no,N,7,,25968,15291,SAR
8,,SING,C,OXT,no,N,8,,25968,15291,SAR
9,,SING,CN,HN1,no,N,9,,25968,15291,SAR
10,,SING,C3',C2',,,,,26592,15331,CM0
10,,SING,CN,HN2,no,N,10,,25968,15291,SAR
11,,SING,CN,HN3,no,N,11,,25968,15291,SAR
12,,SING,OXT,HXT,no,N,12,,25968,15291,SAR
1,,SING,N,CA,no,N,1,,25983,15292,DSE
2,,SING,N,CN,no,N,2,,25983,15292,DSE
3,,SING,N,H,no,N,3,,25983,15292,DSE
4,,SING,CA,C,no,N,4,,25983,15292,DSE
5,,SING,CA,CB,no,N,5,,25983,15292,DSE
6,,SING,CA,HA,no,N,6,,25983,15292,DSE
7,,DOUB,C,O,no,N,7,,25983,15292,DSE
8,,SING,C,OXT,no,N,8,,25983,15292,DSE
9,,SING,OXT,HXT,no,N,9,,25983,15292,DSE
10,,SING,CB,OG,no,N,10,,25983,15292,DSE
11,,SING,CB,HB2,no,N,11,,25983,15292,DSE
12,,SING,CB,HB3,no,N,12,,25983,15292,DSE
13,,SING,CN,HN1,no,N,13,,25983,15292,DSE
14,,SING,CN,HN2,no,N,14,,25983,15292,DSE
15,,SING,CN,HN3,no,N,15,,25983,15292,DSE
16,,SING,OG,HG,no,N,16,,25983,15292,DSE
1,,SING,N,CA,,,,,25998,15293,2ML
2,,SING,N,HN2,,,,,25998,15293,2ML
3,,SING,N,H,,,,,25998,15293,2ML
4,,SING,CA,CB1,,,,,25998,15293,2ML
5,,SING,CA,CB2,,,,,25998,15293,2ML
6,,SING,CA,C,,,,,25998,15293,2ML
7,,SING,CB1,CG,,,,,25998,15293,2ML
8,,SING,CB1,HB11,,,,,25998,15293,2ML
9,,SING,CB1,HB12,,,,,25998,15293,2ML
10,,SING,CB2,HB21,,,,,25998,15293,2ML
11,,SING,CB2,HB22,,,,,25998,15293,2ML
12,,SING,CB2,HB23,,,,,25998,15293,2ML
13,,SING,CG,CD1,,,,,25998,15293,2ML
14,,SING,CG,CD2,,,,,25998,15293,2ML
15,,SING,CG,HG,,,,,25998,15293,2ML
16,,SING,CD1,HD11,,,,,25998,15293,2ML
17,,SING,CD1,HD12,,,,,25998,15293,2ML
18,,SING,CD1,HD13,,,,,25998,15293,2ML
19,,SING,CD2,HD21,,,,,25998,15293,2ML
20,,SING,CD2,HD22,,,,,25998,15293,2ML
21,,SING,CD2,HD23,,,,,25998,15293,2ML
22,,DOUB,C,O,,,,,25998,15293,2ML
23,,SING,C,OXT,,,,,25998,15293,2ML
24,,SING,OXT,HXT,,,,,25998,15293,2ML
1,,SING,N,CA,,,,,25999,15293,DSE
2,,SING,N,CN,,,,,25999,15293,DSE
3,,SING,N,HN,,,,,25999,15293,DSE
4,,SING,CA,C,,,,,25999,15293,DSE
5,,SING,CA,CB,,,,,25999,15293,DSE
6,,SING,CA,HA,,,,,25999,15293,DSE
7,,DOUB,C,O,,,,,25999,15293,DSE
8,,SING,C,OXT,,,,,25999,15293,DSE
9,,SING,OXT,HXT,,,,,25999,15293,DSE
10,,SING,CB,OG,,,,,25999,15293,DSE
11,,SING,CB,HB1,,,,,25999,15293,DSE
12,,SING,CB,HB2,,,,,25999,15293,DSE
13,,SING,CN,HN1,,,,,25999,15293,DSE
14,,SING,CN,HN2,,,,,25999,15293,DSE
15,,SING,CN,HN3,,,,,25999,15293,DSE
16,,SING,OG,HOG,,,,,25999,15293,DSE
1,,SING,N,CN,,,,,26014,15294,MNV
2,,SING,N,CA,,,,,26014,15294,MNV
3,,SING,N,HN,,,,,26014,15294,MNV
4,,SING,CN,HN1,,,,,26014,15294,MNV
5,,SING,CN,HN2,,,,,26014,15294,MNV
6,,SING,CN,HN3,,,,,26014,15294,MNV
7,,SING,CA,CB,,,,,26014,15294,MNV
8,,SING,CA,C,,,,,26014,15294,MNV
9,,SING,CA,HA,,,,,26014,15294,MNV
10,,SING,CB,CG1,,,,,26014,15294,MNV
11,,SING,CB,CG2,,,,,26014,15294,MNV
12,,SING,CB,HB,,,,,26014,15294,MNV
13,,SING,CG1,HG11,,,,,26014,15294,MNV
14,,SING,CG1,HG12,,,,,26014,15294,MNV
15,,SING,CG1,HG13,,,,,26014,15294,MNV
16,,SING,CG2,HG21,,,,,26014,15294,MNV
17,,SING,CG2,HG22,,,,,26014,15294,MNV
18,,SING,CG2,HG23,,,,,26014,15294,MNV
19,,DOUB,C,O,,,,,26014,15294,MNV
20,,SING,C,NT,,,,,26014,15294,MNV
21,,SING,NT,HNT1,,,,,26014,15294,MNV
22,,SING,NT,HNT2,,,,,26014,15294,MNV
1,,SING,N,CA,,,,,26015,15294,2ML
2,,SING,N,HN2,,,,,26015,15294,2ML
3,,SING,N,H,,,,,26015,15294,2ML
4,,SING,CA,CB1,,,,,26015,15294,2ML
5,,SING,CA,CB2,,,,,26015,15294,2ML
6,,SING,CA,C,,,,,26015,15294,2ML
7,,SING,CB1,CG,,,,,26015,15294,2ML
8,,SING,CB1,HB11,,,,,26015,15294,2ML
9,,SING,CB1,HB12,,,,,26015,15294,2ML
10,,SING,CB2,HB21,,,,,26015,15294,2ML
11,,SING,CB2,HB22,,,,,26015,15294,2ML
12,,SING,CB2,HB23,,,,,26015,15294,2ML
13,,SING,CG,CD1,,,,,26015,15294,2ML
14,,SING,CG,CD2,,,,,26015,15294,2ML
15,,SING,CG,HG,,,,,26015,15294,2ML
16,,SING,CD1,HD11,,,,,26015,15294,2ML
17,,SING,CD1,HD12,,,,,26015,15294,2ML
18,,SING,CD1,HD13,,,,,26015,15294,2ML
19,,SING,CD2,HD21,,,,,26015,15294,2ML
20,,SING,CD2,HD22,,,,,26015,15294,2ML
21,,SING,CD2,HD23,,,,,26015,15294,2ML
22,,DOUB,C,O,,,,,26015,15294,2ML
23,,SING,C,OXT,,,,,26015,15294,2ML
24,,SING,OXT,HXT,,,,,26015,15294,2ML
1,,SING,N,CA,,,,,26016,15294,MethylSER
2,,SING,N,CN,,,,,26016,15294,MethylSER
3,,SING,N,HN,,,,,26016,15294,MethylSER
4,,SING,CA,C,,,,,26016,15294,MethylSER
5,,SING,CA,CB,,,,,26016,15294,MethylSER
6,,SING,CA,HA,,,,,26016,15294,MethylSER
7,,DOUB,C,O,,,,,26016,15294,MethylSER
8,,SING,C,OXT,,,,,26016,15294,MethylSER
9,,SING,OXT,HXT,,,,,26016,15294,MethylSER
10,,SING,CB,OG,,,,,26016,15294,MethylSER
11,,SING,CB,HB1,,,,,26016,15294,MethylSER
12,,SING,CB,HB2,,,,,26016,15294,MethylSER
13,,SING,CN,HN1,,,,,26016,15294,MethylSER
14,,SING,CN,HN2,,,,,26016,15294,MethylSER
15,,SING,CN,HN3,,,,,26016,15294,MethylSER
16,,SING,OG,HOG,,,,,26016,15294,MethylSER
1,,SING,FE,NA,no,N,1,,26125,15301,HEC
2,,SING,FE,NB,no,N,2,,26125,15301,HEC
3,,SING,FE,NC,no,N,3,,26125,15301,HEC
4,,SING,FE,ND,no,N,4,,26125,15301,HEC
5,,DOUB,CHA,C1A,no,N,5,,26125,15301,HEC
6,,SING,CHA,C4D,no,N,6,,26125,15301,HEC
7,,SING,CHA,HHA,no,N,7,,26125,15301,HEC
8,,DOUB,CHB,C4A,no,N,8,,26125,15301,HEC
9,,SING,CHB,C1B,no,N,9,,26125,15301,HEC
10,,SING,CHB,HHB,no,N,10,,26125,15301,HEC
11,,DOUB,CHC,C4B,no,N,11,,26125,15301,HEC
12,,SING,CHC,C1C,no,N,12,,26125,15301,HEC
13,,SING,CHC,HHC,no,N,13,,26125,15301,HEC
14,,DOUB,CHD,C4C,no,N,14,,26125,15301,HEC
15,,SING,CHD,C1D,no,N,15,,26125,15301,HEC
16,,SING,CHD,HHD,no,N,16,,26125,15301,HEC
17,,SING,NA,C1A,yes,N,17,,26125,15301,HEC
18,,SING,NA,C4A,yes,N,18,,26125,15301,HEC
19,,SING,C1A,C2A,yes,N,19,,26125,15301,HEC
20,,DOUB,C2A,C3A,yes,N,20,,26125,15301,HEC
21,,SING,C2A,CAA,no,N,21,,26125,15301,HEC
22,,SING,C3A,C4A,yes,N,22,,26125,15301,HEC
23,,SING,C3A,CMA,no,N,23,,26125,15301,HEC
24,,SING,CMA,HMA1,no,N,24,,26125,15301,HEC
25,,SING,CMA,HMA2,no,N,25,,26125,15301,HEC
26,,SING,CMA,HMA3,no,N,26,,26125,15301,HEC
27,,SING,CAA,CBA,no,N,27,,26125,15301,HEC
28,,SING,CAA,HAA1,no,N,28,,26125,15301,HEC
29,,SING,CAA,HAA2,no,N,29,,26125,15301,HEC
30,,SING,CBA,CGA,no,N,30,,26125,15301,HEC
31,,SING,CBA,HBA1,no,N,31,,26125,15301,HEC
32,,SING,CBA,HBA2,no,N,32,,26125,15301,HEC
33,,DOUB,CGA,O1A,no,N,33,,26125,15301,HEC
34,,SING,CGA,O2A,no,N,34,,26125,15301,HEC
35,,SING,O2A,H2A,no,N,35,,26125,15301,HEC
36,,SING,NB,C1B,yes,N,36,,26125,15301,HEC
37,,SING,NB,C4B,yes,N,37,,26125,15301,HEC
38,,DOUB,C1B,C2B,yes,N,38,,26125,15301,HEC
39,,SING,C2B,C3B,yes,N,39,,26125,15301,HEC
40,,SING,C2B,CMB,no,N,40,,26125,15301,HEC
41,,SING,C3B,C4B,yes,N,41,,26125,15301,HEC
42,,DOUB,C3B,CAB,no,E,42,,26125,15301,HEC
43,,SING,CMB,HMB1,no,N,43,,26125,15301,HEC
44,,SING,CMB,HMB2,no,N,44,,26125,15301,HEC
45,,SING,CMB,HMB3,no,N,45,,26125,15301,HEC
46,,SING,CAB,CBB,no,N,46,,26125,15301,HEC
47,,SING,CAB,HAB,no,N,47,,26125,15301,HEC
48,,SING,CBB,HBB1,no,N,48,,26125,15301,HEC
49,,SING,CBB,HBB2,no,N,49,,26125,15301,HEC
50,,SING,CBB,HBB3,no,N,50,,26125,15301,HEC
51,,SING,NC,C1C,yes,N,51,,26125,15301,HEC
52,,SING,NC,C4C,yes,N,52,,26125,15301,HEC
53,,DOUB,C1C,C2C,yes,N,53,,26125,15301,HEC
54,,SING,C2C,C3C,yes,N,54,,26125,15301,HEC
55,,SING,C2C,CMC,no,N,55,,26125,15301,HEC
56,,SING,C3C,C4C,yes,N,56,,26125,15301,HEC
57,,DOUB,C3C,CAC,no,E,57,,26125,15301,HEC
58,,SING,CMC,HMC1,no,N,58,,26125,15301,HEC
59,,SING,CMC,HMC2,no,N,59,,26125,15301,HEC
60,,SING,CMC,HMC3,no,N,60,,26125,15301,HEC
61,,SING,CAC,CBC,no,N,61,,26125,15301,HEC
62,,SING,CAC,HAC,no,N,62,,26125,15301,HEC
63,,SING,CBC,HBC1,no,N,63,,26125,15301,HEC
64,,SING,CBC,HBC2,no,N,64,,26125,15301,HEC
65,,SING,CBC,HBC3,no,N,65,,26125,15301,HEC
66,,SING,ND,C1D,yes,N,66,,26125,15301,HEC
67,,SING,ND,C4D,yes,N,67,,26125,15301,HEC
68,,DOUB,C1D,C2D,yes,N,68,,26125,15301,HEC
69,,SING,C2D,C3D,yes,N,69,,26125,15301,HEC
70,,SING,C2D,CMD,no,N,70,,26125,15301,HEC
71,,DOUB,C3D,C4D,yes,N,71,,26125,15301,HEC
72,,SING,C3D,CAD,no,N,72,,26125,15301,HEC
73,,SING,CMD,HMD1,no,N,73,,26125,15301,HEC
74,,SING,CMD,HMD2,no,N,74,,26125,15301,HEC
75,,SING,CMD,HMD3,no,N,75,,26125,15301,HEC
76,,SING,CAD,CBD,no,N,76,,26125,15301,HEC
77,,SING,CAD,HAD1,no,N,77,,26125,15301,HEC
78,,SING,CAD,HAD2,no,N,78,,26125,15301,HEC
79,,SING,CBD,CGD,no,N,79,,26125,15301,HEC
80,,SING,CBD,HBD1,no,N,80,,26125,15301,HEC
81,,SING,CBD,HBD2,no,N,81,,26125,15301,HEC
82,,DOUB,CGD,O1D,no,N,82,,26125,15301,HEC
83,,SING,CGD,O2D,no,N,83,,26125,15301,HEC
84,,SING,O2D,H2D,no,N,84,,26125,15301,HEC
1,,SING,FE1,S1,no,N,1,,26126,15301,FES
2,,SING,FE1,S2,no,N,2,,26126,15301,FES
3,,SING,FE2,S1,no,N,3,,26126,15301,FES
4,,SING,FE2,S2,no,N,4,,26126,15301,FES
1,,SING,P,O5',,,,,26592,15331,CM0
2,,SING,P,O3P,,,,,26592,15331,CM0
3,,SING,O5',C5',,,,,26592,15331,CM0
4,,DOUB,P,O1P,,,,,26592,15331,CM0
5,,SING,P,O2P,,,,,26592,15331,CM0
6,,SING,C3',C4',,,,,26592,15331,CM0
7,,SING,C5',C4',,,,,26592,15331,CM0
8,,SING,N1,C2,,,,,26592,15331,CM0
9,,SING,C4',O4',,,,,26592,15331,CM0
11,,DOUB,C2,O2,,,,,26592,15331,CM0
12,,SING,C2,N3,,,,,26592,15331,CM0
13,,SING,C5,C4,,,,,26592,15331,CM0
14,,SING,N3,C4,,,,,26592,15331,CM0
15,,DOUB,C4,O4,,,,,26592,15331,CM0
16,,DOUB,C5,C6,,,,,26592,15331,CM0
17,,SING,N1,C6,,,,,26592,15331,CM0
18,,SING,C7,C8,,,,,26592,15331,CM0
19,,SING,C5,O5,,,,,26592,15331,CM0
20,,SING,C7,O5,,,,,26592,15331,CM0
21,,SING,C8,O8,,,,,26592,15331,CM0
22,,SING,N1,C1',,,,,26592,15331,CM0
23,,SING,C2',C1',,,,,26592,15331,CM0
24,,SING,O4',C1',,,,,26592,15331,CM0
25,,SING,C2',O2',,,,,26592,15331,CM0
26,,DOUB,C8,O9,,,,,26592,15331,CM0
27,,SING,C3',O3',,,,,26592,15331,CM0
28,,SING,O2P,H2P,,,,,26592,15331,CM0
29,,SING,O3P,H3P,,,,,26592,15331,CM0
30,,SING,C5',H5'1,,,,,26592,15331,CM0
31,,SING,C5',H5'2,,,,,26592,15331,CM0
32,,SING,C4',H4',,,,,26592,15331,CM0
33,,SING,C3',H3',,,,,26592,15331,CM0
34,,SING,C1',H1',,,,,26592,15331,CM0
35,,SING,C2',H2',,,,,26592,15331,CM0
36,,SING,C6,H6,,,,,26592,15331,CM0
37,,SING,N3,H3,,,,,26592,15331,CM0
38,,SING,C7,H7C1,,,,,26592,15331,CM0
39,,SING,C7,H7C2,,,,,26592,15331,CM0
40,,SING,O8,H8,,,,,26592,15331,CM0
41,,SING,O2',HA,,,,,26592,15331,CM0
42,,SING,O3',HB,,,,,26592,15331,CM0
1,,SING,C4,C5,,,,,26593,15331,6MZ
2,,SING,C4,N9,,,,,26593,15331,6MZ
3,,SING,C2,N3,,,,,26593,15331,6MZ
4,,DOUB,C4,N3,,,,,26593,15331,6MZ
5,,DOUB,C2,N1,,,,,26593,15331,6MZ
6,,DOUB,C5,C6,,,,,26593,15331,6MZ
7,,SING,N1,C6,,,,,26593,15331,6MZ
8,,SING,C6,N6,,,,,26593,15331,6MZ
9,,SING,N6,C9,,,,,26593,15331,6MZ
10,,SING,C5,N7,,,,,26593,15331,6MZ
11,,SING,N9,C8,,,,,26593,15331,6MZ
12,,DOUB,N7,C8,,,,,26593,15331,6MZ
13,,SING,O5',C5',,,,,26593,15331,6MZ
14,,SING,C1',H1',,,,,26593,15331,6MZ
15,,SING,C9,H9C1,,,,,26593,15331,6MZ
16,,SING,C9,H9C2,,,,,26593,15331,6MZ
17,,SING,C5',H5'1,,,,,26593,15331,6MZ
18,,SING,C5',H5'2,,,,,26593,15331,6MZ
19,,SING,C4',H4',,,,,26593,15331,6MZ
20,,SING,C3',H3',,,,,26593,15331,6MZ
21,,SING,C2',H2',,,,,26593,15331,6MZ
22,,SING,O2',HA,,,,,26593,15331,6MZ
23,,SING,O3',HB,,,,,26593,15331,6MZ
24,,SING,O3P,H3P,,,,,26593,15331,6MZ
25,,SING,C5',C4',,,,,26593,15331,6MZ
26,,SING,C4',O4',,,,,26593,15331,6MZ
27,,SING,N9,C1',,,,,26593,15331,6MZ
28,,SING,O4',C1',,,,,26593,15331,6MZ
29,,SING,C1',C2',,,,,26593,15331,6MZ
30,,SING,C2',O2',,,,,26593,15331,6MZ
31,,SING,C4',C3',,,,,26593,15331,6MZ
32,,SING,C2',C3',,,,,26593,15331,6MZ
33,,SING,C3',O3',,,,,26593,15331,6MZ
34,,SING,O1P,P,,,,,26593,15331,6MZ
35,,DOUB,O2P,P,,,,,26593,15331,6MZ
36,,SING,O5',P,,,,,26593,15331,6MZ
37,,SING,P,O3P,,,,,26593,15331,6MZ
38,,SING,C2,H2,,,,,26593,15331,6MZ
39,,SING,O1P,H1P,,,,,26593,15331,6MZ
40,,SING,C8,H8,,,,,26593,15331,6MZ
41,,SING,N6,H6,,,,,26593,15331,6MZ
42,,SING,C9,H9,,,,,26593,15331,6MZ
1,,SING,P,O5',,,,,26907,15342,CM0
2,,SING,P,O3P,,,,,26907,15342,CM0
3,,SING,O5',C5',,,,,26907,15342,CM0
4,,DOUB,P,O1P,,,,,26907,15342,CM0
5,,SING,P,O2P,,,,,26907,15342,CM0
6,,SING,C3',C4',,,,,26907,15342,CM0
7,,SING,C5',C4',,,,,26907,15342,CM0
8,,SING,N1,C2,,,,,26907,15342,CM0
9,,SING,C4',O4',,,,,26907,15342,CM0
10,,SING,C3',C2',,,,,26907,15342,CM0
11,,DOUB,C2,O2,,,,,26907,15342,CM0
12,,SING,C2,N3,,,,,26907,15342,CM0
13,,SING,C5,C4,,,,,26907,15342,CM0
14,,SING,N3,C4,,,,,26907,15342,CM0
15,,DOUB,C4,O4,,,,,26907,15342,CM0
16,,DOUB,C5,C6,,,,,26907,15342,CM0
17,,SING,N1,C6,,,,,26907,15342,CM0
18,,SING,C7,C8,,,,,26907,15342,CM0
19,,SING,C5,O5,,,,,26907,15342,CM0
20,,SING,C7,O5,,,,,26907,15342,CM0
21,,SING,C8,O8,,,,,26907,15342,CM0
22,,SING,N1,C1',,,,,26907,15342,CM0
23,,SING,C2',C1',,,,,26907,15342,CM0
24,,SING,O4',C1',,,,,26907,15342,CM0
25,,SING,C2',O2',,,,,26907,15342,CM0
26,,DOUB,C8,O9,,,,,26907,15342,CM0
27,,SING,C3',O3',,,,,26907,15342,CM0
28,,SING,O2P,H2P,,,,,26907,15342,CM0
29,,SING,O3P,H3P,,,,,26907,15342,CM0
30,,SING,C5',H5'1,,,,,26907,15342,CM0
31,,SING,C5',H5'2,,,,,26907,15342,CM0
32,,SING,C4',H4',,,,,26907,15342,CM0
33,,SING,C3',H3',,,,,26907,15342,CM0
34,,SING,C1',H1',,,,,26907,15342,CM0
35,,SING,C2',H2',,,,,26907,15342,CM0
36,,SING,C6,H6,,,,,26907,15342,CM0
37,,SING,N3,H3,,,,,26907,15342,CM0
38,,SING,C7,H7C1,,,,,26907,15342,CM0
39,,SING,C7,H7C2,,,,,26907,15342,CM0
40,,SING,O8,H8,,,,,26907,15342,CM0
41,,SING,O2',HA,,,,,26907,15342,CM0
42,,SING,O3',HB,,,,,26907,15342,CM0
1,,DOUB,C1,C2,,,,,27320,15361,NGH
2,,SING,C1,C6,,,,,27320,15361,NGH
3,,SING,C1,H1,,,,,27320,15361,NGH
4,,SING,C2,C3,,,,,27320,15361,NGH
5,,SING,C2,H2,,,,,27320,15361,NGH
6,,DOUB,C3,C4,,,,,27320,15361,NGH
7,,SING,C3,O1,,,,,27320,15361,NGH
8,,SING,C4,C5,,,,,27320,15361,NGH
9,,SING,C4,H4,,,,,27320,15361,NGH
10,,DOUB,C5,C6,,,,,27320,15361,NGH
11,,SING,C5,H5,,,,,27320,15361,NGH
12,,SING,C6,S1,,,,,27320,15361,NGH
13,,SING,O1,C7,,,,,27320,15361,NGH
14,,SING,C7,H71,,,,,27320,15361,NGH
15,,SING,C7,H72,,,,,27320,15361,NGH
16,,SING,C7,H73,,,,,27320,15361,NGH
17,,DOUB,S1,O2,,,,,27320,15361,NGH
18,,DOUB,S1,O3,,,,,27320,15361,NGH
19,,SING,S1,N,,,,,27320,15361,NGH
20,,SING,N,C9,,,,,27320,15361,NGH
21,,SING,N,C10,,,,,27320,15361,NGH
22,,SING,C9,C12,,,,,27320,15361,NGH
23,,SING,C9,H91,,,,,27320,15361,NGH
24,,SING,C9,H92,,,,,27320,15361,NGH
25,,SING,C10,C11,,,,,27320,15361,NGH
26,,SING,C10,H101,,,,,27320,15361,NGH
27,,SING,C10,H102,,,,,27320,15361,NGH
28,,SING,C11,N1,,,,,27320,15361,NGH
29,,DOUB,C11,O5,,,,,27320,15361,NGH
30,,SING,N1,O4,,,,,27320,15361,NGH
31,,SING,N1,HN1,,,,,27320,15361,NGH
32,,SING,O4,HO4,,,,,27320,15361,NGH
33,,SING,C12,C13,,,,,27320,15361,NGH
34,,SING,C12,C14,,,,,27320,15361,NGH
35,,SING,C12,H12,,,,,27320,15361,NGH
36,,SING,C13,H131,,,,,27320,15361,NGH
37,,SING,C13,H132,,,,,27320,15361,NGH
38,,SING,C13,H133,,,,,27320,15361,NGH
39,,SING,C14,H141,,,,,27320,15361,NGH
40,,SING,C14,H142,,,,,27320,15361,NGH
41,,SING,C14,H143,,,,,27320,15361,NGH
1,,SING,C4,C5,,,,,27344,15362,6MZ
2,,SING,C4,N9,,,,,27344,15362,6MZ
3,,SING,C2,N3,,,,,27344,15362,6MZ
4,,DOUB,C4,N3,,,,,27344,15362,6MZ
5,,DOUB,C2,N1,,,,,27344,15362,6MZ
6,,DOUB,C5,C6,,,,,27344,15362,6MZ
7,,SING,N1,C6,,,,,27344,15362,6MZ
8,,SING,C6,N6,,,,,27344,15362,6MZ
9,,SING,N6,C9,,,,,27344,15362,6MZ
10,,SING,C5,N7,,,,,27344,15362,6MZ
11,,SING,N9,C8,,,,,27344,15362,6MZ
12,,DOUB,N7,C8,,,,,27344,15362,6MZ
13,,SING,O5',C5',,,,,27344,15362,6MZ
14,,SING,C1',H1',,,,,27344,15362,6MZ
15,,SING,C9,H9C1,,,,,27344,15362,6MZ
16,,SING,C9,H9C2,,,,,27344,15362,6MZ
17,,SING,C5',H5'1,,,,,27344,15362,6MZ
18,,SING,C5',H5'2,,,,,27344,15362,6MZ
19,,SING,C4',H4',,,,,27344,15362,6MZ
20,,SING,C3',H3',,,,,27344,15362,6MZ
21,,SING,C2',H2',,,,,27344,15362,6MZ
22,,SING,O2',HA,,,,,27344,15362,6MZ
23,,SING,O3',HB,,,,,27344,15362,6MZ
24,,SING,O3P,H3P,,,,,27344,15362,6MZ
25,,SING,C5',C4',,,,,27344,15362,6MZ
26,,SING,C4',O4',,,,,27344,15362,6MZ
27,,SING,N9,C1',,,,,27344,15362,6MZ
28,,SING,O4',C1',,,,,27344,15362,6MZ
29,,SING,C1',C2',,,,,27344,15362,6MZ
30,,SING,C2',O2',,,,,27344,15362,6MZ
31,,SING,C4',C3',,,,,27344,15362,6MZ
32,,SING,C2',C3',,,,,27344,15362,6MZ
33,,SING,C3',O3',,,,,27344,15362,6MZ
34,,SING,O1P,P,,,,,27344,15362,6MZ
35,,DOUB,O2P,P,,,,,27344,15362,6MZ
36,,SING,O5',P,,,,,27344,15362,6MZ
37,,SING,P,O3P,,,,,27344,15362,6MZ
38,,SING,C2,H2,,,,,27344,15362,6MZ
39,,SING,O1P,H1P,,,,,27344,15362,6MZ
40,,SING,C8,H8,,,,,27344,15362,6MZ
41,,SING,N6,H6,,,,,27344,15362,6MZ
42,,SING,C9,H9,,,,,27344,15362,6MZ
1,,SING,N,CA,,,,,27366,15363,HYP
2,,SING,N,CD,,,,,27366,15363,HYP
3,,SING,N,H,,,,,27366,15363,HYP
4,,SING,CA,C,,,,,27366,15363,HYP
5,,SING,CA,CB,,,,,27366,15363,HYP
6,,SING,CA,HA,,,,,27366,15363,HYP
7,,DOUB,C,O,,,,,27366,15363,HYP
8,,SING,C,OXT,,,,,27366,15363,HYP
9,,SING,CB,CG,,,,,27366,15363,HYP
10,,SING,CB,HB1,,,,,27366,15363,HYP
11,,SING,CB,HB2,,,,,27366,15363,HYP
12,,SING,CG,CD,,,,,27366,15363,HYP
13,,SING,CG,OD,,,,,27366,15363,HYP
14,,SING,CG,HG,,,,,27366,15363,HYP
15,,SING,CD,HD1,,,,,27366,15363,HYP
16,,SING,CD,HD2,,,,,27366,15363,HYP
17,,SING,OD,HOD,,,,,27366,15363,HYP
18,,SING,OXT,HXT,,,,,27366,15363,HYP
1,,SING,N,CA,,,,,27367,15363,DPN
2,,SING,N,H,,,,,27367,15363,DPN
3,,SING,N,HN2,,,,,27367,15363,DPN
4,,SING,CA,C,,,,,27367,15363,DPN
5,,SING,CA,CB,,,,,27367,15363,DPN
6,,SING,CA,HA,,,,,27367,15363,DPN
7,,DOUB,C,O,,,,,27367,15363,DPN
8,,SING,C,OXT,,,,,27367,15363,DPN
9,,SING,OXT,HXT,,,,,27367,15363,DPN
10,,SING,CB,CG,,,,,27367,15363,DPN
11,,SING,CB,HB1,,,,,27367,15363,DPN
12,,SING,CB,HB2,,,,,27367,15363,DPN
13,,DOUB,CG,CD1,,,,,27367,15363,DPN
14,,SING,CG,CD2,,,,,27367,15363,DPN
15,,SING,CD1,CE1,,,,,27367,15363,DPN
16,,SING,CD1,HD1,,,,,27367,15363,DPN
17,,DOUB,CD2,CE2,,,,,27367,15363,DPN
18,,SING,CD2,HD2,,,,,27367,15363,DPN
19,,DOUB,CE1,CZ,,,,,27367,15363,DPN
20,,SING,CE1,HE1,,,,,27367,15363,DPN
21,,SING,CE2,CZ,,,,,27367,15363,DPN
22,,SING,CE2,HE2,,,,,27367,15363,DPN
23,,SING,CZ,HZ,,,,,27367,15363,DPN
1,,SING,P,OP3,,,,,27610,15376,NCX
2,,DOUB,P,OP1,,,,,27610,15376,NCX
3,,SING,P,O5',,,,,27610,15376,NCX
4,,SING,P,OP2,,,,,27610,15376,NCX
5,,SING,OP2,HOP2,,,,,27610,15376,NCX
6,,SING,OP3,HOP3,,,,,27610,15376,NCX
7,,SING,O5',C5',,,,,27610,15376,NCX
8,,SING,C5',C4',,,,,27610,15376,NCX
9,,SING,C5',H5',,,,,27610,15376,NCX
10,,SING,C5',H5'',,,,,27610,15376,NCX
11,,SING,C4',O4',,,,,27610,15376,NCX
12,,SING,C4',C3',,,,,27610,15376,NCX
13,,SING,C4',H4',,,,,27610,15376,NCX
14,,SING,O4',C1',,,,,27610,15376,NCX
15,,SING,C1',N9,,,,,27610,15376,NCX
16,,SING,C1',C2',,,,,27610,15376,NCX
17,,SING,C1',H1',,,,,27610,15376,NCX
18,,SING,N9,C4,,,,,27610,15376,NCX
19,,SING,N9,C8,,,,,27610,15376,NCX
20,,DOUB,C8,C7,,,,,27610,15376,NCX
21,,SING,C8,H8,,,,,27610,15376,NCX
22,,SING,C7,C5,,,,,27610,15376,NCX
23,,SING,C7,CO7,,,,,27610,15376,NCX
24,,SING,CO7,NH7,,,,,27610,15376,NCX
25,,DOUB,CO7,O7,,,,,27610,15376,NCX
26,,SING,NH7,HH71,,,,,27610,15376,NCX
27,,SING,NH7,HH72,,,,,27610,15376,NCX
28,,DOUB,C5,C6,,,,,27610,15376,NCX
29,,SING,C5,C4,,,,,27610,15376,NCX
30,,DOUB,C4,C3,,,,,27610,15376,NCX
31,,SING,C3,C2,,,,,27610,15376,NCX
32,,SING,C3,H3,,,,,27610,15376,NCX
33,,DOUB,C2,C1,,,,,27610,15376,NCX
34,,SING,C2,H2,,,,,27610,15376,NCX
35,,SING,C1,N1,,,,,27610,15376,NCX
36,,SING,C1,C6,,,,,27610,15376,NCX
37,,SING,N1,O12,,,,,27610,15376,NCX
38,,DOUB,N1,O11,,,,,27610,15376,NCX
39,,SING,C6,H6,,,,,27610,15376,NCX
40,,SING,C3',C2',,,,,27610,15376,NCX
41,,SING,C3',O3',,,,,27610,15376,NCX
42,,SING,C3',H3',,,,,27610,15376,NCX
43,,SING,C2',H2',,,,,27610,15376,NCX
44,,SING,C2',H2'',,,,,27610,15376,NCX
45,,SING,O3',HO3',,,,,27610,15376,NCX
1,,SING,F1,C2,,,,,27774,15384,HLT
2,,SING,C2,F2,,,,,27774,15384,HLT
3,,SING,C2,F3,,,,,27774,15384,HLT
4,,SING,C2,C1,,,,,27774,15384,HLT
5,,SING,C1,BR,,,,,27774,15384,HLT
6,,SING,C1,CL,,,,,27774,15384,HLT
7,,SING,C1,HC1,,,,,27774,15384,HLT
1,,DOUB,C,O,no,N,1,,27920,15391,ACE
2,,SING,C,CH3,no,N,2,,27920,15391,ACE
3,,SING,C,H,no,N,3,,27920,15391,ACE
4,,SING,CH3,H1,no,N,4,,27920,15391,ACE
5,,SING,CH3,H2,no,N,5,,27920,15391,ACE
6,,SING,CH3,H3,no,N,6,,27920,15391,ACE
1,,SING,N,HN1,no,N,1,,27921,15391,NH2
2,,SING,N,HN2,no,N,2,,27921,15391,NH2
1,,DOUB,C,O,no,N,1,,27938,15392,ACE
2,,SING,C,CH3,no,N,2,,27938,15392,ACE
3,,SING,C,H,no,N,3,,27938,15392,ACE
4,,SING,CH3,H1,no,N,4,,27938,15392,ACE
5,,SING,CH3,H2,no,N,5,,27938,15392,ACE
6,,SING,CH3,H3,no,N,6,,27938,15392,ACE
1,,SING,N,HN1,no,N,1,,27939,15392,NH2
2,,SING,N,HN2,no,N,2,,27939,15392,NH2
1,,SING,N,CA,no,N,1,,28094,15400,FTR
2,,SING,N,H,no,N,2,,28094,15400,FTR
3,,SING,N,H2,no,N,3,,28094,15400,FTR
4,,SING,CA,CB,no,N,4,,28094,15400,FTR
5,,SING,CA,C,no,N,5,,28094,15400,FTR
6,,SING,CA,HA,no,N,6,,28094,15400,FTR
7,,SING,CB,CG,no,N,7,,28094,15400,FTR
8,,SING,CB,HB2,no,N,8,,28094,15400,FTR
9,,SING,CB,HB3,no,N,9,,28094,15400,FTR
10,,SING,CG,CD2,yes,N,10,,28094,15400,FTR
11,,DOUB,CG,CD1,yes,N,11,,28094,15400,FTR
12,,DOUB,CD2,CE2,yes,N,12,,28094,15400,FTR
13,,SING,CD2,CE3,yes,N,13,,28094,15400,FTR
14,,SING,CE2,NE1,yes,N,14,,28094,15400,FTR
15,,SING,CE2,CZ2,yes,N,15,,28094,15400,FTR
16,,DOUB,CE3,CZ3,yes,N,16,,28094,15400,FTR
17,,SING,CE3,HE3,no,N,17,,28094,15400,FTR
18,,SING,CD1,NE1,yes,N,18,,28094,15400,FTR
19,,SING,CD1,HD1,no,N,19,,28094,15400,FTR
20,,SING,NE1,HE1,no,N,20,,28094,15400,FTR
21,,DOUB,CZ2,CH2,yes,N,21,,28094,15400,FTR
22,,SING,CZ2,HZ2,no,N,22,,28094,15400,FTR
23,,SING,CZ3,F,no,N,23,,28094,15400,FTR
24,,SING,CZ3,CH2,yes,N,24,,28094,15400,FTR
25,,SING,CH2,HH2,no,N,25,,28094,15400,FTR
26,,DOUB,C,O,no,N,26,,28094,15400,FTR
27,,SING,C,OXT,no,N,27,,28094,15400,FTR
28,,SING,OXT,HXT,no,N,28,,28094,15400,FTR
1,,SING,N,CA,no,N,1,,28580,15427,FTR
2,,SING,N,H,no,N,2,,28580,15427,FTR
3,,SING,N,H2,no,N,3,,28580,15427,FTR
4,,SING,CA,CB,no,N,4,,28580,15427,FTR
5,,SING,CA,C,no,N,5,,28580,15427,FTR
6,,SING,CA,HA,no,N,6,,28580,15427,FTR
7,,SING,CB,CG,no,N,7,,28580,15427,FTR
8,,SING,CB,HB2,no,N,8,,28580,15427,FTR
9,,SING,CB,HB3,no,N,9,,28580,15427,FTR
10,,SING,CG,CD2,yes,N,10,,28580,15427,FTR
11,,DOUB,CG,CD1,yes,N,11,,28580,15427,FTR
12,,DOUB,CD2,CE2,yes,N,12,,28580,15427,FTR
13,,SING,CD2,CE3,yes,N,13,,28580,15427,FTR
14,,SING,CE2,NE1,yes,N,14,,28580,15427,FTR
15,,SING,CE2,CZ2,yes,N,15,,28580,15427,FTR
16,,DOUB,CE3,CZ3,yes,N,16,,28580,15427,FTR
17,,SING,CE3,HE3,no,N,17,,28580,15427,FTR
18,,SING,CD1,NE1,yes,N,18,,28580,15427,FTR
19,,SING,CD1,HD1,no,N,19,,28580,15427,FTR
20,,SING,NE1,HE1,no,N,20,,28580,15427,FTR
21,,DOUB,CZ2,CH2,yes,N,21,,28580,15427,FTR
22,,SING,CZ2,HZ2,no,N,22,,28580,15427,FTR
23,,SING,CZ3,F,no,N,23,,28580,15427,FTR
24,,SING,CZ3,CH2,yes,N,24,,28580,15427,FTR
25,,SING,CH2,HH2,no,N,25,,28580,15427,FTR
26,,DOUB,C,O,no,N,26,,28580,15427,FTR
27,,SING,C,OXT,no,N,27,,28580,15427,FTR
28,,SING,OXT,HXT,no,N,28,,28580,15427,FTR
1,,DOUB,C1,O1,no,N,1,,28670,15433,OLA
2,,SING,C1,O2,no,N,2,,28670,15433,OLA
3,,SING,C1,C2,no,N,3,,28670,15433,OLA
4,,SING,O2,HO2,no,N,4,,28670,15433,OLA
5,,SING,C2,C3,no,N,5,,28670,15433,OLA
6,,SING,C2,H21,no,N,6,,28670,15433,OLA
7,,SING,C2,H22,no,N,7,,28670,15433,OLA
8,,SING,C3,C4,no,N,8,,28670,15433,OLA
9,,SING,C3,H31,no,N,9,,28670,15433,OLA
10,,SING,C3,H32,no,N,10,,28670,15433,OLA
11,,SING,C4,C5,no,N,11,,28670,15433,OLA
12,,SING,C4,H41,no,N,12,,28670,15433,OLA
13,,SING,C4,H42,no,N,13,,28670,15433,OLA
14,,SING,C5,C6,no,N,14,,28670,15433,OLA
15,,SING,C5,H51,no,N,15,,28670,15433,OLA
16,,SING,C5,H52,no,N,16,,28670,15433,OLA
17,,SING,C6,C7,no,N,17,,28670,15433,OLA
18,,SING,C6,H61,no,N,18,,28670,15433,OLA
19,,SING,C6,H62,no,N,19,,28670,15433,OLA
20,,SING,C7,C8,no,N,20,,28670,15433,OLA
21,,SING,C7,H71,no,N,21,,28670,15433,OLA
22,,SING,C7,H72,no,N,22,,28670,15433,OLA
23,,SING,C8,C9,no,N,23,,28670,15433,OLA
24,,SING,C8,H81,no,N,24,,28670,15433,OLA
25,,SING,C8,H82,no,N,25,,28670,15433,OLA
26,,DOUB,C9,C10,no,Z,26,,28670,15433,OLA
27,,SING,C9,H9,no,N,27,,28670,15433,OLA
28,,SING,C10,C11,no,N,28,,28670,15433,OLA
29,,SING,C10,H10,no,N,29,,28670,15433,OLA
30,,SING,C11,C12,no,N,30,,28670,15433,OLA
31,,SING,C11,H111,no,N,31,,28670,15433,OLA
32,,SING,C11,H112,no,N,32,,28670,15433,OLA
33,,SING,C12,C13,no,N,33,,28670,15433,OLA
34,,SING,C12,H121,no,N,34,,28670,15433,OLA
35,,SING,C12,H122,no,N,35,,28670,15433,OLA
36,,SING,C13,C14,no,N,36,,28670,15433,OLA
37,,SING,C13,H131,no,N,37,,28670,15433,OLA
38,,SING,C13,H132,no,N,38,,28670,15433,OLA
39,,SING,C14,C15,no,N,39,,28670,15433,OLA
40,,SING,C14,H141,no,N,40,,28670,15433,OLA
41,,SING,C14,H142,no,N,41,,28670,15433,OLA
42,,SING,C15,C16,no,N,42,,28670,15433,OLA
43,,SING,C15,H151,no,N,43,,28670,15433,OLA
44,,SING,C15,H152,no,N,44,,28670,15433,OLA
45,,SING,C16,C17,no,N,45,,28670,15433,OLA
46,,SING,C16,H161,no,N,46,,28670,15433,OLA
47,,SING,C16,H162,no,N,47,,28670,15433,OLA
48,,SING,C17,C18,no,N,48,,28670,15433,OLA
49,,SING,C17,H171,no,N,49,,28670,15433,OLA
50,,SING,C17,H172,no,N,50,,28670,15433,OLA
51,,SING,C18,H181,no,N,51,,28670,15433,OLA
52,,SING,C18,H182,no,N,52,,28670,15433,OLA
53,,SING,C18,H183,no,N,53,,28670,15433,OLA
1,,DOUB,C1,O1,no,N,1,,28697,15434,OLA
2,,SING,C1,O2,no,N,2,,28697,15434,OLA
3,,SING,C1,C2,no,N,3,,28697,15434,OLA
4,,SING,O2,HO2,no,N,4,,28697,15434,OLA
5,,SING,C2,C3,no,N,5,,28697,15434,OLA
6,,SING,C2,H21,no,N,6,,28697,15434,OLA
7,,SING,C2,H22,no,N,7,,28697,15434,OLA
8,,SING,C3,C4,no,N,8,,28697,15434,OLA
9,,SING,C3,H31,no,N,9,,28697,15434,OLA
10,,SING,C3,H32,no,N,10,,28697,15434,OLA
11,,SING,C4,C5,no,N,11,,28697,15434,OLA
12,,SING,C4,H41,no,N,12,,28697,15434,OLA
13,,SING,C4,H42,no,N,13,,28697,15434,OLA
14,,SING,C5,C6,no,N,14,,28697,15434,OLA
15,,SING,C5,H51,no,N,15,,28697,15434,OLA
16,,SING,C5,H52,no,N,16,,28697,15434,OLA
17,,SING,C6,C7,no,N,17,,28697,15434,OLA
18,,SING,C6,H61,no,N,18,,28697,15434,OLA
19,,SING,C6,H62,no,N,19,,28697,15434,OLA
20,,SING,C7,C8,no,N,20,,28697,15434,OLA
21,,SING,C7,H71,no,N,21,,28697,15434,OLA
22,,SING,C7,H72,no,N,22,,28697,15434,OLA
23,,SING,C8,C9,no,N,23,,28697,15434,OLA
24,,SING,C8,H81,no,N,24,,28697,15434,OLA
25,,SING,C8,H82,no,N,25,,28697,15434,OLA
26,,DOUB,C9,C10,no,Z,26,,28697,15434,OLA
27,,SING,C9,H9,no,N,27,,28697,15434,OLA
28,,SING,C10,C11,no,N,28,,28697,15434,OLA
29,,SING,C10,H10,no,N,29,,28697,15434,OLA
30,,SING,C11,C12,no,N,30,,28697,15434,OLA
31,,SING,C11,H111,no,N,31,,28697,15434,OLA
32,,SING,C11,H112,no,N,32,,28697,15434,OLA
33,,SING,C12,C13,no,N,33,,28697,15434,OLA
34,,SING,C12,H121,no,N,34,,28697,15434,OLA
35,,SING,C12,H122,no,N,35,,28697,15434,OLA
36,,SING,C13,C14,no,N,36,,28697,15434,OLA
37,,SING,C13,H131,no,N,37,,28697,15434,OLA
38,,SING,C13,H132,no,N,38,,28697,15434,OLA
39,,SING,C14,C15,no,N,39,,28697,15434,OLA
40,,SING,C14,H141,no,N,40,,28697,15434,OLA
41,,SING,C14,H142,no,N,41,,28697,15434,OLA
42,,SING,C15,C16,no,N,42,,28697,15434,OLA
43,,SING,C15,H151,no,N,43,,28697,15434,OLA
44,,SING,C15,H152,no,N,44,,28697,15434,OLA
45,,SING,C16,C17,no,N,45,,28697,15434,OLA
46,,SING,C16,H161,no,N,46,,28697,15434,OLA
47,,SING,C16,H162,no,N,47,,28697,15434,OLA
48,,SING,C17,C18,no,N,48,,28697,15434,OLA
49,,SING,C17,H171,no,N,49,,28697,15434,OLA
50,,SING,C17,H172,no,N,50,,28697,15434,OLA
51,,SING,C18,H181,no,N,51,,28697,15434,OLA
52,,SING,C18,H182,no,N,52,,28697,15434,OLA
53,,SING,C18,H183,no,N,53,,28697,15434,OLA
1,,SING,N,CA,no,N,1,,28883,15443,NFA
2,,SING,N,H,no,N,2,,28883,15443,NFA
3,,SING,N,H2,no,N,3,,28883,15443,NFA
4,,SING,CA,C,no,N,4,,28883,15443,NFA
5,,SING,CA,CB,no,N,5,,28883,15443,NFA
6,,SING,CA,HA,no,N,6,,28883,15443,NFA
7,,DOUB,C,O,no,N,7,,28883,15443,NFA
8,,SING,C,NXT,no,N,8,,28883,15443,NFA
9,,SING,CB,CG,no,N,9,,28883,15443,NFA
10,,SING,CB,HB2,no,N,10,,28883,15443,NFA
11,,SING,CB,HB3,no,N,11,,28883,15443,NFA
12,,DOUB,CG,CD1,yes,N,12,,28883,15443,NFA
13,,SING,CG,CD2,yes,N,13,,28883,15443,NFA
14,,SING,CD1,CE1,yes,N,14,,28883,15443,NFA
15,,SING,CD1,HD1,no,N,15,,28883,15443,NFA
16,,DOUB,CD2,CE2,yes,N,16,,28883,15443,NFA
17,,SING,CD2,HD2,no,N,17,,28883,15443,NFA
18,,DOUB,CE1,CZ,yes,N,18,,28883,15443,NFA
19,,SING,CE1,HE1,no,N,19,,28883,15443,NFA
20,,SING,CE2,CZ,yes,N,20,,28883,15443,NFA
21,,SING,CE2,HE2,no,N,21,,28883,15443,NFA
22,,SING,CZ,HZ,no,N,22,,28883,15443,NFA
23,,SING,NXT,HXT1,no,N,23,,28883,15443,NFA
24,,SING,NXT,HXT2,no,N,24,,28883,15443,NFA
1,,SING,N,CA,no,N,1,,28884,15443,ORN
2,,SING,N,H,no,N,2,,28884,15443,ORN
3,,SING,N,H2,no,N,3,,28884,15443,ORN
4,,SING,CA,CB,no,N,4,,28884,15443,ORN
5,,SING,CA,C,no,N,5,,28884,15443,ORN
6,,SING,CA,HA,no,N,6,,28884,15443,ORN
7,,SING,CB,CG,no,N,7,,28884,15443,ORN
8,,SING,CB,HB2,no,N,8,,28884,15443,ORN
9,,SING,CB,HB3,no,N,9,,28884,15443,ORN
10,,SING,CG,CD,no,N,10,,28884,15443,ORN
11,,SING,CG,HG2,no,N,11,,28884,15443,ORN
12,,SING,CG,HG3,no,N,12,,28884,15443,ORN
13,,SING,CD,NE,no,N,13,,28884,15443,ORN
14,,SING,CD,HD2,no,N,14,,28884,15443,ORN
15,,SING,CD,HD3,no,N,15,,28884,15443,ORN
16,,SING,NE,HE1,no,N,16,,28884,15443,ORN
17,,SING,NE,HE2,no,N,17,,28884,15443,ORN
18,,DOUB,C,O,no,N,18,,28884,15443,ORN
19,,SING,C,OXT,no,N,19,,28884,15443,ORN
20,,SING,OXT,HXT,no,N,20,,28884,15443,ORN
1,,SING,C1,C2,no,N,1,,28885,15443,CHA
2,,SING,C1,O1,no,N,2,,28885,15443,CHA
3,,SING,C1,H11,no,N,3,,28885,15443,CHA
4,,SING,C1,H12,no,N,4,,28885,15443,CHA
5,,SING,C2,C3,no,N,5,,28885,15443,CHA
6,,SING,C2,N2,no,N,6,,28885,15443,CHA
7,,SING,C2,H2,no,N,7,,28885,15443,CHA
8,,SING,C3,C1',no,N,8,,28885,15443,CHA
9,,SING,C3,H31,no,N,9,,28885,15443,CHA
10,,SING,C3,H32,no,N,10,,28885,15443,CHA
11,,SING,C1',C2',no,N,11,,28885,15443,CHA
12,,SING,C1',C6',no,N,12,,28885,15443,CHA
13,,SING,C1',H1',no,N,13,,28885,15443,CHA
14,,SING,C2',C3',no,N,14,,28885,15443,CHA
15,,SING,C2',H2'1,no,N,15,,28885,15443,CHA
16,,SING,C2',H2'2,no,N,16,,28885,15443,CHA
17,,SING,C3',C4',no,N,17,,28885,15443,CHA
18,,SING,C3',H3'1,no,N,18,,28885,15443,CHA
19,,SING,C3',H3'2,no,N,19,,28885,15443,CHA
20,,SING,C4',C5',no,N,20,,28885,15443,CHA
21,,SING,C4',H4'1,no,N,21,,28885,15443,CHA
22,,SING,C4',H4'2,no,N,22,,28885,15443,CHA
23,,SING,C5',C6',no,N,23,,28885,15443,CHA
24,,SING,C5',H5'1,no,N,24,,28885,15443,CHA
25,,SING,C5',H5'2,no,N,25,,28885,15443,CHA
26,,SING,C6',H6'1,no,N,26,,28885,15443,CHA
27,,SING,C6',H6'2,no,N,27,,28885,15443,CHA
28,,SING,N2,HN21,no,N,28,,28885,15443,CHA
29,,SING,N2,HN22,no,N,29,,28885,15443,CHA
30,,SING,O1,HO1,no,N,30,,28885,15443,CHA
1,,SING,N,CA,no,N,1,,29122,15454,ALO
2,,SING,N,H,no,N,2,,29122,15454,ALO
3,,SING,N,H2,no,N,3,,29122,15454,ALO
4,,SING,CA,CB,no,N,4,,29122,15454,ALO
5,,SING,CA,C,no,N,5,,29122,15454,ALO
6,,SING,CA,HA,no,N,6,,29122,15454,ALO
7,,SING,CB,CG2,no,N,7,,29122,15454,ALO
8,,SING,CB,OG1,no,N,8,,29122,15454,ALO
9,,SING,CB,HB,no,N,9,,29122,15454,ALO
10,,SING,CG2,HG21,no,N,10,,29122,15454,ALO
11,,SING,CG2,HG22,no,N,11,,29122,15454,ALO
12,,SING,CG2,HG23,no,N,12,,29122,15454,ALO
13,,SING,OG1,HG1,no,N,13,,29122,15454,ALO
14,,DOUB,C,O,no,N,14,,29122,15454,ALO
15,,SING,C,OXT,no,N,15,,29122,15454,ALO
16,,SING,OXT,HXT,no,N,16,,29122,15454,ALO
1,,SING,N,CA,no,N,1,,29147,15455,ABA
2,,SING,N,H,no,N,2,,29147,15455,ABA
3,,SING,N,HN2,no,N,3,,29147,15455,ABA
4,,SING,CA,C,no,N,4,,29147,15455,ABA
5,,SING,CA,CB,no,N,5,,29147,15455,ABA
6,,SING,CA,HA,no,N,6,,29147,15455,ABA
7,,DOUB,C,O,no,N,7,,29147,15455,ABA
8,,SING,C,OXT,no,N,8,,29147,15455,ABA
9,,SING,CB,CG,no,N,9,,29147,15455,ABA
10,,SING,CB,HB3,no,N,10,,29147,15455,ABA
11,,SING,CB,HB2,no,N,11,,29147,15455,ABA
12,,SING,CG,HG1,no,N,12,,29147,15455,ABA
13,,SING,CG,HG3,no,N,13,,29147,15455,ABA
14,,SING,CG,HG2,no,N,14,,29147,15455,ABA
15,,SING,OXT,HXT,no,N,15,,29147,15455,ABA
1,,SING,C1,C2,no,N,1,,29398,15467,BG6
2,,SING,C1,O1,no,N,2,,29398,15467,BG6
3,,SING,C1,O5,no,N,3,,29398,15467,BG6
4,,SING,C1,HC1,no,N,4,,29398,15467,BG6
5,,SING,C2,C3,no,N,5,,29398,15467,BG6
6,,SING,C2,O2,no,N,6,,29398,15467,BG6
7,,SING,C2,HC2,no,N,7,,29398,15467,BG6
8,,SING,O1,HO1,no,N,8,,29398,15467,BG6
9,,SING,O5,C5,no,N,9,,29398,15467,BG6
10,,SING,C3,C4,no,N,10,,29398,15467,BG6
11,,SING,C3,O3,no,N,11,,29398,15467,BG6
12,,SING,C3,HC3,no,N,12,,29398,15467,BG6
13,,SING,O2,HO2,no,N,13,,29398,15467,BG6
14,,SING,C4,C5,no,N,14,,29398,15467,BG6
15,,SING,C4,O4,no,N,15,,29398,15467,BG6
16,,SING,C4,HC4,no,N,16,,29398,15467,BG6
17,,SING,O3,HO3,no,N,17,,29398,15467,BG6
18,,SING,C5,C6,no,N,18,,29398,15467,BG6
19,,SING,C5,HC5,no,N,19,,29398,15467,BG6
20,,SING,O4,HO4,no,N,20,,29398,15467,BG6
21,,SING,C6,O6,no,N,21,,29398,15467,BG6
22,,SING,C6,HC61,no,N,22,,29398,15467,BG6
23,,SING,C6,HC62,no,N,23,,29398,15467,BG6
24,,SING,O6,P,no,N,24,,29398,15467,BG6
25,,SING,P,O1P,no,N,25,,29398,15467,BG6
26,,SING,P,O2P,no,N,26,,29398,15467,BG6
27,,DOUB,P,O3P,no,N,27,,29398,15467,BG6
28,,SING,O1P,H1O1,no,N,28,,29398,15467,BG6
29,,SING,O2P,H2O2,no,N,29,,29398,15467,BG6
1,,SING,AL,F1,no,N,1,,29399,15467,ALF
2,,SING,AL,F2,no,N,2,,29399,15467,ALF
3,,SING,AL,F3,no,N,3,,29399,15467,ALF
4,,SING,AL,F4,no,N,4,,29399,15467,ALF
1,,DOUB,C1,C6,yes,N,1,,29793,15488,STI
2,,SING,C1,C2,yes,N,2,,29793,15488,STI
3,,SING,C1,H11,no,N,3,,29793,15488,STI
4,,SING,C6,C5,yes,N,4,,29793,15488,STI
5,,SING,C6,H61,no,N,5,,29793,15488,STI
6,,DOUB,C5,C4,yes,N,6,,29793,15488,STI
7,,SING,C5,C7,yes,N,7,,29793,15488,STI
8,,SING,C4,N3,yes,N,8,,29793,15488,STI
9,,SING,C4,H41,no,N,9,,29793,15488,STI
10,,DOUB,N3,C2,yes,N,10,,29793,15488,STI
11,,SING,C2,H21,no,N,11,,29793,15488,STI
12,,DOUB,C7,C12,yes,N,12,,29793,15488,STI
13,,SING,C7,N8,yes,N,13,,29793,15488,STI
14,,SING,C12,C11,yes,N,14,,29793,15488,STI
15,,SING,C12,H121,no,N,15,,29793,15488,STI
16,,DOUB,C11,N10,yes,N,16,,29793,15488,STI
17,,SING,C11,H111,no,N,17,,29793,15488,STI
18,,SING,N10,C9,yes,N,18,,29793,15488,STI
19,,DOUB,C9,N8,yes,N,19,,29793,15488,STI
20,,SING,C9,N13,no,N,20,,29793,15488,STI
21,,SING,N13,C14,no,N,21,,29793,15488,STI
22,,SING,N13,H131,no,N,22,,29793,15488,STI
23,,DOUB,C14,C19,yes,N,23,,29793,15488,STI
24,,SING,C14,C15,yes,N,24,,29793,15488,STI
25,,SING,C19,C18,yes,N,25,,29793,15488,STI
26,,SING,C19,C20,no,N,26,,29793,15488,STI
27,,DOUB,C18,C17,yes,N,27,,29793,15488,STI
28,,SING,C18,H181,no,N,28,,29793,15488,STI
29,,SING,C17,C16,yes,N,29,,29793,15488,STI
30,,SING,C17,H171,no,N,30,,29793,15488,STI
31,,DOUB,C16,C15,yes,N,31,,29793,15488,STI
32,,SING,C16,N21,no,N,32,,29793,15488,STI
33,,SING,C15,H151,no,N,33,,29793,15488,STI
34,,SING,N21,C22,no,N,34,,29793,15488,STI
35,,SING,N21,H211,no,N,35,,29793,15488,STI
36,,SING,C22,C23,no,N,36,,29793,15488,STI
37,,DOUB,C22,O29,no,N,37,,29793,15488,STI
38,,DOUB,C23,C25,yes,N,38,,29793,15488,STI
39,,SING,C23,C29,yes,N,39,,29793,15488,STI
40,,SING,C25,C26,yes,N,40,,29793,15488,STI
41,,SING,C25,H251,no,N,41,,29793,15488,STI
42,,DOUB,C26,C27,yes,N,42,,29793,15488,STI
43,,SING,C26,H261,no,N,43,,29793,15488,STI
44,,SING,C27,C28,yes,N,44,,29793,15488,STI
45,,SING,C27,C46,no,N,45,,29793,15488,STI
46,,DOUB,C28,C29,yes,N,46,,29793,15488,STI
47,,SING,C28,H281,no,N,47,,29793,15488,STI
48,,SING,C29,H291,no,N,48,,29793,15488,STI
49,,SING,C46,N48,no,N,49,,29793,15488,STI
50,,SING,C46,H461,no,N,50,,29793,15488,STI
51,,SING,C46,H462,no,N,51,,29793,15488,STI
52,,SING,N48,C53,no,N,52,,29793,15488,STI
53,,SING,N48,C49,no,N,53,,29793,15488,STI
54,,SING,C53,C52,no,N,54,,29793,15488,STI
55,,SING,C53,H531,no,N,55,,29793,15488,STI
56,,SING,C53,H532,no,N,56,,29793,15488,STI
57,,SING,C52,N51,no,N,57,,29793,15488,STI
58,,SING,C52,H521,no,N,58,,29793,15488,STI
59,,SING,C52,H522,no,N,59,,29793,15488,STI
60,,SING,N51,C54,no,N,60,,29793,15488,STI
61,,SING,N51,C50,no,N,61,,29793,15488,STI
62,,SING,C54,H541,no,N,62,,29793,15488,STI
63,,SING,C54,H542,no,N,63,,29793,15488,STI
64,,SING,C54,H543,no,N,64,,29793,15488,STI
65,,SING,C50,C49,no,N,65,,29793,15488,STI
66,,SING,C50,H501,no,N,66,,29793,15488,STI
67,,SING,C50,H502,no,N,67,,29793,15488,STI
68,,SING,C49,H491,no,N,68,,29793,15488,STI
69,,SING,C49,H492,no,N,69,,29793,15488,STI
70,,SING,C20,H201,no,N,70,,29793,15488,STI
71,,SING,C20,H202,no,N,71,,29793,15488,STI
72,,SING,C20,H203,no,N,72,,29793,15488,STI
1,,SING,N,CA,,,,,29819,15489,AYA
2,,SING,N,CT,,,,,29819,15489,AYA
3,,SING,N,HN,,,,,29819,15489,AYA
4,,SING,CA,CB,,,,,29819,15489,AYA
5,,SING,CA,C,,,,,29819,15489,AYA
6,,SING,CA,HA,,,,,29819,15489,AYA
7,,SING,CB,HB1,,,,,29819,15489,AYA
8,,SING,CB,HB2,,,,,29819,15489,AYA
9,,SING,CB,HB3,,,,,29819,15489,AYA
10,,DOUB,C,O,,,,,29819,15489,AYA
11,,SING,C,OXT,,,,,29819,15489,AYA
12,,SING,OXT,HXT,,,,,29819,15489,AYA
13,,DOUB,CT,OT,,,,,29819,15489,AYA
14,,SING,CT,CM,,,,,29819,15489,AYA
15,,SING,CM,HM1,,,,,29819,15489,AYA
16,,SING,CM,HM2,,,,,29819,15489,AYA
17,,SING,CM,HM3,,,,,29819,15489,AYA
1,,SING,N1,C2,yes,N,1,,29881,15492,HWD
2,,SING,N1,C6,yes,N,2,,29881,15492,HWD
3,,SING,N1,C7,no,N,3,,29881,15492,HWD
4,,DOUB,C2,O2,no,N,4,,29881,15492,HWD
5,,SING,C2,N3,yes,N,5,,29881,15492,HWD
6,,SING,N3,C4,yes,N,6,,29881,15492,HWD
7,,SING,N3,H3,no,N,7,,29881,15492,HWD
8,,DOUB,C4,O4,no,N,8,,29881,15492,HWD
9,,SING,C4,C5,yes,N,9,,29881,15492,HWD
10,,DOUB,C5,C6,yes,N,10,,29881,15492,HWD
11,,SING,C5,H5,no,N,11,,29881,15492,HWD
12,,SING,C6,H6,no,N,12,,29881,15492,HWD
13,,SING,C7,C8,no,N,13,,29881,15492,HWD
14,,SING,C7,H71,no,N,14,,29881,15492,HWD
15,,SING,C7,H72,no,N,15,,29881,15492,HWD
16,,SING,C8,N8,no,N,16,,29881,15492,HWD
17,,SING,C8,C9,no,N,17,,29881,15492,HWD
18,,SING,C8,H8,no,N,18,,29881,15492,HWD
19,,SING,N8,H81,no,N,19,,29881,15492,HWD
20,,SING,N8,H82,no,N,20,,29881,15492,HWD
21,,DOUB,C9,O91,no,N,21,,29881,15492,HWD
22,,SING,C9,O92,no,N,22,,29881,15492,HWD
23,,SING,O92,H92O,no,N,23,,29881,15492,HWD
1,,SING,N1,C2,,,,,29898,15493,FWD
2,,SING,N1,C6,,,,,29898,15493,FWD
3,,SING,N1,C7,,,,,29898,15493,FWD
4,,DOUB,C2,O2,,,,,29898,15493,FWD
5,,SING,C2,N3,,,,,29898,15493,FWD
6,,SING,N3,C4,,,,,29898,15493,FWD
7,,SING,N3,H3,,,,,29898,15493,FWD
8,,DOUB,C4,O4,,,,,29898,15493,FWD
9,,SING,C4,C5,,,,,29898,15493,FWD
10,,SING,C5,F5,,,,,29898,15493,FWD
11,,DOUB,C5,C6,,,,,29898,15493,FWD
12,,SING,C6,H6,,,,,29898,15493,FWD
13,,SING,C7,C8,,,,,29898,15493,FWD
14,,SING,C7,H71,,,,,29898,15493,FWD
15,,SING,C7,H72,,,,,29898,15493,FWD
16,,SING,C8,N8,,,,,29898,15493,FWD
17,,SING,C8,C9,,,,,29898,15493,FWD
18,,SING,C8,H8,,,,,29898,15493,FWD
19,,SING,N8,H81,,,,,29898,15493,FWD
20,,SING,N8,H82,,,,,29898,15493,FWD
21,,DOUB,C9,O91,,,,,29898,15493,FWD
22,,SING,C9,O92,,,,,29898,15493,FWD
23,,SING,O92,H92O,,,,,29898,15493,FWD
1,,SING,N1,C2,,,,,29915,15494,BWD
2,,SING,N1,C6,,,,,29915,15494,BWD
3,,SING,N1,C7,,,,,29915,15494,BWD
4,,DOUB,C2,O2,,,,,29915,15494,BWD
5,,SING,C2,N3,,,,,29915,15494,BWD
6,,SING,N3,C4,,,,,29915,15494,BWD
7,,SING,N3,H3,,,,,29915,15494,BWD
8,,DOUB,C4,O4,,,,,29915,15494,BWD
9,,SING,C4,C5,,,,,29915,15494,BWD
10,,SING,C5,BR5,,,,,29915,15494,BWD
11,,DOUB,C5,C6,,,,,29915,15494,BWD
12,,SING,C6,H6,,,,,29915,15494,BWD
13,,SING,C7,C8,,,,,29915,15494,BWD
14,,SING,C7,H71,,,,,29915,15494,BWD
15,,SING,C7,H72,,,,,29915,15494,BWD
16,,SING,C8,N8,,,,,29915,15494,BWD
17,,SING,C8,C9,,,,,29915,15494,BWD
18,,SING,C8,H8,,,,,29915,15494,BWD
19,,SING,N8,H81,,,,,29915,15494,BWD
20,,SING,N8,H82,,,,,29915,15494,BWD
21,,DOUB,C9,O91,,,,,29915,15494,BWD
22,,SING,C9,O92,,,,,29915,15494,BWD
23,,SING,O92,H92O,,,,,29915,15494,BWD
1,,SING,N1,C2,,,,,29932,15495,IWD
2,,SING,N1,C6,,,,,29932,15495,IWD
3,,SING,N1,C7,,,,,29932,15495,IWD
4,,DOUB,C2,O2,,,,,29932,15495,IWD
5,,SING,C2,N3,,,,,29932,15495,IWD
6,,SING,N3,C4,,,,,29932,15495,IWD
7,,SING,N3,H3,,,,,29932,15495,IWD
8,,DOUB,C4,O4,,,,,29932,15495,IWD
9,,SING,C4,C5,,,,,29932,15495,IWD
10,,SING,C5,I5,,,,,29932,15495,IWD
11,,DOUB,C5,C6,,,,,29932,15495,IWD
12,,SING,C6,H6,,,,,29932,15495,IWD
13,,SING,C7,C8,,,,,29932,15495,IWD
14,,SING,C7,H71,,,,,29932,15495,IWD
15,,SING,C7,H72,,,,,29932,15495,IWD
16,,SING,C8,N8,,,,,29932,15495,IWD
17,,SING,C8,C9,,,,,29932,15495,IWD
18,,SING,C8,H8,,,,,29932,15495,IWD
19,,SING,N8,H81,,,,,29932,15495,IWD
20,,SING,N8,H82,,,,,29932,15495,IWD
21,,DOUB,C9,O91,,,,,29932,15495,IWD
22,,SING,C9,O92,,,,,29932,15495,IWD
23,,SING,O92,H92O,,,,,29932,15495,IWD
1,,SING,N,CD,,,,,29949,15496,KAI
2,,SING,N,CA,,,,,29949,15496,KAI
3,,SING,N,HN1,,,,,29949,15496,KAI
4,,SING,CD,CG,,,,,29949,15496,KAI
5,,SING,CD,HD1,,,,,29949,15496,KAI
6,,SING,CD,HD2,,,,,29949,15496,KAI
7,,SING,CD1,CG2,,,,,29949,15496,KAI
8,,SING,CD1,HD11,,,,,29949,15496,KAI
9,,SING,CD1,HD12,,,,,29949,15496,KAI
10,,SING,CD1,HD13,,,,,29949,15496,KAI
11,,SING,CD2,CG2,,,,,29949,15496,KAI
12,,SING,CD2,HD21,,,,,29949,15496,KAI
13,,SING,CD2,HD22,,,,,29949,15496,KAI
14,,SING,CD2,HD23,,,,,29949,15496,KAI
15,,SING,CA,CB,,,,,29949,15496,KAI
16,,SING,CA,C,,,,,29949,15496,KAI
17,,SING,CA,HA,,,,,29949,15496,KAI
18,,SING,CB,CB1,,,,,29949,15496,KAI
19,,SING,CB,CG,,,,,29949,15496,KAI
20,,SING,CB,HB,,,,,29949,15496,KAI
21,,SING,CB1,CG1,,,,,29949,15496,KAI
22,,SING,CB1,HB11,,,,,29949,15496,KAI
23,,SING,CB1,HB12,,,,,29949,15496,KAI
24,,SING,CG,CG2,,,,,29949,15496,KAI
25,,SING,CG,HG,,,,,29949,15496,KAI
26,,SING,CG1,OD1,,,,,29949,15496,KAI
27,,DOUB,CG1,OD2,,,,,29949,15496,KAI
28,,SING,CG2,HG2,,,,,29949,15496,KAI
29,,DOUB,C,O,,,,,29949,15496,KAI
30,,SING,C,OXT,,,,,29949,15496,KAI
31,,SING,OD1,HOD1,,,,,29949,15496,KAI
32,,SING,OXT,HXT,,,,,29949,15496,KAI
1,,DOUB,C,O,no,N,1,,30085,15504,ACE
2,,SING,C,CH3,no,N,2,,30085,15504,ACE
3,,SING,C,H,no,N,3,,30085,15504,ACE
4,,SING,CH3,H1,no,N,4,,30085,15504,ACE
5,,SING,CH3,H2,no,N,5,,30085,15504,ACE
6,,SING,CH3,H3,no,N,6,,30085,15504,ACE
1,,SING,C1,O1,no,N,1,,30134,15507,RAP
2,,DOUB,C1,O2,no,N,2,,30134,15507,RAP
3,,SING,C1,C2,no,N,3,,30134,15507,RAP
4,,SING,O1,C34,no,N,4,,30134,15507,RAP
5,,SING,C2,C3,no,N,5,,30134,15507,RAP
6,,SING,C2,N7,no,N,6,,30134,15507,RAP
7,,SING,C2,H2,no,N,7,,30134,15507,RAP
8,,SING,C3,C4,no,N,8,,30134,15507,RAP
9,,SING,C3,H31A,no,N,9,,30134,15507,RAP
10,,SING,C3,H32,no,N,10,,30134,15507,RAP
11,,SING,C4,C5,no,N,11,,30134,15507,RAP
12,,SING,C4,H41,no,N,12,,30134,15507,RAP
13,,SING,C4,H42,no,N,13,,30134,15507,RAP
14,,SING,C5,C6,no,N,14,,30134,15507,RAP
15,,SING,C5,H51,no,N,15,,30134,15507,RAP
16,,SING,C5,H52,no,N,16,,30134,15507,RAP
17,,SING,C6,N7,no,N,17,,30134,15507,RAP
18,,SING,C6,H61,no,N,18,,30134,15507,RAP
19,,SING,C6,H62,no,N,19,,30134,15507,RAP
20,,SING,N7,C8,no,N,20,,30134,15507,RAP
21,,DOUB,C8,O3,no,N,21,,30134,15507,RAP
22,,SING,C8,C9,no,N,22,,30134,15507,RAP
23,,DOUB,C9,O4,no,N,23,,30134,15507,RAP
24,,SING,C9,C10,no,N,24,,30134,15507,RAP
25,,SING,C10,O5,no,N,25,,30134,15507,RAP
26,,SING,C10,O6,no,N,26,,30134,15507,RAP
27,,SING,C10,C11,no,N,27,,30134,15507,RAP
28,,SING,O5,C14,no,N,28,,30134,15507,RAP
29,,SING,O6,HO6,no,N,29,,30134,15507,RAP
30,,SING,C11,C12,no,N,30,,30134,15507,RAP
31,,SING,C11,C43,no,N,31,,30134,15507,RAP
32,,SING,C11,H11,no,N,32,,30134,15507,RAP
33,,SING,C12,C13,no,N,33,,30134,15507,RAP
34,,SING,C12,H121,no,N,34,,30134,15507,RAP
35,,SING,C12,H122,no,N,35,,30134,15507,RAP
36,,SING,C13,C14,no,N,36,,30134,15507,RAP
37,,SING,C13,H131,no,N,37,,30134,15507,RAP
38,,SING,C13,H132,no,N,38,,30134,15507,RAP
39,,SING,C14,C15,no,N,39,,30134,15507,RAP
40,,SING,C14,H14,no,N,40,,30134,15507,RAP
41,,SING,C15,C16,no,N,41,,30134,15507,RAP
42,,SING,C15,H151,no,N,42,,30134,15507,RAP
43,,SING,C15,H152,no,N,43,,30134,15507,RAP
44,,SING,C16,O7,no,N,44,,30134,15507,RAP
45,,SING,C16,C17,no,N,45,,30134,15507,RAP
46,,SING,C16,H16,no,N,46,,30134,15507,RAP
47,,SING,O7,C50,no,N,47,,30134,15507,RAP
48,,DOUB,C17,C18,no,E,48,,30134,15507,RAP
49,,SING,C17,C44,no,N,49,,30134,15507,RAP
50,,SING,C18,C19,no,N,50,,30134,15507,RAP
51,,SING,C18,H18,no,N,51,,30134,15507,RAP
52,,DOUB,C19,C20,no,E,52,,30134,15507,RAP
53,,SING,C19,H19,no,N,53,,30134,15507,RAP
54,,SING,C20,C21,no,N,54,,30134,15507,RAP
55,,SING,C20,H20,no,N,55,,30134,15507,RAP
56,,DOUB,C21,C22,no,E,56,,30134,15507,RAP
57,,SING,C21,H21,no,N,57,,30134,15507,RAP
58,,SING,C22,C23,no,N,58,,30134,15507,RAP
59,,SING,C22,H22,no,N,59,,30134,15507,RAP
60,,SING,C23,C24,no,N,60,,30134,15507,RAP
61,,SING,C23,C45,no,N,61,,30134,15507,RAP
62,,SING,C23,H23,no,N,62,,30134,15507,RAP
63,,SING,C24,C25,no,N,63,,30134,15507,RAP
64,,SING,C24,H241,no,N,64,,30134,15507,RAP
65,,SING,C24,H242,no,N,65,,30134,15507,RAP
66,,SING,C25,C26,no,N,66,,30134,15507,RAP
67,,SING,C25,C46,no,N,67,,30134,15507,RAP
68,,SING,C25,H25,no,N,68,,30134,15507,RAP
69,,DOUB,C26,O8,no,N,69,,30134,15507,RAP
70,,SING,C26,C27,no,N,70,,30134,15507,RAP
71,,SING,C27,O9,no,N,71,,30134,15507,RAP
72,,SING,C27,C28,no,N,72,,30134,15507,RAP
73,,SING,C27,H27,no,N,73,,30134,15507,RAP
74,,SING,O9,C51,no,N,74,,30134,15507,RAP
75,,SING,C28,O10,no,N,75,,30134,15507,RAP
76,,SING,C28,C29,no,N,76,,30134,15507,RAP
77,,SING,C28,H28,no,N,77,,30134,15507,RAP
78,,SING,O10,HO1,no,N,78,,30134,15507,RAP
79,,DOUB,C29,C30,no,E,79,,30134,15507,RAP
80,,SING,C29,C47,no,N,80,,30134,15507,RAP
81,,SING,C30,C31,no,N,81,,30134,15507,RAP
82,,SING,C30,H30,no,N,82,,30134,15507,RAP
83,,SING,C31,C32,no,N,83,,30134,15507,RAP
84,,SING,C31,C48,no,N,84,,30134,15507,RAP
85,,SING,C31,H31,no,N,85,,30134,15507,RAP
86,,DOUB,C32,O11,no,N,86,,30134,15507,RAP
87,,SING,C32,C33,no,N,87,,30134,15507,RAP
88,,SING,C33,C34,no,N,88,,30134,15507,RAP
89,,SING,C33,H331,no,N,89,,30134,15507,RAP
90,,SING,C33,H332,no,N,90,,30134,15507,RAP
91,,SING,C34,C35,no,N,91,,30134,15507,RAP
92,,SING,C34,H34,no,N,92,,30134,15507,RAP
93,,SING,C35,C36,no,N,93,,30134,15507,RAP
94,,SING,C35,C49,no,N,94,,30134,15507,RAP
95,,SING,C35,H35,no,N,95,,30134,15507,RAP
96,,SING,C36,C37,no,N,96,,30134,15507,RAP
97,,SING,C36,H361,no,N,97,,30134,15507,RAP
98,,SING,C36,H362,no,N,98,,30134,15507,RAP
99,,SING,C37,C38,no,N,99,,30134,15507,RAP
100,,SING,C37,C42,no,N,100,,30134,15507,RAP
101,,SING,C37,H37,no,N,101,,30134,15507,RAP
102,,SING,C38,C39,no,N,102,,30134,15507,RAP
103,,SING,C38,H381,no,N,103,,30134,15507,RAP
104,,SING,C38,H382,no,N,104,,30134,15507,RAP
105,,SING,C39,O12,no,N,105,,30134,15507,RAP
106,,SING,C39,C40,no,N,106,,30134,15507,RAP
107,,SING,C39,H39,no,N,107,,30134,15507,RAP
108,,SING,O12,C52,no,N,108,,30134,15507,RAP
109,,SING,C40,O13,no,N,109,,30134,15507,RAP
110,,SING,C40,C41,no,N,110,,30134,15507,RAP
111,,SING,C40,H40,no,N,111,,30134,15507,RAP
112,,SING,O13,HO3,no,N,112,,30134,15507,RAP
113,,SING,C41,C42,no,N,113,,30134,15507,RAP
114,,SING,C41,H411,no,N,114,,30134,15507,RAP
115,,SING,C41,H412,no,N,115,,30134,15507,RAP
116,,SING,C42,H421,no,N,116,,30134,15507,RAP
117,,SING,C42,H422,no,N,117,,30134,15507,RAP
118,,SING,C43,H431,no,N,118,,30134,15507,RAP
119,,SING,C43,H432,no,N,119,,30134,15507,RAP
120,,SING,C43,H433,no,N,120,,30134,15507,RAP
121,,SING,C44,H441,no,N,121,,30134,15507,RAP
122,,SING,C44,H442,no,N,122,,30134,15507,RAP
123,,SING,C44,H443,no,N,123,,30134,15507,RAP
124,,SING,C45,H451,no,N,124,,30134,15507,RAP
125,,SING,C45,H452,no,N,125,,30134,15507,RAP
126,,SING,C45,H453,no,N,126,,30134,15507,RAP
127,,SING,C46,H461,no,N,127,,30134,15507,RAP
128,,SING,C46,H462,no,N,128,,30134,15507,RAP
129,,SING,C46,H463,no,N,129,,30134,15507,RAP
130,,SING,C47,H471,no,N,130,,30134,15507,RAP
131,,SING,C47,H472,no,N,131,,30134,15507,RAP
132,,SING,C47,H473,no,N,132,,30134,15507,RAP
133,,SING,C48,H481,no,N,133,,30134,15507,RAP
134,,SING,C48,H482,no,N,134,,30134,15507,RAP
135,,SING,C48,H483,no,N,135,,30134,15507,RAP
136,,SING,C49,H491,no,N,136,,30134,15507,RAP
137,,SING,C49,H492,no,N,137,,30134,15507,RAP
138,,SING,C49,H493,no,N,138,,30134,15507,RAP
139,,SING,C50,H501,no,N,139,,30134,15507,RAP
140,,SING,C50,H502,no,N,140,,30134,15507,RAP
141,,SING,C50,H503,no,N,141,,30134,15507,RAP
142,,SING,C51,H511,no,N,142,,30134,15507,RAP
143,,SING,C51,H512,no,N,143,,30134,15507,RAP
144,,SING,C51,H513,no,N,144,,30134,15507,RAP
145,,SING,C52,H521,no,N,145,,30134,15507,RAP
146,,SING,C52,H522,no,N,146,,30134,15507,RAP
147,,SING,C52,H523,no,N,147,,30134,15507,RAP
1,,DOUB,C1,O1,,,,,30285,15515,DKA
2,,SING,C1,C2,,,,,30285,15515,DKA
3,,SING,C1,O2,,,,,30285,15515,DKA
4,,SING,C2,C3,,,,,30285,15515,DKA
5,,SING,C2,H21,,,,,30285,15515,DKA
6,,SING,C2,H22,,,,,30285,15515,DKA
7,,SING,C3,C4,,,,,30285,15515,DKA
8,,SING,C3,H31,,,,,30285,15515,DKA
9,,SING,C3,H32,,,,,30285,15515,DKA
10,,SING,C4,C5,,,,,30285,15515,DKA
11,,SING,C4,H41,,,,,30285,15515,DKA
12,,SING,C4,H42,,,,,30285,15515,DKA
13,,SING,C5,C6,,,,,30285,15515,DKA
14,,SING,C5,H51,,,,,30285,15515,DKA
15,,SING,C5,H52,,,,,30285,15515,DKA
16,,SING,C6,C7,,,,,30285,15515,DKA
17,,SING,C6,H61,,,,,30285,15515,DKA
18,,SING,C6,H62,,,,,30285,15515,DKA
19,,SING,C7,C8,,,,,30285,15515,DKA
20,,SING,C7,H71,,,,,30285,15515,DKA
21,,SING,C7,H72,,,,,30285,15515,DKA
22,,SING,C8,C9,,,,,30285,15515,DKA
23,,SING,C8,H81,,,,,30285,15515,DKA
24,,SING,C8,H82,,,,,30285,15515,DKA
25,,SING,C9,C10,,,,,30285,15515,DKA
26,,SING,C9,H91,,,,,30285,15515,DKA
27,,SING,C9,H92,,,,,30285,15515,DKA
28,,SING,C10,H101,,,,,30285,15515,DKA
29,,SING,C10,H102,,,,,30285,15515,DKA
30,,SING,C10,H103,,,,,30285,15515,DKA
31,,SING,O2,HO2,,,,,30285,15515,DKA
1,,SING,N,CA,,,,,30286,15515,DSG
2,,SING,N,H,,,,,30286,15515,DSG
3,,SING,N,HN2,,,,,30286,15515,DSG
4,,SING,CA,C,,,,,30286,15515,DSG
5,,SING,CA,CB,,,,,30286,15515,DSG
6,,SING,CA,HA,,,,,30286,15515,DSG
7,,DOUB,C,O,,,,,30286,15515,DSG
8,,SING,C,OXT,,,,,30286,15515,DSG
9,,SING,CB,CG,,,,,30286,15515,DSG
10,,SING,CB,HB1,,,,,30286,15515,DSG
11,,SING,CB,HB2,,,,,30286,15515,DSG
12,,DOUB,CG,OD1,,,,,30286,15515,DSG
13,,SING,CG,ND2,,,,,30286,15515,DSG
14,,SING,ND2,HD21,,,,,30286,15515,DSG
15,,SING,ND2,HD22,,,,,30286,15515,DSG
16,,SING,OXT,HXT,,,,,30286,15515,DSG
1,,SING,N,CA,,,,,30287,15515,ORN
2,,SING,N,HN1,,,,,30287,15515,ORN
3,,SING,N,HN2,,,,,30287,15515,ORN
4,,SING,N,HN3,,,,,30287,15515,ORN
5,,SING,CA,CB,,,,,30287,15515,ORN
6,,SING,CA,C,,,,,30287,15515,ORN
7,,SING,CA,HA,,,,,30287,15515,ORN
8,,SING,CB,CG,,,,,30287,15515,ORN
9,,SING,CB,HB1,,,,,30287,15515,ORN
10,,SING,CB,HB2,,,,,30287,15515,ORN
11,,SING,CG,CD,,,,,30287,15515,ORN
12,,SING,CG,HG1,,,,,30287,15515,ORN
13,,SING,CG,HG2,,,,,30287,15515,ORN
14,,SING,CD,NE,,,,,30287,15515,ORN
15,,SING,CD,HD1,,,,,30287,15515,ORN
16,,SING,CD,HD2,,,,,30287,15515,ORN
17,,SING,NE,HNE1,,,,,30287,15515,ORN
18,,SING,NE,HNE2,,,,,30287,15515,ORN
19,,SING,NE,HNE3,,,,,30287,15515,ORN
20,,DOUB,C,O,,,,,30287,15515,ORN
21,,SING,C,OXT,,,,,30287,15515,ORN
22,,SING,OXT,HXT,,,,,30287,15515,ORN
1,,SING,N,CA,,,,,30288,15515,DAL
2,,SING,N,H,,,,,30288,15515,DAL
3,,SING,N,HN2,,,,,30288,15515,DAL
4,,SING,CA,CB,,,,,30288,15515,DAL
5,,SING,CA,C,,,,,30288,15515,DAL
6,,SING,CA,HA,,,,,30288,15515,DAL
7,,SING,CB,HB1,,,,,30288,15515,DAL
8,,SING,CB,HB2,,,,,30288,15515,DAL
9,,SING,CB,HB3,,,,,30288,15515,DAL
10,,DOUB,C,O,,,,,30288,15515,DAL
11,,SING,C,OXT,,,,,30288,15515,DAL
12,,SING,OXT,HXT,,,,,30288,15515,DAL
1,,SING,N,CA,,,,,30289,15515,DSN
2,,SING,N,H,,,,,30289,15515,DSN
3,,SING,N,HN2,,,,,30289,15515,DSN
4,,SING,CA,C,,,,,30289,15515,DSN
5,,SING,CA,CB,,,,,30289,15515,DSN
6,,SING,CA,HA,,,,,30289,15515,DSN
7,,DOUB,C,O,,,,,30289,15515,DSN
8,,SING,C,OXT,,,,,30289,15515,DSN
9,,SING,OXT,HXT,,,,,30289,15515,DSN
10,,SING,CB,OG,,,,,30289,15515,DSN
11,,SING,CB,HB1,,,,,30289,15515,DSN
12,,SING,CB,HB2,,,,,30289,15515,DSN
13,,SING,OG,HOG,,,,,30289,15515,DSN
1,,SING,N,CA,,,,,30290,15515,MEG
2,,SING,N,H,,,,,30290,15515,MEG
3,,SING,N,HN2,,,,,30290,15515,MEG
4,,SING,CA,CB,,,,,30290,15515,MEG
5,,SING,CA,C,,,,,30290,15515,MEG
6,,SING,CA,HA,,,,,30290,15515,MEG
7,,SING,CB,CG,,,,,30290,15515,MEG
8,,SING,CB,C1,,,,,30290,15515,MEG
9,,SING,CB,HB,,,,,30290,15515,MEG
10,,SING,CG,CD,,,,,30290,15515,MEG
11,,SING,CG,HG1,,,,,30290,15515,MEG
12,,SING,CG,HG2,,,,,30290,15515,MEG
13,,DOUB,CD,OE1,,,,,30290,15515,MEG
14,,SING,CD,OE2,,,,,30290,15515,MEG
15,,DOUB,C,O,,,,,30290,15515,MEG
16,,SING,C,OXT,,,,,30290,15515,MEG
17,,SING,OXT,HXT,,,,,30290,15515,MEG
18,,SING,C1,H11,,,,,30290,15515,MEG
19,,SING,C1,H12,,,,,30290,15515,MEG
20,,SING,C1,H13,,,,,30290,15515,MEG
21,,SING,HO1,OE2,,,,,30290,15515,MEG
1,,SING,N,CA,,,,,30291,15515,KYN
2,,SING,N,H,,,,,30291,15515,KYN
3,,SING,N,HN2,,,,,30291,15515,KYN
4,,SING,CA,CB,,,,,30291,15515,KYN
5,,SING,CA,C,,,,,30291,15515,KYN
6,,SING,CA,HA,,,,,30291,15515,KYN
7,,SING,CB,C1,,,,,30291,15515,KYN
8,,SING,CB,HB1,,,,,30291,15515,KYN
9,,SING,CB,HB2,,,,,30291,15515,KYN
10,,DOUB,CG,CD1,,,,,30291,15515,KYN
11,,SING,CG,CD2,,,,,30291,15515,KYN
12,,SING,CG,N1,,,,,30291,15515,KYN
13,,SING,CD1,CE1,,,,,30291,15515,KYN
14,,SING,CD1,HD1,,,,,30291,15515,KYN
15,,DOUB,CE1,CZ,,,,,30291,15515,KYN
16,,SING,CE1,HE1,,,,,30291,15515,KYN
17,,SING,CZ,CE2,,,,,30291,15515,KYN
18,,SING,CZ,HZ,,,,,30291,15515,KYN
19,,DOUB,CE2,CD2,,,,,30291,15515,KYN
20,,SING,CE2,HE2,,,,,30291,15515,KYN
21,,SING,CD2,C1,,,,,30291,15515,KYN
22,,DOUB,C,O,,,,,30291,15515,KYN
23,,SING,C,OXT,,,,,30291,15515,KYN
24,,SING,OXT,HXT,,,,,30291,15515,KYN
25,,DOUB,C1,O2,,,,,30291,15515,KYN
26,,SING,N1,H11,,,,,30291,15515,KYN
27,,SING,N1,H12,,,,,30291,15515,KYN
1,,DOUB,PG,O1G,no,N,1,,30446,15525,GNP
2,,SING,PG,O2G,no,N,2,,30446,15525,GNP
3,,SING,PG,O3G,no,N,3,,30446,15525,GNP
4,,SING,PG,N3B,no,N,4,,30446,15525,GNP
5,,SING,O2G,HOG2,no,N,5,,30446,15525,GNP
6,,SING,O3G,HOG3,no,N,6,,30446,15525,GNP
7,,SING,N3B,PB,no,N,7,,30446,15525,GNP
8,,SING,N3B,HNB3,no,N,8,,30446,15525,GNP
9,,DOUB,PB,O1B,no,N,9,,30446,15525,GNP
10,,SING,PB,O2B,no,N,10,,30446,15525,GNP
11,,SING,PB,O3A,no,N,11,,30446,15525,GNP
12,,SING,O2B,HOB2,no,N,12,,30446,15525,GNP
13,,SING,O3A,PA,no,N,13,,30446,15525,GNP
14,,DOUB,PA,O1A,no,N,14,,30446,15525,GNP
15,,SING,PA,O2A,no,N,15,,30446,15525,GNP
16,,SING,PA,O5',no,N,16,,30446,15525,GNP
17,,SING,O2A,HOA2,no,N,17,,30446,15525,GNP
18,,SING,O5',C5',no,N,18,,30446,15525,GNP
19,,SING,C5',C4',no,N,19,,30446,15525,GNP
20,,SING,C5',H5'2,no,N,20,,30446,15525,GNP
21,,SING,C5',H5'1,no,N,21,,30446,15525,GNP
22,,SING,C4',O4',no,N,22,,30446,15525,GNP
23,,SING,C4',C3',no,N,23,,30446,15525,GNP
24,,SING,C4',H4',no,N,24,,30446,15525,GNP
25,,SING,O4',C1',no,N,25,,30446,15525,GNP
26,,SING,C3',O3',no,N,26,,30446,15525,GNP
27,,SING,C3',C2',no,N,27,,30446,15525,GNP
28,,SING,C3',H3',no,N,28,,30446,15525,GNP
29,,SING,O3',HO3',no,N,29,,30446,15525,GNP
30,,SING,C2',O2',no,N,30,,30446,15525,GNP
31,,SING,C2',C1',no,N,31,,30446,15525,GNP
32,,SING,C2',H2',no,N,32,,30446,15525,GNP
33,,SING,O2',HO2',no,N,33,,30446,15525,GNP
34,,SING,C1',N9,no,N,34,,30446,15525,GNP
35,,SING,C1',H1',no,N,35,,30446,15525,GNP
36,,SING,N9,C8,yes,N,36,,30446,15525,GNP
37,,SING,N9,C4,yes,N,37,,30446,15525,GNP
38,,DOUB,C8,N7,yes,N,38,,30446,15525,GNP
39,,SING,C8,H8,no,N,39,,30446,15525,GNP
40,,SING,N7,C5,yes,N,40,,30446,15525,GNP
41,,SING,C5,C6,yes,N,41,,30446,15525,GNP
42,,DOUB,C5,C4,yes,N,42,,30446,15525,GNP
43,,DOUB,C6,O6,no,N,43,,30446,15525,GNP
44,,SING,C6,N1,yes,N,44,,30446,15525,GNP
45,,SING,N1,C2,yes,N,45,,30446,15525,GNP
46,,SING,N1,HN1,no,N,46,,30446,15525,GNP
47,,SING,C2,N2,no,N,47,,30446,15525,GNP
48,,DOUB,C2,N3,yes,N,48,,30446,15525,GNP
49,,SING,N2,HN21,no,N,49,,30446,15525,GNP
50,,SING,N2,HN22,no,N,50,,30446,15525,GNP
51,,SING,N3,C4,yes,N,51,,30446,15525,GNP
1,,SING,O,H1,no,N,1,,30448,15525,HOH
2,,SING,O,H2,no,N,2,,30448,15525,HOH
1,,DOUB,C1,O1,,,,,30877,15546,UQ8
2,,SING,C1,C2,,,,,30877,15546,UQ8
3,,SING,C1,C6,,,,,30877,15546,UQ8
4,,SING,C2,O2,,,,,30877,15546,UQ8
5,,DOUB,C2,C3,,,,,30877,15546,UQ8
6,,SING,O2,CM2,,,,,30877,15546,UQ8
7,,SING,CM2,HM21,,,,,30877,15546,UQ8
8,,SING,CM2,HM22,,,,,30877,15546,UQ8
9,,SING,CM2,HM23,,,,,30877,15546,UQ8
10,,SING,C3,O3,,,,,30877,15546,UQ8
11,,SING,C3,C4,,,,,30877,15546,UQ8
12,,SING,O3,CM3,,,,,30877,15546,UQ8
13,,SING,CM3,HM31,,,,,30877,15546,UQ8
14,,SING,CM3,HM32,,,,,30877,15546,UQ8
15,,SING,CM3,HM33,,,,,30877,15546,UQ8
16,,DOUB,C4,O4,,,,,30877,15546,UQ8
17,,SING,C4,C5,,,,,30877,15546,UQ8
18,,SING,C5,CM5,,,,,30877,15546,UQ8
19,,DOUB,C5,C6,,,,,30877,15546,UQ8
20,,SING,CM5,HM51,,,,,30877,15546,UQ8
21,,SING,CM5,HM52,,,,,30877,15546,UQ8
22,,SING,CM5,HM53,,,,,30877,15546,UQ8
23,,SING,C6,C7,,,,,30877,15546,UQ8
24,,SING,C7,C8,,,,,30877,15546,UQ8
25,,SING,C7,H71,,,,,30877,15546,UQ8
26,,SING,C7,H72,,,,,30877,15546,UQ8
27,,DOUB,C8,C9,,,,,30877,15546,UQ8
28,,SING,C8,H8,,,,,30877,15546,UQ8
29,,SING,C9,C10,,,,,30877,15546,UQ8
30,,SING,C9,C11,,,,,30877,15546,UQ8
31,,SING,C10,H101,,,,,30877,15546,UQ8
32,,SING,C10,H102,,,,,30877,15546,UQ8
33,,SING,C10,H103,,,,,30877,15546,UQ8
34,,SING,C11,H111,,,,,30877,15546,UQ8
35,,SING,C11,H112,,,,,30877,15546,UQ8
36,,SING,C11,H113,,,,,30877,15546,UQ8
1,,SING,C1,C2,no,N,1,,31003,15553,NAG
2,,SING,C1,O1,no,N,2,,31003,15553,NAG
3,,SING,C1,O5,no,N,3,,31003,15553,NAG
4,,SING,C1,H1,no,N,4,,31003,15553,NAG
5,,SING,C2,C3,no,N,5,,31003,15553,NAG
6,,SING,C2,N2,no,N,6,,31003,15553,NAG
7,,SING,C2,H2,no,N,7,,31003,15553,NAG
8,,SING,C3,C4,no,N,8,,31003,15553,NAG
9,,SING,C3,O3,no,N,9,,31003,15553,NAG
10,,SING,C3,H3,no,N,10,,31003,15553,NAG
11,,SING,C4,C5,no,N,11,,31003,15553,NAG
12,,SING,C4,O4,no,N,12,,31003,15553,NAG
13,,SING,C4,H4,no,N,13,,31003,15553,NAG
14,,SING,C5,C6,no,N,14,,31003,15553,NAG
15,,SING,C5,O5,no,N,15,,31003,15553,NAG
16,,SING,C5,H5,no,N,16,,31003,15553,NAG
17,,SING,C6,O6,no,N,17,,31003,15553,NAG
18,,SING,C6,H61,no,N,18,,31003,15553,NAG
19,,SING,C6,H62,no,N,19,,31003,15553,NAG
20,,SING,C7,C8,no,N,20,,31003,15553,NAG
21,,SING,C7,N2,no,N,21,,31003,15553,NAG
22,,DOUB,C7,O7,no,N,22,,31003,15553,NAG
23,,SING,C8,H81,no,N,23,,31003,15553,NAG
24,,SING,C8,H82,no,N,24,,31003,15553,NAG
25,,SING,C8,H83,no,N,25,,31003,15553,NAG
26,,SING,N2,HN2,no,N,26,,31003,15553,NAG
27,,SING,O1,HO1,no,N,27,,31003,15553,NAG
28,,SING,O3,HO3,no,N,28,,31003,15553,NAG
29,,SING,O4,HO4,no,N,29,,31003,15553,NAG
30,,SING,O6,HO6,no,N,30,,31003,15553,NAG
1,,SING,O1,N1,no,N,1,,31143,15562,MTN
2,,SING,N1,C1,no,N,2,,31143,15562,MTN
3,,SING,N1,C5,no,N,3,,31143,15562,MTN
4,,SING,C1,C2,no,N,4,,31143,15562,MTN
5,,SING,C1,C8,no,N,5,,31143,15562,MTN
6,,SING,C1,C9,no,N,6,,31143,15562,MTN
7,,DOUB,C2,C3,no,N,7,,31143,15562,MTN
8,,SING,C2,H2,no,N,8,,31143,15562,MTN
9,,SING,C3,C4,no,N,9,,31143,15562,MTN
10,,SING,C3,C5,no,N,10,,31143,15562,MTN
11,,SING,C4,S1,no,N,11,,31143,15562,MTN
12,,SING,C4,H41,no,N,12,,31143,15562,MTN
13,,SING,C4,H42,no,N,13,,31143,15562,MTN
14,,SING,C5,C6,no,N,14,,31143,15562,MTN
15,,SING,C5,C7,no,N,15,,31143,15562,MTN
16,,SING,C6,H61,no,N,16,,31143,15562,MTN
17,,SING,C6,H62,no,N,17,,31143,15562,MTN
18,,SING,C6,H63,no,N,18,,31143,15562,MTN
19,,SING,C7,H71,no,N,19,,31143,15562,MTN
20,,SING,C7,H72,no,N,20,,31143,15562,MTN
21,,SING,C7,H73,no,N,21,,31143,15562,MTN
22,,SING,C8,H81,no,N,22,,31143,15562,MTN
23,,SING,C8,H82,no,N,23,,31143,15562,MTN
24,,SING,C8,H83,no,N,24,,31143,15562,MTN
25,,SING,C9,H91,no,N,25,,31143,15562,MTN
26,,SING,C9,H92,no,N,26,,31143,15562,MTN
27,,SING,C9,H93,no,N,27,,31143,15562,MTN
28,,SING,S1,S2,no,N,28,,31143,15562,MTN
29,,DOUB,S2,O2,no,N,29,,31143,15562,MTN
30,,DOUB,S2,O3,no,N,30,,31143,15562,MTN
31,,SING,S2,C12,no,N,31,,31143,15562,MTN
32,,SING,C12,H4,no,N,32,,31143,15562,MTN
33,,SING,C12,H1,no,N,33,,31143,15562,MTN
34,,SING,C12,H3,no,N,34,,31143,15562,MTN
1,,DOUB,C,O,no,N,1,,31213,15565,ACE
2,,SING,C,CH3,no,N,2,,31213,15565,ACE
3,,SING,C,H,no,N,3,,31213,15565,ACE
4,,SING,CH3,H1,no,N,4,,31213,15565,ACE
5,,SING,CH3,H2,no,N,5,,31213,15565,ACE
6,,SING,CH3,H3,no,N,6,,31213,15565,ACE
1,,SING,N,HN1,no,N,1,,31214,15565,NH2
2,,SING,N,HN2,no,N,2,,31214,15565,NH2
1,,SING,O3A,C1A,no,N,1,,32196,15613,PZD
2,,DOUB,C6A,C1A,yes,N,2,,32196,15613,PZD
3,,SING,C1A,C2A,yes,N,3,,32196,15613,PZD
4,,SING,C2A,O2A,no,N,4,,32196,15613,PZD
5,,DOUB,C2A,C3A,yes,N,5,,32196,15613,PZD
6,,SING,C4A,C3A,yes,N,6,,32196,15613,PZD
7,,SING,C3A,H3A,no,N,7,,32196,15613,PZD
8,,DOUB,C5A,C4A,yes,N,8,,32196,15613,PZD
9,,SING,C4A,C7A,no,N,9,,32196,15613,PZD
10,,SING,C6A,C5A,yes,N,10,,32196,15613,PZD
11,,SING,N2A,C5A,no,N,11,,32196,15613,PZD
12,,SING,H6A,C6A,no,N,12,,32196,15613,PZD
13,,SING,N1A,C7A,no,N,13,,32196,15613,PZD
14,,DOUB,C7A,O1A,no,N,14,,32196,15613,PZD
15,,SING,C8A,N1A,no,N,15,,32196,15613,PZD
16,,SING,N1A,C10,no,N,16,,32196,15613,PZD
17,,SING,C9A,C8A,no,N,17,,32196,15613,PZD
18,,SING,H8A,C8A,no,N,18,,32196,15613,PZD
19,,SING,C12,C8A,no,N,19,,32196,15613,PZD
20,,DOUB,C11,C10,no,N,20,,32196,15613,PZD
21,,SING,C10,H10,no,N,21,,32196,15613,PZD
22,,SING,C12,C11,no,N,22,,32196,15613,PZD
23,,SING,C11,C20,no,N,23,,32196,15613,PZD
24,,SING,H12A,C12,no,N,24,,32196,15613,PZD
25,,SING,H12,C12,no,N,25,,32196,15613,PZD
26,,DOUB,C18,C13,yes,N,26,,32196,15613,PZD
27,,SING,C19,C13,yes,N,27,,32196,15613,PZD
28,,SING,C13,C14,yes,N,28,,32196,15613,PZD
29,,DOUB,C14,C15,yes,N,29,,32196,15613,PZD
30,,SING,C14,C22,yes,N,30,,32196,15613,PZD
31,,SING,C16,C15,yes,N,31,,32196,15613,PZD
32,,SING,C15,H15,no,N,32,,32196,15613,PZD
33,,DOUB,C17,C16,yes,N,33,,32196,15613,PZD
34,,SING,C16,H16,no,N,34,,32196,15613,PZD
35,,SING,H17,C17,no,N,35,,32196,15613,PZD
36,,SING,C18,C17,yes,N,36,,32196,15613,PZD
37,,SING,H18,C18,no,N,37,,32196,15613,PZD
38,,SING,H19,C19,no,N,38,,32196,15613,PZD
39,,DOUB,C19,C20,yes,N,39,,32196,15613,PZD
40,,SING,C20,C21,yes,N,40,,32196,15613,PZD
41,,DOUB,C21,C22,yes,N,41,,32196,15613,PZD
42,,SING,C21,H21,no,N,42,,32196,15613,PZD
43,,SING,C22,H22,no,N,43,,32196,15613,PZD
44,,SING,O2A,C23,no,N,44,,32196,15613,PZD
45,,SING,H23B,C23,no,N,45,,32196,15613,PZD
46,,SING,C23,H23,no,N,46,,32196,15613,PZD
47,,SING,C23,H23A,no,N,47,,32196,15613,PZD
48,,SING,C24,O3A,no,N,48,,32196,15613,PZD
49,,SING,H24A,C24,no,N,49,,32196,15613,PZD
50,,SING,C24,H24,no,N,50,,32196,15613,PZD
51,,SING,C24,H24B,no,N,51,,32196,15613,PZD
52,,SING,H9A,C9A,no,N,52,,32196,15613,PZD
53,,SING,C9A,N2A,no,N,53,,32196,15613,PZD
54,,SING,C9A,H9AA,no,N,54,,32196,15613,PZD
55,,SING,HN2A,N2A,no,N,55,,32196,15613,PZD
1,,SING,N,CA,,,,,32325,15620,PCA
2,,SING,N,CD,,,,,32325,15620,PCA
3,,SING,N,HN,,,,,32325,15620,PCA
4,,SING,CA,CB,,,,,32325,15620,PCA
5,,SING,CA,C,,,,,32325,15620,PCA
6,,SING,CA,HA,,,,,32325,15620,PCA
7,,SING,CB,CG,,,,,32325,15620,PCA
8,,SING,CB,HB1,,,,,32325,15620,PCA
9,,SING,CB,HB2,,,,,32325,15620,PCA
10,,SING,CG,CD,,,,,32325,15620,PCA
11,,SING,CG,HG1,,,,,32325,15620,PCA
12,,SING,CG,HG2,,,,,32325,15620,PCA
13,,DOUB,CD,OE,,,,,32325,15620,PCA
14,,DOUB,C,O,,,,,32325,15620,PCA
15,,SING,C,OXT,,,,,32325,15620,PCA
16,,SING,OXT,HXT,,,,,32325,15620,PCA
1,,SING,C1,C2,,,,,32342,15621,MAN
2,,SING,C1,O1,,,,,32342,15621,MAN
3,,SING,C1,O5,,,,,32342,15621,MAN
4,,SING,C1,H1,,,,,32342,15621,MAN
5,,SING,C2,C3,,,,,32342,15621,MAN
6,,SING,C2,O2,,,,,32342,15621,MAN
7,,SING,C2,H2,,,,,32342,15621,MAN
8,,SING,C3,C4,,,,,32342,15621,MAN
9,,SING,C3,O3,,,,,32342,15621,MAN
10,,SING,C3,H3,,,,,32342,15621,MAN
11,,SING,C4,C5,,,,,32342,15621,MAN
12,,SING,C4,O4,,,,,32342,15621,MAN
13,,SING,C4,H4,,,,,32342,15621,MAN
14,,SING,C5,C6,,,,,32342,15621,MAN
15,,SING,C5,O5,,,,,32342,15621,MAN
16,,SING,C5,H5,,,,,32342,15621,MAN
17,,SING,C6,O6,,,,,32342,15621,MAN
18,,SING,C6,H61,,,,,32342,15621,MAN
19,,SING,C6,H62,,,,,32342,15621,MAN
20,,SING,O1,HO1,,,,,32342,15621,MAN
21,,SING,O2,HO2,,,,,32342,15621,MAN
22,,SING,O3,HO3,,,,,32342,15621,MAN
23,,SING,O4,HO4,,,,,32342,15621,MAN
24,,SING,O6,HO6,,,,,32342,15621,MAN
1,,SING,C1,C2,,,,,32489,15629,CHR
2,,SING,C1,C9,,,,,32489,15629,CHR
3,,DOUB,C1,C12,,,,,32489,15629,CHR
4,,TRIP,C2,C3,,,,,32489,15629,CHR
5,,SING,C3,C4,,,,,32489,15629,CHR
6,,SING,C4,O2,,,,,32489,15629,CHR
7,,SING,C4,C5,,,,,32489,15629,CHR
8,,SING,C4,C33,,,,,32489,15629,CHR
9,,SING,O2,C5,,,,,32489,15629,CHR
10,,SING,C5,C6,,,,,32489,15629,CHR
11,,SING,C5,H5,,,,,32489,15629,CHR
12,,TRIP,C6,C7,,,,,32489,15629,CHR
13,,SING,C7,C8,,,,,32489,15629,CHR
14,,DOUB,C8,C9,,,,,32489,15629,CHR
15,,SING,C8,H8,,,,,32489,15629,CHR
16,,SING,C9,C10,,,,,32489,15629,CHR
17,,SING,C10,O1,,,,,32489,15629,CHR
18,,SING,C10,C11,,,,,32489,15629,CHR
19,,SING,C10,H10,,,,,32489,15629,CHR
20,,SING,O1,C13,,,,,32489,15629,CHR
21,,SING,C11,O6,,,,,32489,15629,CHR
22,,SING,C11,C12,,,,,32489,15629,CHR
23,,SING,C11,H11,,,,,32489,15629,CHR
24,,SING,O6,C20,,,,,32489,15629,CHR
25,,SING,C12,H12,,,,,32489,15629,CHR
26,,SING,C13,O3,,,,,32489,15629,CHR
27,,SING,C13,C14,,,,,32489,15629,CHR
28,,SING,C13,H13,,,,,32489,15629,CHR
29,,SING,O3,C17,,,,,32489,15629,CHR
30,,SING,C14,N1,,,,,32489,15629,CHR
31,,SING,C14,C15,,,,,32489,15629,CHR
32,,SING,C14,H14,,,,,32489,15629,CHR
33,,SING,N1,C19,,,,,32489,15629,CHR
34,,SING,N1,HN1,,,,,32489,15629,CHR
35,,SING,C19,H191,,,,,32489,15629,CHR
36,,SING,C19,H192,,,,,32489,15629,CHR
37,,SING,C19,H193,,,,,32489,15629,CHR
38,,SING,C15,O4,,,,,32489,15629,CHR
39,,SING,C15,C16,,,,,32489,15629,CHR
40,,SING,C15,H15,,,,,32489,15629,CHR
41,,SING,O4,HO4,,,,,32489,15629,CHR
42,,SING,C16,O5,,,,,32489,15629,CHR
43,,SING,C16,C17,,,,,32489,15629,CHR
44,,SING,C16,H16,,,,,32489,15629,CHR
45,,SING,O5,HO5,,,,,32489,15629,CHR
46,,SING,C17,C18,,,,,32489,15629,CHR
47,,SING,C17,H17,,,,,32489,15629,CHR
48,,SING,C18,H181,,,,,32489,15629,CHR
49,,SING,C18,H182,,,,,32489,15629,CHR
50,,SING,C18,H183,,,,,32489,15629,CHR
51,,DOUB,C20,O7,,,,,32489,15629,CHR
52,,SING,C20,C21,,,,,32489,15629,CHR
53,,DOUB,C21,C22,,,,,32489,15629,CHR
54,,SING,C21,C26,,,,,32489,15629,CHR
55,,SING,C22,O9,,,,,32489,15629,CHR
56,,SING,C22,C23,,,,,32489,15629,CHR
57,,SING,O9,HO9,,,,,32489,15629,CHR
58,,DOUB,C23,C24,,,,,32489,15629,CHR
59,,SING,C23,H23,,,,,32489,15629,CHR
60,,SING,C24,C25,,,,,32489,15629,CHR
61,,SING,C24,H24,,,,,32489,15629,CHR
62,,DOUB,C25,C26,,,,,32489,15629,CHR
63,,SING,C25,C30,,,,,32489,15629,CHR
64,,SING,C26,C27,,,,,32489,15629,CHR
65,,DOUB,C27,C28,,,,,32489,15629,CHR
66,,SING,C27,H27,,,,,32489,15629,CHR
67,,SING,C28,O8,,,,,32489,15629,CHR
68,,SING,C28,C29,,,,,32489,15629,CHR
69,,SING,O8,C31,,,,,32489,15629,CHR
70,,SING,C31,H311,,,,,32489,15629,CHR
71,,SING,C31,H312,,,,,32489,15629,CHR
72,,SING,C31,H313,,,,,32489,15629,CHR
73,,DOUB,C29,C30,,,,,32489,15629,CHR
74,,SING,C29,H29,,,,,32489,15629,CHR
75,,SING,C30,C32,,,,,32489,15629,CHR
76,,SING,C32,H321,,,,,32489,15629,CHR
77,,SING,C32,H322,,,,,32489,15629,CHR
78,,SING,C32,H323,,,,,32489,15629,CHR
79,,SING,C33,O10,,,,,32489,15629,CHR
80,,SING,C33,C35,,,,,32489,15629,CHR
81,,SING,C33,H33,,,,,32489,15629,CHR
82,,SING,O10,C34,,,,,32489,15629,CHR
83,,DOUB,C34,O11,,,,,32489,15629,CHR
84,,SING,C34,O12,,,,,32489,15629,CHR
85,,SING,O12,C35,,,,,32489,15629,CHR
86,,SING,C35,H351,,,,,32489,15629,CHR
87,,SING,C35,H352,,,,,32489,15629,CHR
1,,SING,N,C,,,,,32490,15629,OHO
2,,SING,N,C1,,,,,32490,15629,OHO
3,,SING,N,HN,,,,,32490,15629,OHO
4,,DOUB,C,O,,,,,32490,15629,OHO
5,,SING,C,OXT,,,,,32490,15629,OHO
6,,SING,OXT,HXT,,,,,32490,15629,OHO
7,,SING,C1,C2,,,,,32490,15629,OHO
8,,SING,C1,C6,,,,,32490,15629,OHO
9,,SING,C1,H1,,,,,32490,15629,OHO
10,,SING,C2,C3,,,,,32490,15629,OHO
11,,SING,C2,H21,,,,,32490,15629,OHO
12,,SING,C2,H22,,,,,32490,15629,OHO
13,,SING,C3,C4,,,,,32490,15629,OHO
14,,SING,C3,H31,,,,,32490,15629,OHO
15,,SING,C3,H32,,,,,32490,15629,OHO
16,,SING,C4,C5,,,,,32490,15629,OHO
17,,SING,C4,H41,,,,,32490,15629,OHO
18,,SING,C4,H42,,,,,32490,15629,OHO
19,,SING,C5,C6,,,,,32490,15629,OHO
20,,SING,C5,H51,,,,,32490,15629,OHO
21,,SING,C5,H52,,,,,32490,15629,OHO
22,,SING,C6,H61,,,,,32490,15629,OHO
23,,SING,C6,H62,,,,,32490,15629,OHO
1,,SING,N,CA,,,,,32571,15635,TYS
2,,SING,N,HN1,,,,,32571,15635,TYS
3,,SING,N,HN2,,,,,32571,15635,TYS
4,,SING,CA,CB,,,,,32571,15635,TYS
5,,SING,CA,C,,,,,32571,15635,TYS
6,,SING,CA,HA,,,,,32571,15635,TYS
7,,SING,CB,CG,,,,,32571,15635,TYS
8,,SING,CB,HB1,,,,,32571,15635,TYS
9,,SING,CB,HB2,,,,,32571,15635,TYS
10,,DOUB,CG,CD1,,,,,32571,15635,TYS
11,,SING,CG,CD2,,,,,32571,15635,TYS
12,,SING,CD1,CE1,,,,,32571,15635,TYS
13,,SING,CD1,HD1,,,,,32571,15635,TYS
14,,DOUB,CD2,CE2,,,,,32571,15635,TYS
15,,SING,CD2,HD2,,,,,32571,15635,TYS
16,,DOUB,CE1,CZ,,,,,32571,15635,TYS
17,,SING,CE1,HE1,,,,,32571,15635,TYS
18,,SING,CE2,CZ,,,,,32571,15635,TYS
19,,SING,CE2,HE2,,,,,32571,15635,TYS
20,,SING,CZ,OH,,,,,32571,15635,TYS
21,,SING,OH,S,,,,,32571,15635,TYS
22,,DOUB,S,O1,,,,,32571,15635,TYS
23,,DOUB,S,O2,,,,,32571,15635,TYS
24,,SING,S,O3,,,,,32571,15635,TYS
25,,SING,O3,HO3,,,,,32571,15635,TYS
26,,DOUB,C,O,,,,,32571,15635,TYS
27,,SING,C,OXT,,,,,32571,15635,TYS
28,,SING,OXT,HXT,,,,,32571,15635,TYS
1,,SING,N,CA,,,,,32616,15637,TYS
2,,SING,N,HN1,,,,,32616,15637,TYS
3,,SING,N,HN2,,,,,32616,15637,TYS
4,,SING,CA,CB,,,,,32616,15637,TYS
5,,SING,CA,C,,,,,32616,15637,TYS
6,,SING,CA,HA,,,,,32616,15637,TYS
7,,SING,CB,CG,,,,,32616,15637,TYS
8,,SING,CB,HB1,,,,,32616,15637,TYS
9,,SING,CB,HB2,,,,,32616,15637,TYS
10,,DOUB,CG,CD1,,,,,32616,15637,TYS
11,,SING,CG,CD2,,,,,32616,15637,TYS
12,,SING,CD1,CE1,,,,,32616,15637,TYS
13,,SING,CD1,HD1,,,,,32616,15637,TYS
14,,DOUB,CD2,CE2,,,,,32616,15637,TYS
15,,SING,CD2,HD2,,,,,32616,15637,TYS
16,,DOUB,CE1,CZ,,,,,32616,15637,TYS
17,,SING,CE1,HE1,,,,,32616,15637,TYS
18,,SING,CE2,CZ,,,,,32616,15637,TYS
19,,SING,CE2,HE2,,,,,32616,15637,TYS
20,,SING,CZ,OH,,,,,32616,15637,TYS
21,,SING,OH,S,,,,,32616,15637,TYS
22,,DOUB,S,O1,,,,,32616,15637,TYS
23,,DOUB,S,O2,,,,,32616,15637,TYS
24,,SING,S,O3,,,,,32616,15637,TYS
25,,SING,O3,HO3,,,,,32616,15637,TYS
26,,DOUB,C,O,,,,,32616,15637,TYS
27,,SING,C,OXT,,,,,32616,15637,TYS
28,,SING,OXT,HXT,,,,,32616,15637,TYS
1,,SING,O,C,,,,,32656,15639,NLQ
2,,SING,O,HO,,,,,32656,15639,NLQ
3,,DOUB,C,OXT,,,,,32656,15639,NLQ
4,,SING,C,CA,,,,,32656,15639,NLQ
5,,SING,CA,N,,,,,32656,15639,NLQ
6,,SING,CA,CB,,,,,32656,15639,NLQ
7,,SING,CA,HA,,,,,32656,15639,NLQ
8,,SING,N,C6,,,,,32656,15639,NLQ
9,,SING,N,HN,,,,,32656,15639,NLQ
10,,DOUB,C6,O4,,,,,32656,15639,NLQ
11,,SING,C6,C7,,,,,32656,15639,NLQ
12,,SING,C7,H71,,,,,32656,15639,NLQ
13,,SING,C7,H72,,,,,32656,15639,NLQ
14,,SING,C7,H73,,,,,32656,15639,NLQ
15,,SING,CB,CG,,,,,32656,15639,NLQ
16,,SING,CB,HB1,,,,,32656,15639,NLQ
17,,SING,CB,HB2,,,,,32656,15639,NLQ
18,,SING,CG,CD,,,,,32656,15639,NLQ
19,,SING,CG,HG1,,,,,32656,15639,NLQ
20,,SING,CG,HG2,,,,,32656,15639,NLQ
21,,SING,CD,NE2,,,,,32656,15639,NLQ
22,,DOUB,CD,OE1,,,,,32656,15639,NLQ
23,,SING,NE2,HE21,,,,,32656,15639,NLQ
24,,SING,NE2,HE22,,,,,32656,15639,NLQ
1,,SING,N,CA,,,,,32657,15639,SET
2,,SING,N,HN1,,,,,32657,15639,SET
3,,SING,N,HN2,,,,,32657,15639,SET
4,,SING,CA,CB,,,,,32657,15639,SET
5,,SING,CA,C,,,,,32657,15639,SET
6,,SING,CA,HA,,,,,32657,15639,SET
7,,SING,CB,OG,,,,,32657,15639,SET
8,,SING,CB,HB1,,,,,32657,15639,SET
9,,SING,CB,HB2,,,,,32657,15639,SET
10,,SING,OG,HOG,,,,,32657,15639,SET
11,,SING,NT,C,,,,,32657,15639,SET
12,,SING,NT,HNT1,,,,,32657,15639,SET
13,,SING,NT,HNT2,,,,,32657,15639,SET
14,,DOUB,C,O,,,,,32657,15639,SET
1,,DOUB,C,O,no,N,1,,32673,15640,ACE
2,,SING,C,CH3,no,N,2,,32673,15640,ACE
3,,SING,C,H,no,N,3,,32673,15640,ACE
4,,SING,CH3,H1,no,N,4,,32673,15640,ACE
5,,SING,CH3,H2,no,N,5,,32673,15640,ACE
6,,SING,CH3,H3,no,N,6,,32673,15640,ACE
1,,SING,N,HN1,no,N,1,,32674,15640,NH2
2,,SING,N,HN2,no,N,2,,32674,15640,NH2
1,,SING,O23,P24,no,N,1,,33028,15658,PNS
2,,SING,O23,HOP1,no,N,2,,33028,15658,PNS
3,,SING,P24,O25,no,N,3,,33028,15658,PNS
4,,DOUB,P24,O26,no,N,4,,33028,15658,PNS
5,,SING,P24,O27,no,N,5,,33028,15658,PNS
6,,SING,O25,HOP2,no,N,6,,33028,15658,PNS
7,,SING,O27,C28,no,N,7,,33028,15658,PNS
8,,SING,C28,C29,no,N,8,,33028,15658,PNS
9,,SING,C28,H282,no,N,9,,33028,15658,PNS
10,,SING,C28,H281,no,N,10,,33028,15658,PNS
11,,SING,C29,C30,no,N,11,,33028,15658,PNS
12,,SING,C29,C31,no,N,12,,33028,15658,PNS
13,,SING,C29,C32,no,N,13,,33028,15658,PNS
14,,SING,C30,H303,no,N,14,,33028,15658,PNS
15,,SING,C30,H302,no,N,15,,33028,15658,PNS
16,,SING,C30,H301,no,N,16,,33028,15658,PNS
17,,SING,C31,H313,no,N,17,,33028,15658,PNS
18,,SING,C31,H312,no,N,18,,33028,15658,PNS
19,,SING,C31,H311,no,N,19,,33028,15658,PNS
20,,SING,C32,O33,no,N,20,,33028,15658,PNS
21,,SING,C32,C34,no,N,21,,33028,15658,PNS
22,,SING,C32,H32,no,N,22,,33028,15658,PNS
23,,SING,O33,H33,no,N,23,,33028,15658,PNS
24,,DOUB,C34,O35,no,N,24,,33028,15658,PNS
25,,SING,C34,N36,no,N,25,,33028,15658,PNS
26,,SING,N36,C37,no,N,26,,33028,15658,PNS
27,,SING,N36,H36,no,N,27,,33028,15658,PNS
28,,SING,C37,C38,no,N,28,,33028,15658,PNS
29,,SING,C37,H372,no,N,29,,33028,15658,PNS
30,,SING,C37,H371,no,N,30,,33028,15658,PNS
31,,SING,C38,C39,no,N,31,,33028,15658,PNS
32,,SING,C38,H382,no,N,32,,33028,15658,PNS
33,,SING,C38,H381,no,N,33,,33028,15658,PNS
34,,DOUB,C39,O40,no,N,34,,33028,15658,PNS
35,,SING,C39,N41,no,N,35,,33028,15658,PNS
36,,SING,N41,C42,no,N,36,,33028,15658,PNS
37,,SING,N41,H41,no,N,37,,33028,15658,PNS
38,,SING,C42,C43,no,N,38,,33028,15658,PNS
39,,SING,C42,H422,no,N,39,,33028,15658,PNS
40,,SING,C42,H421,no,N,40,,33028,15658,PNS
41,,SING,C43,S44,no,N,41,,33028,15658,PNS
42,,SING,C43,H431,no,N,42,,33028,15658,PNS
43,,SING,C43,H432,no,N,43,,33028,15658,PNS
44,,SING,S44,H44,no,N,44,,33028,15658,PNS
1,,SING,N,CA,,,,,33280,15671,M3L
2,,SING,N,H,,,,,33280,15671,M3L
3,,SING,N,H2,,,,,33280,15671,M3L
4,,SING,CA,CB,,,,,33280,15671,M3L
5,,SING,CA,C,,,,,33280,15671,M3L
6,,SING,CA,HA,,,,,33280,15671,M3L
7,,SING,CB,CG,,,,,33280,15671,M3L
8,,SING,CB,HB2,,,,,33280,15671,M3L
9,,SING,CB,HB3,,,,,33280,15671,M3L
10,,SING,CG,CD,,,,,33280,15671,M3L
11,,SING,CG,HG2,,,,,33280,15671,M3L
12,,SING,CG,HG3,,,,,33280,15671,M3L
13,,SING,CD,CE,,,,,33280,15671,M3L
14,,SING,CD,HD2,,,,,33280,15671,M3L
15,,SING,CD,HD3,,,,,33280,15671,M3L
16,,SING,CE,NZ,,,,,33280,15671,M3L
17,,SING,CE,HE2,,,,,33280,15671,M3L
18,,SING,CE,HE3,,,,,33280,15671,M3L
19,,SING,NZ,CM1,,,,,33280,15671,M3L
20,,SING,NZ,CM2,,,,,33280,15671,M3L
21,,SING,NZ,CM3,,,,,33280,15671,M3L
22,,DOUB,C,O,,,,,33280,15671,M3L
23,,SING,C,OXT,,,,,33280,15671,M3L
24,,SING,OXT,HXT,,,,,33280,15671,M3L
25,,SING,CM1,HM11,,,,,33280,15671,M3L
26,,SING,CM1,HM12,,,,,33280,15671,M3L
27,,SING,CM1,HM13,,,,,33280,15671,M3L
28,,SING,CM2,HM21,,,,,33280,15671,M3L
29,,SING,CM2,HM22,,,,,33280,15671,M3L
30,,SING,CM2,HM23,,,,,33280,15671,M3L
31,,SING,CM3,HM31,,,,,33280,15671,M3L
32,,SING,CM3,HM32,,,,,33280,15671,M3L
33,,SING,CM3,HM33,,,,,33280,15671,M3L
1,,SING,C1,C2,,,,,33894,15706,DFP
2,,SING,C1,C3,,,,,33894,15706,DFP
3,,SING,C1,O1P,,,,,33894,15706,DFP
4,,SING,C1,H1,,,,,33894,15706,DFP
5,,SING,C2,H21,,,,,33894,15706,DFP
6,,SING,C2,H22,,,,,33894,15706,DFP
7,,SING,C2,H23,,,,,33894,15706,DFP
8,,SING,C3,H31,,,,,33894,15706,DFP
9,,SING,C3,H32,,,,,33894,15706,DFP
10,,SING,C3,H33,,,,,33894,15706,DFP
11,,SING,C1',C2',,,,,33894,15706,DFP
12,,SING,C1',C3',,,,,33894,15706,DFP
13,,SING,C1',O2P,,,,,33894,15706,DFP
14,,SING,C1',H1',,,,,33894,15706,DFP
15,,SING,C2',H2'1,,,,,33894,15706,DFP
16,,SING,C2',H2'2,,,,,33894,15706,DFP
17,,SING,C2',H2'3,,,,,33894,15706,DFP
18,,SING,C3',H3'1,,,,,33894,15706,DFP
19,,SING,C3',H3'2,,,,,33894,15706,DFP
20,,SING,C3',H3'3,,,,,33894,15706,DFP
21,,SING,P,O1P,,,,,33894,15706,DFP
22,,SING,P,O2P,,,,,33894,15706,DFP
23,,DOUB,P,O3P,,,,,33894,15706,DFP
24,,SING,HP1,P,,,,,33894,15706,DFP
1,,DOUB,CHA,C1A,,,1,,34081,15717,CYC
2,,SING,CHA,C4D,,,2,,34081,15717,CYC
3,,SING,CHA,HHA,,,3,,34081,15717,CYC
4,,SING,NA,C1A,,,4,,34081,15717,CYC
5,,DOUB,NA,C4A,,,5,,34081,15717,CYC
6,,SING,C1A,C2A,,,6,,34081,15717,CYC
7,,DOUB,C2A,C3A,,,7,,34081,15717,CYC
8,,SING,C2A,CAA,,,8,,34081,15717,CYC
9,,SING,C3A,C4A,,,9,,34081,15717,CYC
10,,SING,C3A,CMA,,,10,,34081,15717,CYC
11,,SING,C4A,CHB,,,11,,34081,15717,CYC
12,,SING,CMA,HMA1,,,12,,34081,15717,CYC
13,,SING,CMA,HMA2,,,13,,34081,15717,CYC
14,,SING,CMA,HMA3,,,14,,34081,15717,CYC
15,,SING,CAA,CBA,,,15,,34081,15717,CYC
16,,SING,CAA,HAA1,,,16,,34081,15717,CYC
17,,SING,CAA,HAA2,,,17,,34081,15717,CYC
18,,SING,CBA,CGA,,,18,,34081,15717,CYC
19,,SING,CBA,HBA1,,,19,,34081,15717,CYC
20,,SING,CBA,HBA2,,,20,,34081,15717,CYC
21,,DOUB,CGA,O1A,,,21,,34081,15717,CYC
22,,SING,CGA,O2A,,,22,,34081,15717,CYC
23,,SING,O2A,H2A,,,23,,34081,15717,CYC
24,,DOUB,CHB,C1B,,,24,,34081,15717,CYC
25,,SING,CHB,HHB,,,25,,34081,15717,CYC
26,,SING,NB,C1B,,,26,,34081,15717,CYC
27,,SING,NB,C4B,,,27,,34081,15717,CYC
28,,SING,NB,HB,,,28,,34081,15717,CYC
29,,SING,C1B,C2B,,,29,,34081,15717,CYC
30,,DOUB,C2B,C3B,,,30,,34081,15717,CYC
31,,SING,C2B,CMB,,,31,,34081,15717,CYC
32,,SING,C3B,C4B,,,32,,34081,15717,CYC
33,,SING,C3B,CAB,,,33,,34081,15717,CYC
34,,DOUB,C4B,OB,,,34,,34081,15717,CYC
35,,SING,CMB,HMB1,,,35,,34081,15717,CYC
36,,SING,CMB,HMB2,,,36,,34081,15717,CYC
37,,SING,CMB,HMB3,,,37,,34081,15717,CYC
38,,SING,CAB,CBB,,,38,,34081,15717,CYC
39,,SING,CAB,HAB1,,,39,,34081,15717,CYC
40,,SING,CAB,HAB2,,,40,,34081,15717,CYC
41,,SING,CBB,HBB1,,,41,,34081,15717,CYC
42,,SING,CBB,HBB2,,,42,,34081,15717,CYC
43,,SING,CBB,HBB3,,,43,,34081,15717,CYC
44,,SING,NC,C1C,,,44,,34081,15717,CYC
45,,SING,NC,C4C,,,45,,34081,15717,CYC
46,,SING,NC,HC,,,46,,34081,15717,CYC
47,,SING,C1C,C2C,,,47,,34081,15717,CYC
48,,DOUB,C1C,OC,,,48,,34081,15717,CYC
49,,SING,C2C,C3C,,,49,,34081,15717,CYC
50,,SING,C2C,CMC,,,50,,34081,15717,CYC
51,,SING,C2C,H2C,,,51,,34081,15717,CYC
52,,SING,C3C,C4C,,,52,,34081,15717,CYC
53,,SING,C3C,CAC,,,53,,34081,15717,CYC
54,,SING,C3C,H3C,,,54,,34081,15717,CYC
55,,DOUB,C4C,CHD,,,55,,34081,15717,CYC
56,,SING,CMC,HMC1,,,56,,34081,15717,CYC
57,,SING,CMC,HMC2,,,57,,34081,15717,CYC
58,,SING,CMC,HMC3,,,58,,34081,15717,CYC
59,,SING,CAC,CBC,,,59,,34081,15717,CYC
60,,SING,CAC,HAC1,,,60,,34081,15717,CYC
61,,SING,CAC,HAC2,,,61,,34081,15717,CYC
62,,SING,CBC,HBC1,,,62,,34081,15717,CYC
63,,SING,CBC,HBC2,,,63,,34081,15717,CYC
64,,SING,CBC,HBC3,,,64,,34081,15717,CYC
65,,SING,CHD,C1D,,,65,,34081,15717,CYC
66,,SING,CHD,HHD,,,66,,34081,15717,CYC
67,,SING,ND,C1D,,,67,,34081,15717,CYC
68,,SING,ND,C4D,,,68,,34081,15717,CYC
69,,SING,ND,HD,,,69,,34081,15717,CYC
70,,DOUB,C1D,C2D,,,70,,34081,15717,CYC
71,,SING,C2D,C3D,,,71,,34081,15717,CYC
72,,SING,C2D,CMD,,,72,,34081,15717,CYC
73,,DOUB,C3D,C4D,,,73,,34081,15717,CYC
74,,SING,C3D,CAD,,,74,,34081,15717,CYC
75,,SING,CMD,HMD1,,,75,,34081,15717,CYC
76,,SING,CMD,HMD2,,,76,,34081,15717,CYC
77,,SING,CMD,HMD3,,,77,,34081,15717,CYC
78,,SING,CAD,CBD,,,78,,34081,15717,CYC
79,,SING,CAD,HAD1,,,79,,34081,15717,CYC
80,,SING,CAD,HAD2,,,80,,34081,15717,CYC
81,,SING,CBD,CGD,,,81,,34081,15717,CYC
82,,SING,CBD,HBD1,,,82,,34081,15717,CYC
83,,SING,CBD,HBD2,,,83,,34081,15717,CYC
84,,DOUB,CGD,O1D,,,84,,34081,15717,CYC
85,,SING,CGD,O2D,,,85,,34081,15717,CYC
86,,SING,O2D,H2D,,,86,,34081,15717,CYC
1,,SING,N1,C2,yes,N,1,,34239,15724,FMN
2,,DOUB,N1,C10,yes,N,2,,34239,15724,FMN
3,,DOUB,C2,O2,no,N,3,,34239,15724,FMN
4,,SING,C2,N3,yes,N,4,,34239,15724,FMN
5,,SING,N3,C4,yes,N,5,,34239,15724,FMN
6,,SING,N3,HN3,no,N,6,,34239,15724,FMN
7,,DOUB,C4,O4,no,N,7,,34239,15724,FMN
8,,SING,C4,C4A,yes,N,8,,34239,15724,FMN
9,,DOUB,C4A,N5,yes,N,9,,34239,15724,FMN
10,,SING,C4A,C10,yes,N,10,,34239,15724,FMN
11,,SING,N5,C5A,yes,N,11,,34239,15724,FMN
12,,DOUB,C5A,C6,yes,N,12,,34239,15724,FMN
13,,SING,C5A,C9A,yes,N,13,,34239,15724,FMN
14,,SING,C6,C7,yes,N,14,,34239,15724,FMN
15,,SING,C6,H6,no,N,15,,34239,15724,FMN
16,,SING,C7,C7M,no,N,16,,34239,15724,FMN
17,,DOUB,C7,C8,yes,N,17,,34239,15724,FMN
18,,SING,C7M,HM71,no,N,18,,34239,15724,FMN
19,,SING,C7M,HM72,no,N,19,,34239,15724,FMN
20,,SING,C7M,HM73,no,N,20,,34239,15724,FMN
21,,SING,C8,C8M,no,N,21,,34239,15724,FMN
22,,SING,C8,C9,yes,N,22,,34239,15724,FMN
23,,SING,C8M,HM81,no,N,23,,34239,15724,FMN
24,,SING,C8M,HM82,no,N,24,,34239,15724,FMN
25,,SING,C8M,HM83,no,N,25,,34239,15724,FMN
26,,DOUB,C9,C9A,yes,N,26,,34239,15724,FMN
27,,SING,C9,H9,no,N,27,,34239,15724,FMN
28,,SING,C9A,N10,yes,N,28,,34239,15724,FMN
29,,SING,N10,C10,yes,N,29,,34239,15724,FMN
30,,SING,N10,C1',no,N,30,,34239,15724,FMN
31,,SING,C1',C2',no,N,31,,34239,15724,FMN
32,,SING,C1',H1'1,no,N,32,,34239,15724,FMN
33,,SING,C1',H1'2,no,N,33,,34239,15724,FMN
34,,SING,C2',O2',no,N,34,,34239,15724,FMN
35,,SING,C2',C3',no,N,35,,34239,15724,FMN
36,,SING,C2',H2',no,N,36,,34239,15724,FMN
37,,SING,O2',HO2',no,N,37,,34239,15724,FMN
38,,SING,C3',O3',no,N,38,,34239,15724,FMN
39,,SING,C3',C4',no,N,39,,34239,15724,FMN
40,,SING,C3',H3',no,N,40,,34239,15724,FMN
41,,SING,O3',HO3',no,N,41,,34239,15724,FMN
42,,SING,C4',O4',no,N,42,,34239,15724,FMN
43,,SING,C4',C5',no,N,43,,34239,15724,FMN
44,,SING,C4',H4',no,N,44,,34239,15724,FMN
45,,SING,O4',HO4',no,N,45,,34239,15724,FMN
46,,SING,C5',O5',no,N,46,,34239,15724,FMN
47,,SING,C5',H5'1,no,N,47,,34239,15724,FMN
48,,SING,C5',H5'2,no,N,48,,34239,15724,FMN
49,,SING,O5',P,no,N,49,,34239,15724,FMN
50,,DOUB,P,O1P,no,N,50,,34239,15724,FMN
51,,SING,P,O2P,no,N,51,,34239,15724,FMN
52,,SING,P,O3P,no,N,52,,34239,15724,FMN
53,,SING,O2P,HOP2,no,N,53,,34239,15724,FMN
54,,SING,O3P,HOP3,no,N,54,,34239,15724,FMN
1,,SING,N1,C2,no,N,1,,34279,15725,FMN
2,,DOUB,N1,C10,no,N,2,,34279,15725,FMN
3,,DOUB,C2,O2,no,N,3,,34279,15725,FMN
4,,SING,C2,N3,no,N,4,,34279,15725,FMN
5,,SING,N3,C4,no,N,5,,34279,15725,FMN
6,,SING,N3,HN3,no,N,6,,34279,15725,FMN
7,,DOUB,C4,O4,no,N,7,,34279,15725,FMN
8,,SING,C4,C4A,no,N,8,,34279,15725,FMN
9,,DOUB,C4A,N5,no,N,9,,34279,15725,FMN
10,,SING,C4A,C10,no,N,10,,34279,15725,FMN
11,,SING,N5,C5A,no,N,11,,34279,15725,FMN
12,,DOUB,C5A,C6,yes,N,12,,34279,15725,FMN
13,,SING,C5A,C9A,yes,N,13,,34279,15725,FMN
14,,SING,C6,C7,yes,N,14,,34279,15725,FMN
15,,SING,C6,H6,no,N,15,,34279,15725,FMN
16,,SING,C7,C7M,no,N,16,,34279,15725,FMN
17,,DOUB,C7,C8,yes,N,17,,34279,15725,FMN
18,,SING,C7M,HM71,no,N,18,,34279,15725,FMN
19,,SING,C7M,HM72,no,N,19,,34279,15725,FMN
20,,SING,C7M,HM73,no,N,20,,34279,15725,FMN
21,,SING,C8,C8M,no,N,21,,34279,15725,FMN
22,,SING,C8,C9,yes,N,22,,34279,15725,FMN
23,,SING,C8M,HM81,no,N,23,,34279,15725,FMN
24,,SING,C8M,HM82,no,N,24,,34279,15725,FMN
25,,SING,C8M,HM83,no,N,25,,34279,15725,FMN
26,,DOUB,C9,C9A,yes,N,26,,34279,15725,FMN
27,,SING,C9,H9,no,N,27,,34279,15725,FMN
28,,SING,C9A,N10,no,N,28,,34279,15725,FMN
29,,SING,N10,C10,no,N,29,,34279,15725,FMN
30,,SING,N10,C1',no,N,30,,34279,15725,FMN
31,,SING,C1',C2',no,N,31,,34279,15725,FMN
32,,SING,C1',H1'1,no,N,32,,34279,15725,FMN
33,,SING,C1',H1'2,no,N,33,,34279,15725,FMN
34,,SING,C2',O2',no,N,34,,34279,15725,FMN
35,,SING,C2',C3',no,N,35,,34279,15725,FMN
36,,SING,C2',H2',no,N,36,,34279,15725,FMN
37,,SING,O2',HO2',no,N,37,,34279,15725,FMN
38,,SING,C3',O3',no,N,38,,34279,15725,FMN
39,,SING,C3',C4',no,N,39,,34279,15725,FMN
40,,SING,C3',H3',no,N,40,,34279,15725,FMN
41,,SING,O3',HO3',no,N,41,,34279,15725,FMN
42,,SING,C4',O4',no,N,42,,34279,15725,FMN
43,,SING,C4',C5',no,N,43,,34279,15725,FMN
44,,SING,C4',H4',no,N,44,,34279,15725,FMN
45,,SING,O4',HO4',no,N,45,,34279,15725,FMN
46,,SING,C5',O5',no,N,46,,34279,15725,FMN
47,,SING,C5',H5'1,no,N,47,,34279,15725,FMN
48,,SING,C5',H5'2,no,N,48,,34279,15725,FMN
49,,SING,O5',P,no,N,49,,34279,15725,FMN
50,,DOUB,P,O1P,no,N,50,,34279,15725,FMN
51,,SING,P,O2P,no,N,51,,34279,15725,FMN
52,,SING,P,O3P,no,N,52,,34279,15725,FMN
53,,SING,O2P,HOP2,no,N,53,,34279,15725,FMN
54,,SING,O3P,HOP3,no,N,54,,34279,15725,FMN
1,,DOUB,P,O1P,no,N,1,,34462,15734,35G
2,,SING,P,O2P,no,N,2,,34462,15734,35G
3,,SING,P,O5',no,N,3,,34462,15734,35G
4,,SING,P,O3',no,N,4,,34462,15734,35G
5,,SING,O2P,HOP2,no,N,5,,34462,15734,35G
6,,SING,O5',C5',no,N,6,,34462,15734,35G
7,,SING,C5',C4',no,N,7,,34462,15734,35G
8,,SING,C5',H5'1,no,N,8,,34462,15734,35G
9,,SING,C5',H5'2,no,N,9,,34462,15734,35G
10,,SING,C4',O4',no,N,10,,34462,15734,35G
11,,SING,C4',C3',no,N,11,,34462,15734,35G
12,,SING,C4',H4',no,N,12,,34462,15734,35G
13,,SING,O4',C1',no,N,13,,34462,15734,35G
14,,SING,C3',O3',no,N,14,,34462,15734,35G
15,,SING,C3',C2',no,N,15,,34462,15734,35G
16,,SING,C3',H3',no,N,16,,34462,15734,35G
17,,SING,C2',O2',no,N,17,,34462,15734,35G
18,,SING,C2',C1',no,N,18,,34462,15734,35G
19,,SING,C2',H2',no,N,19,,34462,15734,35G
20,,SING,O2',HO2',no,N,20,,34462,15734,35G
21,,SING,C1',N9,no,N,21,,34462,15734,35G
22,,SING,C1',H1',no,N,22,,34462,15734,35G
23,,SING,N9,C8,yes,N,23,,34462,15734,35G
24,,SING,N9,C4,yes,N,24,,34462,15734,35G
25,,DOUB,C8,N7,yes,N,25,,34462,15734,35G
26,,SING,C8,H8,no,N,26,,34462,15734,35G
27,,SING,N7,C5,yes,N,27,,34462,15734,35G
28,,SING,C5,C6,no,N,28,,34462,15734,35G
29,,DOUB,C5,C4,yes,N,29,,34462,15734,35G
30,,DOUB,C6,O6,no,N,30,,34462,15734,35G
31,,SING,C6,N1,no,N,31,,34462,15734,35G
32,,SING,N1,C2,no,N,32,,34462,15734,35G
33,,SING,N1,HN1,no,N,33,,34462,15734,35G
34,,SING,C2,N2,no,N,34,,34462,15734,35G
35,,DOUB,C2,N3,no,N,35,,34462,15734,35G
36,,SING,N2,HN21,no,N,36,,34462,15734,35G
37,,SING,N2,HN22,no,N,37,,34462,15734,35G
38,,SING,N3,C4,no,N,38,,34462,15734,35G
1,,SING,C1,C2,,,,,34528,15737,A2G
2,,SING,C1,O,,,,,34528,15737,A2G
3,,SING,C1,O1,,,,,34528,15737,A2G
4,,SING,C1,H1,,,,,34528,15737,A2G
5,,SING,C2,C3,,,,,34528,15737,A2G
6,,SING,C2,N2,,,,,34528,15737,A2G
7,,SING,C2,H2,,,,,34528,15737,A2G
8,,SING,C3,C4,,,,,34528,15737,A2G
9,,SING,C3,O3,,,,,34528,15737,A2G
10,,SING,C3,H3,,,,,34528,15737,A2G
11,,SING,C4,C5,,,,,34528,15737,A2G
12,,SING,C4,O4,,,,,34528,15737,A2G
13,,SING,C4,H4,,,,,34528,15737,A2G
14,,SING,C5,C6,,,,,34528,15737,A2G
15,,SING,C5,O,,,,,34528,15737,A2G
16,,SING,C5,H5,,,,,34528,15737,A2G
17,,SING,C6,O6,,,,,34528,15737,A2G
18,,SING,C6,H61,,,,,34528,15737,A2G
19,,SING,C6,H62,,,,,34528,15737,A2G
20,,SING,C7,C8,,,,,34528,15737,A2G
21,,DOUB,C7,O7,,,,,34528,15737,A2G
22,,SING,C7,N2,,,,,34528,15737,A2G
23,,SING,C8,H81,,,,,34528,15737,A2G
24,,SING,C8,H82,,,,,34528,15737,A2G
25,,SING,C8,H83,,,,,34528,15737,A2G
26,,SING,O1,HO1,,,,,34528,15737,A2G
27,,SING,O3,HO3,,,,,34528,15737,A2G
28,,SING,O4,HO4,,,,,34528,15737,A2G
29,,SING,O6,HO6,,,,,34528,15737,A2G
30,,SING,N2,HN2,,,,,34528,15737,A2G
1,,SING,C2,C3,,,,,34529,15737,BGC
2,,SING,C2,C1,,,,,34529,15737,BGC
3,,SING,C2,O2,,,,,34529,15737,BGC
4,,SING,C2,H2,,,,,34529,15737,BGC
5,,SING,C3,C4,,,,,34529,15737,BGC
6,,SING,C3,O3,,,,,34529,15737,BGC
7,,SING,C3,H3,,,,,34529,15737,BGC
8,,SING,C4,C5,,,,,34529,15737,BGC
9,,SING,C4,O4,,,,,34529,15737,BGC
10,,SING,C4,H4,,,,,34529,15737,BGC
11,,SING,C5,C6,,,,,34529,15737,BGC
12,,SING,C5,O5,,,,,34529,15737,BGC
13,,SING,C5,H5,,,,,34529,15737,BGC
14,,SING,C6,O6,,,,,34529,15737,BGC
15,,SING,C6,H6C1,,,,,34529,15737,BGC
16,,SING,C6,H6C2,,,,,34529,15737,BGC
17,,SING,C1,O1,,,,,34529,15737,BGC
18,,SING,C1,O5,,,,,34529,15737,BGC
19,,SING,C1,H1,,,,,34529,15737,BGC
20,,SING,O1,HA,,,,,34529,15737,BGC
21,,SING,O2,HB,,,,,34529,15737,BGC
22,,SING,O3,HC,,,,,34529,15737,BGC
23,,SING,O4,HD,,,,,34529,15737,BGC
24,,SING,O6,H6,,,,,34529,15737,BGC
1,,DOUB,C,O,no,N,1,,34721,15747,ACE
2,,SING,C,CH3,no,N,2,,34721,15747,ACE
3,,SING,C,H,no,N,3,,34721,15747,ACE
4,,SING,CH3,H1,no,N,4,,34721,15747,ACE
5,,SING,CH3,H2,no,N,5,,34721,15747,ACE
6,,SING,CH3,H3,no,N,6,,34721,15747,ACE
1,,SING,N,HN1,no,N,1,,34722,15747,NH2
2,,SING,N,HN2,no,N,2,,34722,15747,NH2
1,,SING,FE,NA,,,1,,35059,15765,HEM_red
2,,SING,FE,NB,,,2,,35059,15765,HEM_red
3,,SING,FE,NC,,,3,,35059,15765,HEM_red
4,,SING,FE,ND,,,4,,35059,15765,HEM_red
5,,DOUB,CHA,C1A,,,5,,35059,15765,HEM_red
6,,SING,CHA,C4D,,,6,,35059,15765,HEM_red
7,,SING,CHA,HHA,,,7,,35059,15765,HEM_red
8,,DOUB,CHB,C4A,,,8,,35059,15765,HEM_red
9,,SING,CHB,C1B,,,9,,35059,15765,HEM_red
10,,SING,CHB,HHB,,,10,,35059,15765,HEM_red
11,,DOUB,CHC,C4B,,,11,,35059,15765,HEM_red
12,,SING,CHC,C1C,,,12,,35059,15765,HEM_red
13,,SING,CHC,HHC,,,13,,35059,15765,HEM_red
14,,SING,CHD,C4C,,,14,,35059,15765,HEM_red
15,,DOUB,CHD,C1D,,,15,,35059,15765,HEM_red
16,,SING,CHD,HHD,,,16,,35059,15765,HEM_red
17,,SING,NA,C1A,,,17,,35059,15765,HEM_red
18,,SING,NA,C4A,,,18,,35059,15765,HEM_red
19,,SING,C1A,C2A,,,19,,35059,15765,HEM_red
20,,DOUB,C2A,C3A,,,20,,35059,15765,HEM_red
21,,SING,C2A,CAA,,,21,,35059,15765,HEM_red
22,,SING,C3A,C4A,,,22,,35059,15765,HEM_red
23,,SING,C3A,CMA,,,23,,35059,15765,HEM_red
24,,SING,CMA,1HMA,,,24,,35059,15765,HEM_red
25,,SING,CMA,2HMA,,,25,,35059,15765,HEM_red
26,,SING,CMA,3HMA,,,26,,35059,15765,HEM_red
27,,SING,CAA,CBA,,,27,,35059,15765,HEM_red
28,,SING,CAA,1HAA,,,28,,35059,15765,HEM_red
29,,SING,CAA,2HAA,,,29,,35059,15765,HEM_red
30,,SING,CBA,CGA,,,30,,35059,15765,HEM_red
31,,SING,CBA,1HBA,,,31,,35059,15765,HEM_red
32,,SING,CBA,2HBA,,,32,,35059,15765,HEM_red
33,,DOUB,CGA,O1A,,,33,,35059,15765,HEM_red
34,,SING,CGA,O2A,,,34,,35059,15765,HEM_red
35,,SING,O2A,H2A,,,35,,35059,15765,HEM_red
36,,DOUB,NB,C1B,,,36,,35059,15765,HEM_red
37,,SING,NB,C4B,,,37,,35059,15765,HEM_red
38,,SING,C1B,C2B,,,38,,35059,15765,HEM_red
39,,DOUB,C2B,C3B,,,39,,35059,15765,HEM_red
40,,SING,C2B,CMB,,,40,,35059,15765,HEM_red
41,,SING,C3B,C4B,,,41,,35059,15765,HEM_red
42,,SING,C3B,CAB,,,42,,35059,15765,HEM_red
43,,SING,CMB,1HMB,,,43,,35059,15765,HEM_red
44,,SING,CMB,2HMB,,,44,,35059,15765,HEM_red
45,,SING,CMB,3HMB,,,45,,35059,15765,HEM_red
46,,DOUB,CAB,CBB,,,46,,35059,15765,HEM_red
47,,SING,CAB,HAB,,,47,,35059,15765,HEM_red
48,,SING,CBB,1HBB,,,48,,35059,15765,HEM_red
49,,SING,CBB,2HBB,,,49,,35059,15765,HEM_red
50,,SING,NC,C1C,,,50,,35059,15765,HEM_red
51,,SING,NC,C4C,,,51,,35059,15765,HEM_red
52,,DOUB,C1C,C2C,,,52,,35059,15765,HEM_red
53,,SING,C2C,C3C,,,53,,35059,15765,HEM_red
54,,SING,C2C,CMC,,,54,,35059,15765,HEM_red
55,,DOUB,C3C,C4C,,,55,,35059,15765,HEM_red
56,,SING,C3C,CAC,,,56,,35059,15765,HEM_red
57,,SING,CMC,1HMC,,,57,,35059,15765,HEM_red
58,,SING,CMC,2HMC,,,58,,35059,15765,HEM_red
59,,SING,CMC,3HMC,,,59,,35059,15765,HEM_red
60,,DOUB,CAC,CBC,,,60,,35059,15765,HEM_red
61,,SING,CAC,HAC,,,61,,35059,15765,HEM_red
62,,SING,CBC,1HBC,,,62,,35059,15765,HEM_red
63,,SING,CBC,2HBC,,,63,,35059,15765,HEM_red
64,,SING,ND,C1D,,,64,,35059,15765,HEM_red
65,,DOUB,ND,C4D,,,65,,35059,15765,HEM_red
66,,SING,C1D,C2D,,,66,,35059,15765,HEM_red
67,,DOUB,C2D,C3D,,,67,,35059,15765,HEM_red
68,,SING,C2D,CMD,,,68,,35059,15765,HEM_red
69,,SING,C3D,C4D,,,69,,35059,15765,HEM_red
70,,SING,C3D,CAD,,,70,,35059,15765,HEM_red
71,,SING,CMD,1HMD,,,71,,35059,15765,HEM_red
72,,SING,CMD,2HMD,,,72,,35059,15765,HEM_red
73,,SING,CMD,3HMD,,,73,,35059,15765,HEM_red
74,,SING,CAD,CBD,,,74,,35059,15765,HEM_red
75,,SING,CAD,1HAD,,,75,,35059,15765,HEM_red
76,,SING,CAD,2HAD,,,76,,35059,15765,HEM_red
77,,SING,CBD,CGD,,,77,,35059,15765,HEM_red
78,,SING,CBD,1HBD,,,78,,35059,15765,HEM_red
79,,SING,CBD,2HBD,,,79,,35059,15765,HEM_red
80,,DOUB,CGD,O1D,,,80,,35059,15765,HEM_red
81,,SING,CGD,O2D,,,81,,35059,15765,HEM_red
82,,SING,O2D,H2D,,,82,,35059,15765,HEM_red
1,,SING,O1,N1,,,,,35205,15774,MTN
2,,SING,O1,HO1,,,,,35205,15774,MTN
3,,SING,N1,C1,,,,,35205,15774,MTN
4,,SING,N1,C5,,,,,35205,15774,MTN
5,,SING,C1,C2,,,,,35205,15774,MTN
6,,SING,C1,C8,,,,,35205,15774,MTN
7,,SING,C1,C9,,,,,35205,15774,MTN
8,,DOUB,C2,C3,,,,,35205,15774,MTN
9,,SING,C2,H2,,,,,35205,15774,MTN
10,,SING,C3,C4,,,,,35205,15774,MTN
11,,SING,C3,C5,,,,,35205,15774,MTN
12,,SING,C4,S1,,,,,35205,15774,MTN
13,,SING,C4,H41,,,,,35205,15774,MTN
14,,SING,C4,H42,,,,,35205,15774,MTN
15,,SING,S1,HS1,,,,,35205,15774,MTN
16,,SING,C5,C6,,,,,35205,15774,MTN
17,,SING,C5,C7,,,,,35205,15774,MTN
18,,SING,C6,H61,,,,,35205,15774,MTN
19,,SING,C6,H62,,,,,35205,15774,MTN
20,,SING,C6,H63,,,,,35205,15774,MTN
21,,SING,C7,H71,,,,,35205,15774,MTN
22,,SING,C7,H72,,,,,35205,15774,MTN
23,,SING,C7,H73,,,,,35205,15774,MTN
24,,SING,C8,H81,,,,,35205,15774,MTN
25,,SING,C8,H82,,,,,35205,15774,MTN
26,,SING,C8,H83,,,,,35205,15774,MTN
27,,SING,C9,H91,,,,,35205,15774,MTN
28,,SING,C9,H92,,,,,35205,15774,MTN
29,,SING,C9,H93,,,,,35205,15774,MTN
1,,DOUB,C,O,no,N,1,,35291,15778,ACE
2,,SING,C,CH3,no,N,2,,35291,15778,ACE
3,,SING,C,H,no,N,3,,35291,15778,ACE
4,,SING,CH3,H1,no,N,4,,35291,15778,ACE
5,,SING,CH3,H2,no,N,5,,35291,15778,ACE
6,,SING,CH3,H3,no,N,6,,35291,15778,ACE
1,,SING,N,CA,no,N,1,,35292,15778,TYS
2,,SING,N,H,no,N,2,,35292,15778,TYS
3,,SING,N,HN2,no,N,3,,35292,15778,TYS
4,,SING,CA,CB,no,N,4,,35292,15778,TYS
5,,SING,CA,C,no,N,5,,35292,15778,TYS
6,,SING,CA,HA,no,N,6,,35292,15778,TYS
7,,SING,CB,CG,no,N,7,,35292,15778,TYS
8,,SING,CB,HB2,no,N,8,,35292,15778,TYS
9,,SING,CB,HB3,no,N,9,,35292,15778,TYS
10,,DOUB,CG,CD1,yes,N,10,,35292,15778,TYS
11,,SING,CG,CD2,yes,N,11,,35292,15778,TYS
12,,SING,CD1,CE1,yes,N,12,,35292,15778,TYS
13,,SING,CD1,HD1,no,N,13,,35292,15778,TYS
14,,DOUB,CD2,CE2,yes,N,14,,35292,15778,TYS
15,,SING,CD2,HD2,no,N,15,,35292,15778,TYS
16,,DOUB,CE1,CZ,yes,N,16,,35292,15778,TYS
17,,SING,CE1,HE1,no,N,17,,35292,15778,TYS
18,,SING,CE2,CZ,yes,N,18,,35292,15778,TYS
19,,SING,CE2,HE2,no,N,19,,35292,15778,TYS
20,,SING,CZ,OH,no,N,20,,35292,15778,TYS
21,,SING,OH,S,no,N,21,,35292,15778,TYS
22,,DOUB,S,O1,no,N,22,,35292,15778,TYS
23,,DOUB,S,O2,no,N,23,,35292,15778,TYS
24,,SING,S,O3,no,N,24,,35292,15778,TYS
25,,SING,O3,HO3,no,N,25,,35292,15778,TYS
26,,DOUB,C,O,no,N,26,,35292,15778,TYS
27,,SING,C,OXT,no,N,27,,35292,15778,TYS
28,,SING,OXT,HXT,no,N,28,,35292,15778,TYS
1,,SING,N,HN1,no,N,1,,35293,15778,NH2
2,,SING,N,HN2,no,N,2,,35293,15778,NH2
1,,DOUB,PA,O1A,,,,,35501,15788,FAD
2,,SING,PA,O2A,,,,,35501,15788,FAD
3,,SING,PA,O5B,,,,,35501,15788,FAD
4,,SING,PA,O3P,,,,,35501,15788,FAD
5,,SING,O2A,HOA2,,,,,35501,15788,FAD
6,,SING,O5B,C5B,,,,,35501,15788,FAD
7,,SING,C5B,C4B,,,,,35501,15788,FAD
8,,SING,C5B,H51A,,,,,35501,15788,FAD
9,,SING,C5B,H52A,,,,,35501,15788,FAD
10,,SING,C4B,O4B,,,,,35501,15788,FAD
11,,SING,C4B,C3B,,,,,35501,15788,FAD
12,,SING,C4B,H4B,,,,,35501,15788,FAD
13,,SING,O4B,C1B,,,,,35501,15788,FAD
14,,SING,C3B,O3B,,,,,35501,15788,FAD
15,,SING,C3B,C2B,,,,,35501,15788,FAD
16,,SING,C3B,H3B,,,,,35501,15788,FAD
17,,SING,O3B,HO3A,,,,,35501,15788,FAD
18,,SING,C2B,O2B,,,,,35501,15788,FAD
19,,SING,C2B,C1B,,,,,35501,15788,FAD
20,,SING,C2B,H2B,,,,,35501,15788,FAD
21,,SING,O2B,HO2A,,,,,35501,15788,FAD
22,,SING,C1B,N9A,,,,,35501,15788,FAD
23,,SING,C1B,H1B,,,,,35501,15788,FAD
24,,SING,N9A,C8A,,,,,35501,15788,FAD
25,,SING,N9A,C4A,,,,,35501,15788,FAD
26,,DOUB,C8A,N7A,,,,,35501,15788,FAD
27,,SING,C8A,H8A,,,,,35501,15788,FAD
28,,SING,N7A,C5A,,,,,35501,15788,FAD
29,,SING,C5A,C6A,,,,,35501,15788,FAD
30,,DOUB,C5A,C4A,,,,,35501,15788,FAD
31,,SING,C6A,N6A,,,,,35501,15788,FAD
32,,DOUB,C6A,N1A,,,,,35501,15788,FAD
33,,SING,N6A,H61A,,,,,35501,15788,FAD
34,,SING,N6A,H62A,,,,,35501,15788,FAD
35,,SING,N1A,C2A,,,,,35501,15788,FAD
36,,DOUB,C2A,N3A,,,,,35501,15788,FAD
37,,SING,C2A,H2A,,,,,35501,15788,FAD
38,,SING,N3A,C4A,,,,,35501,15788,FAD
39,,SING,N1,C2,,,,,35501,15788,FAD
40,,DOUB,N1,C10,,,,,35501,15788,FAD
41,,DOUB,C2,O2,,,,,35501,15788,FAD
42,,SING,C2,N3,,,,,35501,15788,FAD
43,,SING,N3,C4,,,,,35501,15788,FAD
44,,SING,N3,HN3,,,,,35501,15788,FAD
45,,DOUB,C4,O4,,,,,35501,15788,FAD
46,,SING,C4,C4X,,,,,35501,15788,FAD
47,,DOUB,C4X,N5,,,,,35501,15788,FAD
48,,SING,C4X,C10,,,,,35501,15788,FAD
49,,SING,N5,C5X,,,,,35501,15788,FAD
50,,DOUB,C5X,C6,,,,,35501,15788,FAD
51,,SING,C5X,C9A,,,,,35501,15788,FAD
52,,SING,C6,C7,,,,,35501,15788,FAD
53,,SING,C6,H6,,,,,35501,15788,FAD
54,,SING,C7,C7M,,,,,35501,15788,FAD
55,,DOUB,C7,C8,,,,,35501,15788,FAD
56,,SING,C7M,HM71,,,,,35501,15788,FAD
57,,SING,C7M,HM72,,,,,35501,15788,FAD
58,,SING,C7M,HM73,,,,,35501,15788,FAD
59,,SING,C8,C8M,,,,,35501,15788,FAD
60,,SING,C8,C9,,,,,35501,15788,FAD
61,,SING,C8M,HM81,,,,,35501,15788,FAD
62,,SING,C8M,HM82,,,,,35501,15788,FAD
63,,SING,C8M,HM83,,,,,35501,15788,FAD
64,,DOUB,C9,C9A,,,,,35501,15788,FAD
65,,SING,C9,H9,,,,,35501,15788,FAD
66,,SING,C9A,N10,,,,,35501,15788,FAD
67,,SING,N10,C10,,,,,35501,15788,FAD
68,,SING,N10,C1',,,,,35501,15788,FAD
69,,SING,C1',C2',,,,,35501,15788,FAD
70,,SING,C1',H1'1,,,,,35501,15788,FAD
71,,SING,C1',H1'2,,,,,35501,15788,FAD
72,,SING,C2',O2',,,,,35501,15788,FAD
73,,SING,C2',C3',,,,,35501,15788,FAD
74,,SING,C2',H2',,,,,35501,15788,FAD
75,,SING,O2',HO2',,,,,35501,15788,FAD
76,,SING,C3',O3',,,,,35501,15788,FAD
77,,SING,C3',C4',,,,,35501,15788,FAD
78,,SING,C3',H3',,,,,35501,15788,FAD
79,,SING,O3',HO3',,,,,35501,15788,FAD
80,,SING,C4',O4',,,,,35501,15788,FAD
81,,SING,C4',C5',,,,,35501,15788,FAD
82,,SING,C4',H4',,,,,35501,15788,FAD
83,,SING,O4',HO4',,,,,35501,15788,FAD
84,,SING,C5',O5',,,,,35501,15788,FAD
85,,SING,C5',H5'1,,,,,35501,15788,FAD
86,,SING,C5',H5'2,,,,,35501,15788,FAD
87,,SING,O5',P,,,,,35501,15788,FAD
88,,DOUB,P,O1P,,,,,35501,15788,FAD
89,,SING,P,O2P,,,,,35501,15788,FAD
90,,SING,P,O3P,,,,,35501,15788,FAD
23,,SING,N3,C4,,,,,37213,15860,D33
91,,SING,O2P,HOP2,,,,,35501,15788,FAD
1,,SING,C1,C2,no,N,1,,35730,15800,LAT
2,,SING,C1,O1,no,N,2,,35730,15800,LAT
3,,SING,C1,O5,no,N,3,,35730,15800,LAT
4,,SING,C1,H1,no,N,4,,35730,15800,LAT
5,,SING,C2,C3,no,N,5,,35730,15800,LAT
6,,SING,C2,O2,no,N,6,,35730,15800,LAT
7,,SING,C2,H2,no,N,7,,35730,15800,LAT
8,,SING,C3,C4,no,N,8,,35730,15800,LAT
9,,SING,C3,O3,no,N,9,,35730,15800,LAT
10,,SING,C3,H3,no,N,10,,35730,15800,LAT
11,,SING,C4,C5,no,N,11,,35730,15800,LAT
12,,SING,C4,O4,no,N,12,,35730,15800,LAT
13,,SING,C4,H4,no,N,13,,35730,15800,LAT
14,,SING,C5,C6,no,N,14,,35730,15800,LAT
15,,SING,C5,O5,no,N,15,,35730,15800,LAT
16,,SING,C5,H5,no,N,16,,35730,15800,LAT
17,,SING,C6,O6,no,N,17,,35730,15800,LAT
18,,SING,C6,H61,no,N,18,,35730,15800,LAT
19,,SING,C6,H62,no,N,19,,35730,15800,LAT
20,,SING,O1,C4',no,N,20,,35730,15800,LAT
21,,SING,O2,HO2,no,N,21,,35730,15800,LAT
22,,SING,O3,HO3,no,N,22,,35730,15800,LAT
23,,SING,O4,HO4,no,N,23,,35730,15800,LAT
24,,SING,O6,HO6,no,N,24,,35730,15800,LAT
25,,SING,C1',C2',no,N,25,,35730,15800,LAT
26,,SING,C1',O1',no,N,26,,35730,15800,LAT
27,,SING,C1',O5',no,N,27,,35730,15800,LAT
28,,SING,C1',H1',no,N,28,,35730,15800,LAT
29,,SING,C2',C3',no,N,29,,35730,15800,LAT
30,,SING,C2',O2',no,N,30,,35730,15800,LAT
31,,SING,C2',H2',no,N,31,,35730,15800,LAT
32,,SING,C3',C4',no,N,32,,35730,15800,LAT
33,,SING,C3',O3',no,N,33,,35730,15800,LAT
34,,SING,C3',H3',no,N,34,,35730,15800,LAT
35,,SING,C4',C5',no,N,35,,35730,15800,LAT
36,,SING,C4',H4',no,N,36,,35730,15800,LAT
37,,SING,C5',C6',no,N,37,,35730,15800,LAT
38,,SING,C5',O5',no,N,38,,35730,15800,LAT
39,,SING,C5',H5',no,N,39,,35730,15800,LAT
40,,SING,C6',O6',no,N,40,,35730,15800,LAT
41,,SING,C6',H6'1,no,N,41,,35730,15800,LAT
42,,SING,C6',H6'2,no,N,42,,35730,15800,LAT
43,,SING,O1',HO1',no,N,43,,35730,15800,LAT
44,,SING,O2',HO2',no,N,44,,35730,15800,LAT
45,,SING,O3',HO3',no,N,45,,35730,15800,LAT
46,,SING,O6',HO6',no,N,46,,35730,15800,LAT
1,,DOUB,PG,O1G,no,N,1,,35788,15803,GNP
2,,SING,PG,O2G,no,N,2,,35788,15803,GNP
3,,SING,PG,O3G,no,N,3,,35788,15803,GNP
4,,SING,PG,N3B,no,N,4,,35788,15803,GNP
5,,SING,O2G,HOG2,no,N,5,,35788,15803,GNP
6,,SING,O3G,HOG3,no,N,6,,35788,15803,GNP
7,,SING,N3B,PB,no,N,7,,35788,15803,GNP
8,,SING,N3B,HNB3,no,N,8,,35788,15803,GNP
9,,DOUB,PB,O1B,no,N,9,,35788,15803,GNP
10,,SING,PB,O2B,no,N,10,,35788,15803,GNP
11,,SING,PB,O3A,no,N,11,,35788,15803,GNP
12,,SING,O2B,HOB2,no,N,12,,35788,15803,GNP
13,,SING,O3A,PA,no,N,13,,35788,15803,GNP
14,,DOUB,PA,O1A,no,N,14,,35788,15803,GNP
15,,SING,PA,O2A,no,N,15,,35788,15803,GNP
16,,SING,PA,O5',no,N,16,,35788,15803,GNP
17,,SING,O2A,HOA2,no,N,17,,35788,15803,GNP
18,,SING,O5',C5',no,N,18,,35788,15803,GNP
19,,SING,C5',C4',no,N,19,,35788,15803,GNP
20,,SING,C5',H5'2,no,N,20,,35788,15803,GNP
21,,SING,C5',H5'1,no,N,21,,35788,15803,GNP
22,,SING,C4',O4',no,N,22,,35788,15803,GNP
23,,SING,C4',C3',no,N,23,,35788,15803,GNP
24,,SING,C4',H4',no,N,24,,35788,15803,GNP
25,,SING,O4',C1',no,N,25,,35788,15803,GNP
26,,SING,C3',O3',no,N,26,,35788,15803,GNP
27,,SING,C3',C2',no,N,27,,35788,15803,GNP
28,,SING,C3',H3',no,N,28,,35788,15803,GNP
29,,SING,O3',HO3',no,N,29,,35788,15803,GNP
30,,SING,C2',O2',no,N,30,,35788,15803,GNP
31,,SING,C2',C1',no,N,31,,35788,15803,GNP
32,,SING,C2',H2',no,N,32,,35788,15803,GNP
33,,SING,O2',HO2',no,N,33,,35788,15803,GNP
34,,SING,C1',N9,no,N,34,,35788,15803,GNP
35,,SING,C1',H1',no,N,35,,35788,15803,GNP
36,,SING,N9,C8,yes,N,36,,35788,15803,GNP
37,,SING,N9,C4,yes,N,37,,35788,15803,GNP
38,,DOUB,C8,N7,yes,N,38,,35788,15803,GNP
39,,SING,C8,H8,no,N,39,,35788,15803,GNP
40,,SING,N7,C5,yes,N,40,,35788,15803,GNP
41,,SING,C5,C6,yes,N,41,,35788,15803,GNP
42,,DOUB,C5,C4,yes,N,42,,35788,15803,GNP
43,,DOUB,C6,O6,no,N,43,,35788,15803,GNP
44,,SING,C6,N1,yes,N,44,,35788,15803,GNP
45,,SING,N1,C2,yes,N,45,,35788,15803,GNP
46,,SING,N1,HN1,no,N,46,,35788,15803,GNP
47,,SING,C2,N2,no,N,47,,35788,15803,GNP
48,,DOUB,C2,N3,yes,N,48,,35788,15803,GNP
49,,SING,N2,HN21,no,N,49,,35788,15803,GNP
50,,SING,N2,HN22,no,N,50,,35788,15803,GNP
51,,SING,N3,C4,yes,N,51,,35788,15803,GNP
1,,DOUB,PB,O1B,no,N,1,,35916,15809,GDP
2,,SING,PB,O2B,no,N,2,,35916,15809,GDP
3,,SING,PB,O3B,no,N,3,,35916,15809,GDP
4,,SING,PB,O3A,no,N,4,,35916,15809,GDP
5,,SING,O2B,HOB2,no,N,5,,35916,15809,GDP
6,,SING,O3B,HOB3,no,N,6,,35916,15809,GDP
7,,SING,O3A,PA,no,N,7,,35916,15809,GDP
8,,DOUB,PA,O1A,no,N,8,,35916,15809,GDP
9,,SING,PA,O2A,no,N,9,,35916,15809,GDP
10,,SING,PA,O5',no,N,10,,35916,15809,GDP
11,,SING,O2A,HOA2,no,N,11,,35916,15809,GDP
12,,SING,O5',C5',no,N,12,,35916,15809,GDP
13,,SING,C5',C4',no,N,13,,35916,15809,GDP
14,,SING,C5',H5',no,N,14,,35916,15809,GDP
15,,SING,C5',H5'',no,N,15,,35916,15809,GDP
16,,SING,C4',O4',no,N,16,,35916,15809,GDP
17,,SING,C4',C3',no,N,17,,35916,15809,GDP
18,,SING,C4',H4',no,N,18,,35916,15809,GDP
19,,SING,O4',C1',no,N,19,,35916,15809,GDP
20,,SING,C3',O3',no,N,20,,35916,15809,GDP
21,,SING,C3',C2',no,N,21,,35916,15809,GDP
22,,SING,C3',H3',no,N,22,,35916,15809,GDP
23,,SING,O3',HO3',no,N,23,,35916,15809,GDP
24,,SING,C2',O2',no,N,24,,35916,15809,GDP
25,,SING,C2',C1',no,N,25,,35916,15809,GDP
26,,SING,C2',H2',no,N,26,,35916,15809,GDP
27,,SING,O2',HO2',no,N,27,,35916,15809,GDP
28,,SING,C1',N9,no,N,28,,35916,15809,GDP
29,,SING,C1',H1',no,N,29,,35916,15809,GDP
30,,SING,N9,C8,yes,N,30,,35916,15809,GDP
31,,SING,N9,C4,yes,N,31,,35916,15809,GDP
32,,DOUB,C8,N7,yes,N,32,,35916,15809,GDP
33,,SING,C8,H8,no,N,33,,35916,15809,GDP
34,,SING,N7,C5,yes,N,34,,35916,15809,GDP
35,,SING,C5,C6,no,N,35,,35916,15809,GDP
36,,DOUB,C5,C4,yes,N,36,,35916,15809,GDP
37,,DOUB,C6,O6,no,N,37,,35916,15809,GDP
38,,SING,C6,N1,no,N,38,,35916,15809,GDP
39,,SING,N1,C2,no,N,39,,35916,15809,GDP
40,,SING,N1,HN1,no,N,40,,35916,15809,GDP
41,,SING,C2,N2,no,N,41,,35916,15809,GDP
42,,DOUB,C2,N3,no,N,42,,35916,15809,GDP
43,,SING,N2,HN21,no,N,43,,35916,15809,GDP
44,,SING,N2,HN22,no,N,44,,35916,15809,GDP
45,,SING,N3,C4,no,N,45,,35916,15809,GDP
1,,DOUB,C1,O1,no,N,1,,35917,15809,MYR
2,,SING,C1,O2,no,N,2,,35917,15809,MYR
3,,SING,C1,C2,no,N,3,,35917,15809,MYR
4,,SING,O2,HO2,no,N,4,,35917,15809,MYR
5,,SING,C2,C3,no,N,5,,35917,15809,MYR
6,,SING,C2,H21,no,N,6,,35917,15809,MYR
7,,SING,C2,H22,no,N,7,,35917,15809,MYR
8,,SING,C3,C4,no,N,8,,35917,15809,MYR
9,,SING,C3,H31,no,N,9,,35917,15809,MYR
10,,SING,C3,H32,no,N,10,,35917,15809,MYR
11,,SING,C4,C5,no,N,11,,35917,15809,MYR
12,,SING,C4,H41,no,N,12,,35917,15809,MYR
13,,SING,C4,H42,no,N,13,,35917,15809,MYR
14,,SING,C5,C6,no,N,14,,35917,15809,MYR
15,,SING,C5,H51,no,N,15,,35917,15809,MYR
16,,SING,C5,H52,no,N,16,,35917,15809,MYR
17,,SING,C6,C7,no,N,17,,35917,15809,MYR
18,,SING,C6,H61,no,N,18,,35917,15809,MYR
19,,SING,C6,H62,no,N,19,,35917,15809,MYR
20,,SING,C7,C8,no,N,20,,35917,15809,MYR
21,,SING,C7,H71,no,N,21,,35917,15809,MYR
22,,SING,C7,H72,no,N,22,,35917,15809,MYR
23,,SING,C8,C9,no,N,23,,35917,15809,MYR
24,,SING,C8,H81,no,N,24,,35917,15809,MYR
25,,SING,C8,H82,no,N,25,,35917,15809,MYR
26,,SING,C9,C10,no,N,26,,35917,15809,MYR
27,,SING,C9,H91,no,N,27,,35917,15809,MYR
28,,SING,C9,H92,no,N,28,,35917,15809,MYR
29,,SING,C10,C11,no,N,29,,35917,15809,MYR
30,,SING,C10,H101,no,N,30,,35917,15809,MYR
31,,SING,C10,H102,no,N,31,,35917,15809,MYR
32,,SING,C11,C12,no,N,32,,35917,15809,MYR
33,,SING,C11,H111,no,N,33,,35917,15809,MYR
34,,SING,C11,H112,no,N,34,,35917,15809,MYR
35,,SING,C12,C13,no,N,35,,35917,15809,MYR
36,,SING,C12,H121,no,N,36,,35917,15809,MYR
37,,SING,C12,H122,no,N,37,,35917,15809,MYR
38,,SING,C13,C14,no,N,38,,35917,15809,MYR
39,,SING,C13,H131,no,N,39,,35917,15809,MYR
40,,SING,C13,H132,no,N,40,,35917,15809,MYR
41,,SING,C14,H141,no,N,41,,35917,15809,MYR
42,,SING,C14,H142,no,N,42,,35917,15809,MYR
43,,SING,C14,H143,no,N,43,,35917,15809,MYR
1,,SING,N1A,C2A,yes,N,1,,36869,15848,COA
2,,DOUB,N1A,C6A,yes,N,2,,36869,15848,COA
3,,DOUB,C2A,N3A,yes,N,3,,36869,15848,COA
4,,SING,C2A,H2A,no,N,4,,36869,15848,COA
5,,SING,N3A,C4A,yes,N,5,,36869,15848,COA
6,,DOUB,C4A,C5A,yes,N,6,,36869,15848,COA
7,,SING,C4A,N9A,yes,N,7,,36869,15848,COA
8,,SING,C5A,C6A,yes,N,8,,36869,15848,COA
9,,SING,C5A,N7A,yes,N,9,,36869,15848,COA
10,,SING,C6A,N6A,no,N,10,,36869,15848,COA
11,,SING,N6A,H61A,no,N,11,,36869,15848,COA
12,,SING,N6A,H62A,no,N,12,,36869,15848,COA
13,,DOUB,N7A,C8A,yes,N,13,,36869,15848,COA
14,,SING,C8A,N9A,yes,N,14,,36869,15848,COA
15,,SING,C8A,H8A,no,N,15,,36869,15848,COA
16,,SING,N9A,C1B,no,N,16,,36869,15848,COA
17,,SING,C1B,C2B,no,N,17,,36869,15848,COA
18,,SING,C1B,O4B,no,N,18,,36869,15848,COA
19,,SING,C1B,H1B,no,N,19,,36869,15848,COA
20,,SING,C2B,O2B,no,N,20,,36869,15848,COA
21,,SING,C2B,C3B,no,N,21,,36869,15848,COA
22,,SING,C2B,H2B,no,N,22,,36869,15848,COA
23,,SING,O2B,HO2A,no,N,23,,36869,15848,COA
24,,SING,C3B,O3B,no,N,24,,36869,15848,COA
25,,SING,C3B,C4B,no,N,25,,36869,15848,COA
26,,SING,C3B,H3B,no,N,26,,36869,15848,COA
27,,SING,O3B,P3B,no,N,27,,36869,15848,COA
28,,DOUB,P3B,O7A,no,N,28,,36869,15848,COA
29,,SING,P3B,O8A,no,N,29,,36869,15848,COA
30,,SING,P3B,O9A,no,N,30,,36869,15848,COA
31,,SING,O8A,HOA8,no,N,31,,36869,15848,COA
32,,SING,O9A,HOA9,no,N,32,,36869,15848,COA
33,,SING,C4B,O4B,no,N,33,,36869,15848,COA
34,,SING,C4B,C5B,no,N,34,,36869,15848,COA
35,,SING,C4B,H4B,no,N,35,,36869,15848,COA
36,,SING,C5B,O5B,no,N,36,,36869,15848,COA
37,,SING,C5B,H51A,no,N,37,,36869,15848,COA
38,,SING,C5B,H52A,no,N,38,,36869,15848,COA
39,,SING,O5B,P1A,no,N,39,,36869,15848,COA
40,,DOUB,P1A,O1A,no,N,40,,36869,15848,COA
41,,SING,P1A,O2A,no,N,41,,36869,15848,COA
42,,SING,P1A,O3A,no,N,42,,36869,15848,COA
43,,SING,O2A,HOA2,no,N,43,,36869,15848,COA
44,,SING,O3A,P2A,no,N,44,,36869,15848,COA
45,,DOUB,P2A,O4A,no,N,45,,36869,15848,COA
46,,SING,P2A,O5A,no,N,46,,36869,15848,COA
47,,SING,P2A,O6A,no,N,47,,36869,15848,COA
48,,SING,O5A,HOA5,no,N,48,,36869,15848,COA
49,,SING,O6A,CCP,no,N,49,,36869,15848,COA
50,,SING,CBP,CCP,no,N,50,,36869,15848,COA
51,,SING,CBP,CDP,no,N,51,,36869,15848,COA
52,,SING,CBP,CEP,no,N,52,,36869,15848,COA
53,,SING,CBP,CAP,no,N,53,,36869,15848,COA
54,,SING,CCP,H121,no,N,54,,36869,15848,COA
55,,SING,CCP,H122,no,N,55,,36869,15848,COA
56,,SING,CDP,H131,no,N,56,,36869,15848,COA
57,,SING,CDP,H132,no,N,57,,36869,15848,COA
58,,SING,CDP,H133,no,N,58,,36869,15848,COA
59,,SING,CEP,H141,no,N,59,,36869,15848,COA
60,,SING,CEP,H142,no,N,60,,36869,15848,COA
61,,SING,CEP,H143,no,N,61,,36869,15848,COA
62,,SING,CAP,OAP,no,N,62,,36869,15848,COA
63,,SING,CAP,C9P,no,N,63,,36869,15848,COA
64,,SING,CAP,H10,no,N,64,,36869,15848,COA
65,,SING,OAP,HO1,no,N,65,,36869,15848,COA
66,,DOUB,C9P,O9P,no,N,66,,36869,15848,COA
67,,SING,C9P,N8P,no,N,67,,36869,15848,COA
68,,SING,N8P,C7P,no,N,68,,36869,15848,COA
69,,SING,N8P,HN8,no,N,69,,36869,15848,COA
70,,SING,C7P,C6P,no,N,70,,36869,15848,COA
71,,SING,C7P,H71,no,N,71,,36869,15848,COA
72,,SING,C7P,H72,no,N,72,,36869,15848,COA
73,,SING,C6P,C5P,no,N,73,,36869,15848,COA
74,,SING,C6P,H61,no,N,74,,36869,15848,COA
75,,SING,C6P,H62,no,N,75,,36869,15848,COA
76,,DOUB,C5P,O5P,no,N,76,,36869,15848,COA
77,,SING,C5P,N4P,no,N,77,,36869,15848,COA
78,,SING,N4P,C3P,no,N,78,,36869,15848,COA
79,,SING,N4P,HN4,no,N,79,,36869,15848,COA
80,,SING,C3P,C2P,no,N,80,,36869,15848,COA
81,,SING,C3P,H31,no,N,81,,36869,15848,COA
82,,SING,C3P,H32,no,N,82,,36869,15848,COA
83,,SING,C2P,S1P,no,N,83,,36869,15848,COA
84,,SING,C2P,H21,no,N,84,,36869,15848,COA
85,,SING,C2P,H22,no,N,85,,36869,15848,COA
86,,SING,S1P,HS1,no,N,86,,36869,15848,COA
1,,SING,C9,C8,no,N,1,,37046,15854,ITL
2,,SING,C14,C8,no,N,2,,37046,15854,ITL
3,,SING,C8,C7,no,N,3,,37046,15854,ITL
4,,SING,C8,H8,no,N,4,,37046,15854,ITL
5,,SING,C10,C5,no,N,5,,37046,15854,ITL
6,,SING,C5,C4,no,N,6,,37046,15854,ITL
7,,SING,C5,C6,no,N,7,,37046,15854,ITL
8,,SING,C5,H5,no,N,8,,37046,15854,ITL
9,,SING,C7,C6,no,N,9,,37046,15854,ITL
10,,SING,C6,H6,no,N,10,,37046,15854,ITL
11,,SING,C6,H6A,no,N,11,,37046,15854,ITL
12,,DOUB,O6,C34,no,N,12,,37046,15854,ITL
13,,SING,C27,N1,no,N,13,,37046,15854,ITL
14,,SING,N1,C26,no,N,14,,37046,15854,ITL
15,,SING,N1,C33,no,N,15,,37046,15854,ITL
16,,SING,C1,C2,no,N,16,,37046,15854,ITL
17,,SING,C2,C3,no,N,17,,37046,15854,ITL
18,,SING,C2,H2,no,N,18,,37046,15854,ITL
19,,SING,C2,H2A,no,N,19,,37046,15854,ITL
20,,SING,C37,N3,no,N,20,,37046,15854,ITL
21,,SING,C30,N3,no,N,21,,37046,15854,ITL
22,,SING,N3,C31,no,N,22,,37046,15854,ITL
23,,SING,C3,C4,no,N,23,,37046,15854,ITL
24,,SING,C4,H4,no,N,24,,37046,15854,ITL
25,,SING,C4,H4A,no,N,25,,37046,15854,ITL
26,,SING,C24,O1,no,N,26,,37046,15854,ITL
27,,SING,O1,HO1,no,N,27,,37046,15854,ITL
28,,DOUB,O2,C24,no,N,28,,37046,15854,ITL
29,,SING,C24,C23,no,N,29,,37046,15854,ITL
30,,SING,C23,C22,no,N,30,,37046,15854,ITL
31,,SING,C23,H23,no,N,31,,37046,15854,ITL
32,,SING,C23,H23A,no,N,32,,37046,15854,ITL
33,,SING,C22,C20,no,N,33,,37046,15854,ITL
34,,SING,C22,H22,no,N,34,,37046,15854,ITL
35,,SING,C22,H22A,no,N,35,,37046,15854,ITL
36,,SING,C21,C20,no,N,36,,37046,15854,ITL
37,,SING,C20,C17,no,N,37,,37046,15854,ITL
38,,SING,C20,H20,no,N,38,,37046,15854,ITL
39,,SING,C21,H21,no,N,39,,37046,15854,ITL
40,,SING,C21,H21A,no,N,40,,37046,15854,ITL
41,,SING,C21,H21B,no,N,41,,37046,15854,ITL
42,,SING,C17,C13,no,N,42,,37046,15854,ITL
43,,SING,C17,C16,no,N,43,,37046,15854,ITL
44,,SING,C17,H17,no,N,44,,37046,15854,ITL
45,,SING,C16,C15,no,N,45,,37046,15854,ITL
46,,SING,C16,H16,no,N,46,,37046,15854,ITL
47,,SING,C16,H16A,no,N,47,,37046,15854,ITL
48,,SING,C14,C15,no,N,48,,37046,15854,ITL
49,,SING,C15,H15,no,N,49,,37046,15854,ITL
50,,SING,C15,H15A,no,N,50,,37046,15854,ITL
51,,SING,C13,C14,no,N,51,,37046,15854,ITL
52,,SING,C14,H14,no,N,52,,37046,15854,ITL
53,,SING,C12,C13,no,N,53,,37046,15854,ITL
54,,SING,C18,C13,no,N,54,,37046,15854,ITL
55,,SING,C18,H18,no,N,55,,37046,15854,ITL
56,,SING,C18,H18A,no,N,56,,37046,15854,ITL
57,,SING,C18,H18B,no,N,57,,37046,15854,ITL
58,,SING,C12,C11,no,N,58,,37046,15854,ITL
59,,SING,C12,H12,no,N,59,,37046,15854,ITL
60,,SING,C12,H12A,no,N,60,,37046,15854,ITL
61,,SING,C11,C9,no,N,61,,37046,15854,ITL
62,,SING,C11,H11,no,N,62,,37046,15854,ITL
63,,SING,C11,H11A,no,N,63,,37046,15854,ITL
64,,SING,C9,C10,no,N,64,,37046,15854,ITL
65,,SING,C9,H9,no,N,65,,37046,15854,ITL
66,,SING,C7,H7,no,N,66,,37046,15854,ITL
67,,SING,C7,H7A,no,N,67,,37046,15854,ITL
68,,SING,C1,C10,no,N,68,,37046,15854,ITL
69,,SING,C19,C10,no,N,69,,37046,15854,ITL
70,,SING,C19,H19,no,N,70,,37046,15854,ITL
71,,SING,C19,H19A,no,N,71,,37046,15854,ITL
72,,SING,C19,H19B,no,N,72,,37046,15854,ITL
73,,SING,C1,H1,no,N,73,,37046,15854,ITL
74,,SING,C1,H1A,no,N,74,,37046,15854,ITL
75,,SING,C3,N4,no,N,75,,37046,15854,ITL
76,,SING,C3,H3,no,N,76,,37046,15854,ITL
77,,SING,C41,N4,no,N,77,,37046,15854,ITL
78,,SING,N4,HN4,no,N,78,,37046,15854,ITL
79,,DOUB,O,C41,no,N,79,,37046,15854,ITL
80,,SING,C41,C40,no,N,80,,37046,15854,ITL
81,,SING,C40,C39,no,N,81,,37046,15854,ITL
82,,SING,C40,H40,no,N,82,,37046,15854,ITL
83,,SING,C40,H40A,no,N,83,,37046,15854,ITL
84,,SING,C39,C35,no,N,84,,37046,15854,ITL
85,,SING,C39,H39,no,N,85,,37046,15854,ITL
86,,SING,C39,H39A,no,N,86,,37046,15854,ITL
87,,SING,C35,C36,no,N,87,,37046,15854,ITL
88,,SING,C35,N2,no,N,88,,37046,15854,ITL
89,,SING,C35,H35,no,N,89,,37046,15854,ITL
90,,DOUB,O9,C36,no,N,90,,37046,15854,ITL
91,,SING,C36,O8,no,N,91,,37046,15854,ITL
92,,SING,O8,HO8,no,N,92,,37046,15854,ITL
93,,SING,C29,N2,no,N,93,,37046,15854,ITL
94,,SING,N2,C28,no,N,94,,37046,15854,ITL
95,,SING,C29,C30,no,N,95,,37046,15854,ITL
96,,SING,C29,H29,no,N,96,,37046,15854,ITL
97,,SING,C29,H29A,no,N,97,,37046,15854,ITL
98,,SING,C30,H30,no,N,98,,37046,15854,ITL
99,,SING,C30,H30A,no,N,99,,37046,15854,ITL
100,,SING,C38,C37,no,N,100,,37046,15854,ITL
101,,SING,C37,H37,no,N,101,,37046,15854,ITL
102,,SING,C37,H37A,no,N,102,,37046,15854,ITL
103,,DOUB,O11,C38,no,N,103,,37046,15854,ITL
104,,SING,C38,O10,no,N,104,,37046,15854,ITL
105,,SING,O10,HO10,no,N,105,,37046,15854,ITL
106,,SING,C31,C32,no,N,106,,37046,15854,ITL
107,,SING,C31,H31,no,N,107,,37046,15854,ITL
108,,SING,C31,H31A,no,N,108,,37046,15854,ITL
109,,DOUB,O4,C32,no,N,109,,37046,15854,ITL
110,,SING,C32,O13,no,N,110,,37046,15854,ITL
111,,SING,O13,HO13,no,N,111,,37046,15854,ITL
112,,SING,C28,C27,no,N,112,,37046,15854,ITL
113,,SING,C28,H28,no,N,113,,37046,15854,ITL
114,,SING,C28,H28A,no,N,114,,37046,15854,ITL
115,,SING,C27,H27,no,N,115,,37046,15854,ITL
116,,SING,C27,H27A,no,N,116,,37046,15854,ITL
117,,SING,C33,C34,no,N,117,,37046,15854,ITL
118,,SING,C33,H33,no,N,118,,37046,15854,ITL
119,,SING,C33,H33A,no,N,119,,37046,15854,ITL
120,,SING,C34,O7,no,N,120,,37046,15854,ITL
121,,SING,O7,HO7,no,N,121,,37046,15854,ITL
122,,SING,C26,C25,no,N,122,,37046,15854,ITL
123,,SING,C26,H26,no,N,123,,37046,15854,ITL
124,,SING,C26,H26A,no,N,124,,37046,15854,ITL
125,,DOUB,C25,O3,no,N,125,,37046,15854,ITL
126,,SING,C25,O12,no,N,126,,37046,15854,ITL
127,,SING,O12,HO12,no,N,127,,37046,15854,ITL
1,,SING,O5',C5',,,,,37213,15860,D33
2,,SING,O5',P,,,,,37213,15860,D33
3,,SING,C5',C4',,,,,37213,15860,D33
4,,SING,C5',H5'1,,,,,37213,15860,D33
5,,SING,C5',H5'2,,,,,37213,15860,D33
6,,SING,C4',O4',,,,,37213,15860,D33
7,,SING,C4',C3',,,,,37213,15860,D33
8,,SING,C4',H4',,,,,37213,15860,D33
9,,SING,O4',C1',,,,,37213,15860,D33
10,,SING,C3',O3',,,,,37213,15860,D33
11,,SING,C3',C2',,,,,37213,15860,D33
12,,SING,C3',H3',,,,,37213,15860,D33
13,,SING,O3',HO'3,,,,,37213,15860,D33
14,,SING,C2',H2'1,,,,,37213,15860,D33
15,,SING,C2',H2'2,,,,,37213,15860,D33
16,,SING,C2',C1',,,,,37213,15860,D33
17,,SING,C1',N1,,,,,37213,15860,D33
18,,SING,C1',H1',,,,,37213,15860,D33
19,,DOUB,N1,C2,,,,,37213,15860,D33
20,,SING,N1,C5,,,,,37213,15860,D33
21,,DOUB,C2,N3,,,,,37213,15860,D33
22,,SING,C2,H2,,,,,37213,15860,D33
24,,DOUB,C4,C5,,,,,37213,15860,D33
25,,SING,C4,H4,,,,,37213,15860,D33
26,,DOUB,C5,H5,,,,,37213,15860,D33
27,,SING,P,O1P,,,,,37213,15860,D33
28,,SING,P,O2P,,,,,37213,15860,D33
29,,SING,P,O3P,,,,,37213,15860,D33
30,,SING,O1P,H1P,,,,,37213,15860,D33
31,,SING,O2P,H2P,,,,,37213,15860,D33
1,,DOUB,S,O1S,,,,,37481,15876,SDS
2,,SING,S,O2S,,,,,37481,15876,SDS
3,,SING,S,O3S,,,,,37481,15876,SDS
4,,DOUB,S,O4,,,,,37481,15876,SDS
5,,SING,O2S,C1,,,,,37481,15876,SDS
6,,SING,O3S,H3S,,,,,37481,15876,SDS
7,,SING,C1,C12,,,,,37481,15876,SDS
8,,SING,C1,H1C1,,,,,37481,15876,SDS
9,,SING,C1,H1C2,,,,,37481,15876,SDS
10,,SING,C2,C3,,,,,37481,15876,SDS
11,,SING,C2,H2C1,,,,,37481,15876,SDS
12,,SING,C2,H2C2,,,,,37481,15876,SDS
13,,SING,C2,H2C3,,,,,37481,15876,SDS
14,,SING,C3,C4,,,,,37481,15876,SDS
15,,SING,C3,H3C1,,,,,37481,15876,SDS
16,,SING,C3,H3C2,,,,,37481,15876,SDS
17,,SING,C4,C5,,,,,37481,15876,SDS
18,,SING,C4,H4C1,,,,,37481,15876,SDS
19,,SING,C4,H4C2,,,,,37481,15876,SDS
20,,SING,C5,C6,,,,,37481,15876,SDS
21,,SING,C5,H5C1,,,,,37481,15876,SDS
22,,SING,C5,H5C2,,,,,37481,15876,SDS
23,,SING,C6,C7,,,,,37481,15876,SDS
24,,SING,C6,H6C1,,,,,37481,15876,SDS
25,,SING,C6,H6C2,,,,,37481,15876,SDS
26,,SING,C7,C8,,,,,37481,15876,SDS
27,,SING,C7,H7C1,,,,,37481,15876,SDS
28,,SING,C7,H7C2,,,,,37481,15876,SDS
29,,SING,C8,C9,,,,,37481,15876,SDS
30,,SING,C8,H8C1,,,,,37481,15876,SDS
31,,SING,C8,H8C2,,,,,37481,15876,SDS
32,,SING,C9,C10,,,,,37481,15876,SDS
33,,SING,C9,H9C1,,,,,37481,15876,SDS
34,,SING,C9,H9C2,,,,,37481,15876,SDS
35,,SING,C10,C11,,,,,37481,15876,SDS
36,,SING,C10,H101,,,,,37481,15876,SDS
37,,SING,C10,H102,,,,,37481,15876,SDS
38,,SING,C11,C12,,,,,37481,15876,SDS
39,,SING,C11,H111,,,,,37481,15876,SDS
40,,SING,C11,H112,,,,,37481,15876,SDS
41,,SING,C12,H121,,,,,37481,15876,SDS
42,,SING,C12,H122,,,,,37481,15876,SDS
1,,DOUB,C6,C5,,,,,37532,15879,NAL
2,,SING,C6,C7,,,,,37532,15879,NAL
3,,SING,C5,C4A,,,,,37532,15879,NAL
4,,DOUB,C7,C8,,,,,37532,15879,NAL
5,,DOUB,C4A,C4,,,,,37532,15879,NAL
6,,SING,C4A,C8A,,,,,37532,15879,NAL
7,,SING,C8,C8A,,,,,37532,15879,NAL
8,,SING,C4,C3,,,,,37532,15879,NAL
9,,DOUB,C8A,C1,,,,,37532,15879,NAL
10,,DOUB,C3,C2,,,,,37532,15879,NAL
11,,SING,C1,C2,,,,,37532,15879,NAL
12,,SING,C2,C9,,,,,37532,15879,NAL
13,,SING,C9,C10,,,,,37532,15879,NAL
14,,SING,C10,N,,,,,37532,15879,NAL
15,,SING,C10,C11,,,,,37532,15879,NAL
16,,DOUB,C11,O2,,,,,37532,15879,NAL
17,,SING,C11,OXT,,,,,37532,15879,NAL
18,,SING,C1,H1,,,,,37532,15879,NAL
19,,SING,C3,H3,,,,,37532,15879,NAL
20,,SING,C4,H4,,,,,37532,15879,NAL
21,,SING,C5,H5,,,,,37532,15879,NAL
22,,SING,C6,H6,,,,,37532,15879,NAL
23,,SING,C7,H7,,,,,37532,15879,NAL
24,,SING,C8,H8,,,,,37532,15879,NAL
25,,SING,C9,H91,,,,,37532,15879,NAL
26,,SING,C9,H92,,,,,37532,15879,NAL
27,,SING,C10,H10,,,,,37532,15879,NAL
28,,SING,N,HN1,,,,,37532,15879,NAL
29,,SING,N,HN2,,,,,37532,15879,NAL
30,,SING,OXT,HXT,,,,,37532,15879,NAL
1,,SING,C1,N1,,,,,37533,15879,DNS
2,,SING,C1,H11A,,,,,37533,15879,DNS
3,,SING,C1,H12,,,,,37533,15879,DNS
4,,SING,C1,H13,,,,,37533,15879,DNS
5,,SING,N1,C2,,,,,37533,15879,DNS
6,,SING,N1,C3,,,,,37533,15879,DNS
7,,SING,C2,H21,,,,,37533,15879,DNS
8,,SING,C2,H22,,,,,37533,15879,DNS
9,,SING,C2,H23,,,,,37533,15879,DNS
10,,SING,C3,C4,,,,,37533,15879,DNS
11,,DOUB,C3,C12,,,,,37533,15879,DNS
12,,DOUB,C4,C5,,,,,37533,15879,DNS
13,,SING,C4,H4,,,,,37533,15879,DNS
14,,SING,C5,C6,,,,,37533,15879,DNS
15,,SING,C5,H5,,,,,37533,15879,DNS
16,,DOUB,C6,C7,,,,,37533,15879,DNS
17,,SING,C6,H6,,,,,37533,15879,DNS
18,,SING,C7,C8,,,,,37533,15879,DNS
19,,SING,C7,C12,,,,,37533,15879,DNS
20,,SING,C8,S,,,,,37533,15879,DNS
21,,DOUB,C8,C9,,,,,37533,15879,DNS
22,,DOUB,S,OA,,,,,37533,15879,DNS
23,,DOUB,S,OB,,,,,37533,15879,DNS
24,,SING,S,NZ,,,,,37533,15879,DNS
25,,SING,NZ,CE,,,,,37533,15879,DNS
26,,SING,NZ,HZ,,,,,37533,15879,DNS
27,,SING,CE,CD,,,,,37533,15879,DNS
28,,SING,CE,HE3,,,,,37533,15879,DNS
29,,SING,CE,HE2,,,,,37533,15879,DNS
30,,SING,CD,CG,,,,,37533,15879,DNS
31,,SING,CD,HD3,,,,,37533,15879,DNS
32,,SING,CD,HD2,,,,,37533,15879,DNS
33,,SING,CG,CB,,,,,37533,15879,DNS
34,,SING,CG,HG3,,,,,37533,15879,DNS
35,,SING,CG,HG2,,,,,37533,15879,DNS
36,,SING,CB,CA,,,,,37533,15879,DNS
37,,SING,CB,HB3,,,,,37533,15879,DNS
38,,SING,CB,HB2,,,,,37533,15879,DNS
39,,SING,CA,C,,,,,37533,15879,DNS
40,,SING,CA,N,,,,,37533,15879,DNS
41,,SING,CA,HA,,,,,37533,15879,DNS
42,,SING,C,OXT,,,,,37533,15879,DNS
43,,DOUB,C,O,,,,,37533,15879,DNS
44,,SING,OXT,HO,,,,,37533,15879,DNS
45,,SING,N,H,,,,,37533,15879,DNS
46,,SING,N,H2,,,,,37533,15879,DNS
47,,SING,C9,C10,,,,,37533,15879,DNS
48,,SING,C9,H9,,,,,37533,15879,DNS
49,,DOUB,C10,C11,,,,,37533,15879,DNS
50,,SING,C10,H10,,,,,37533,15879,DNS
51,,SING,C11,C12,,,,,37533,15879,DNS
52,,SING,C11,H11,,,,,37533,15879,DNS
1,,SING,C1,C2,no,N,1,,37585,15881,NAG
2,,SING,C1,O1,no,N,2,,37585,15881,NAG
3,,SING,C1,O5,no,N,3,,37585,15881,NAG
4,,SING,C1,H1,no,N,4,,37585,15881,NAG
5,,SING,C2,C3,no,N,5,,37585,15881,NAG
6,,SING,C2,N2,no,N,6,,37585,15881,NAG
7,,SING,C2,H2,no,N,7,,37585,15881,NAG
8,,SING,C3,C4,no,N,8,,37585,15881,NAG
9,,SING,C3,O3,no,N,9,,37585,15881,NAG
10,,SING,C3,H3,no,N,10,,37585,15881,NAG
11,,SING,C4,C5,no,N,11,,37585,15881,NAG
12,,SING,C4,O4,no,N,12,,37585,15881,NAG
13,,SING,C4,H4,no,N,13,,37585,15881,NAG
14,,SING,C5,C6,no,N,14,,37585,15881,NAG
15,,SING,C5,O5,no,N,15,,37585,15881,NAG
16,,SING,C5,H5,no,N,16,,37585,15881,NAG
17,,SING,C6,O6,no,N,17,,37585,15881,NAG
18,,SING,C6,H61,no,N,18,,37585,15881,NAG
19,,SING,C6,H62,no,N,19,,37585,15881,NAG
20,,SING,C7,C8,no,N,20,,37585,15881,NAG
21,,SING,C7,N2,no,N,21,,37585,15881,NAG
22,,DOUB,C7,O7,no,N,22,,37585,15881,NAG
23,,SING,C8,H81,no,N,23,,37585,15881,NAG
24,,SING,C8,H82,no,N,24,,37585,15881,NAG
25,,SING,C8,H83,no,N,25,,37585,15881,NAG
26,,SING,N2,HN2,no,N,26,,37585,15881,NAG
27,,SING,O1,HO1,no,N,27,,37585,15881,NAG
28,,SING,O3,HO3,no,N,28,,37585,15881,NAG
29,,SING,O4,HO4,no,N,29,,37585,15881,NAG
30,,SING,O6,HO6,no,N,30,,37585,15881,NAG
1,,SING,N1,C2,yes,N,1,,38059,15904,FMN
2,,DOUB,N1,C10,yes,N,2,,38059,15904,FMN
3,,DOUB,C2,O2,no,N,3,,38059,15904,FMN
4,,SING,C2,N3,yes,N,4,,38059,15904,FMN
5,,SING,N3,C4,yes,N,5,,38059,15904,FMN
6,,SING,N3,HN3,no,N,6,,38059,15904,FMN
7,,DOUB,C4,O4,no,N,7,,38059,15904,FMN
8,,SING,C4,C4A,yes,N,8,,38059,15904,FMN
9,,DOUB,C4A,N5,yes,N,9,,38059,15904,FMN
10,,SING,C4A,C10,yes,N,10,,38059,15904,FMN
11,,SING,N5,C5A,yes,N,11,,38059,15904,FMN
12,,DOUB,C5A,C6,yes,N,12,,38059,15904,FMN
13,,SING,C5A,C9A,yes,N,13,,38059,15904,FMN
14,,SING,C6,C7,yes,N,14,,38059,15904,FMN
15,,SING,C6,H6,no,N,15,,38059,15904,FMN
16,,SING,C7,C7M,no,N,16,,38059,15904,FMN
17,,DOUB,C7,C8,yes,N,17,,38059,15904,FMN
18,,SING,C7M,HM71,no,N,18,,38059,15904,FMN
19,,SING,C7M,HM72,no,N,19,,38059,15904,FMN
20,,SING,C7M,HM73,no,N,20,,38059,15904,FMN
21,,SING,C8,C8M,no,N,21,,38059,15904,FMN
22,,SING,C8,C9,yes,N,22,,38059,15904,FMN
23,,SING,C8M,HM81,no,N,23,,38059,15904,FMN
24,,SING,C8M,HM82,no,N,24,,38059,15904,FMN
25,,SING,C8M,HM83,no,N,25,,38059,15904,FMN
26,,DOUB,C9,C9A,yes,N,26,,38059,15904,FMN
27,,SING,C9,H9,no,N,27,,38059,15904,FMN
28,,SING,C9A,N10,yes,N,28,,38059,15904,FMN
29,,SING,N10,C10,yes,N,29,,38059,15904,FMN
30,,SING,N10,C1',no,N,30,,38059,15904,FMN
31,,SING,C1',C2',no,N,31,,38059,15904,FMN
32,,SING,C1',H1'1,no,N,32,,38059,15904,FMN
33,,SING,C1',H1'2,no,N,33,,38059,15904,FMN
34,,SING,C2',O2',no,N,34,,38059,15904,FMN
35,,SING,C2',C3',no,N,35,,38059,15904,FMN
36,,SING,C2',H2',no,N,36,,38059,15904,FMN
37,,SING,O2',HO2',no,N,37,,38059,15904,FMN
38,,SING,C3',O3',no,N,38,,38059,15904,FMN
39,,SING,C3',C4',no,N,39,,38059,15904,FMN
40,,SING,C3',H3',no,N,40,,38059,15904,FMN
41,,SING,O3',HO3',no,N,41,,38059,15904,FMN
42,,SING,C4',O4',no,N,42,,38059,15904,FMN
43,,SING,C4',C5',no,N,43,,38059,15904,FMN
44,,SING,C4',H4',no,N,44,,38059,15904,FMN
45,,SING,O4',HO4',no,N,45,,38059,15904,FMN
46,,SING,C5',O5',no,N,46,,38059,15904,FMN
47,,SING,C5',H5'1,no,N,47,,38059,15904,FMN
48,,SING,C5',H5'2,no,N,48,,38059,15904,FMN
49,,SING,O5',P,no,N,49,,38059,15904,FMN
50,,DOUB,P,O1P,no,N,50,,38059,15904,FMN
51,,SING,P,O2P,no,N,51,,38059,15904,FMN
52,,SING,P,O3P,no,N,52,,38059,15904,FMN
53,,SING,O2P,HOP2,no,N,53,,38059,15904,FMN
54,,SING,O3P,HOP3,no,N,54,,38059,15904,FMN
1,,SING,ZN,NA,no,N,1,,38327,15913,ZNH
2,,SING,ZN,NB,no,N,2,,38327,15913,ZNH
3,,SING,ZN,NC,no,N,3,,38327,15913,ZNH
4,,SING,ZN,ND,no,N,4,,38327,15913,ZNH
5,,DOUB,CHA,C1A,yes,N,5,,38327,15913,ZNH
6,,SING,CHA,C4D,yes,N,6,,38327,15913,ZNH
7,,SING,CHA,HHA,no,N,7,,38327,15913,ZNH
8,,DOUB,CHB,C4A,yes,N,8,,38327,15913,ZNH
9,,SING,CHB,C1B,yes,N,9,,38327,15913,ZNH
10,,SING,CHB,HHB,no,N,10,,38327,15913,ZNH
11,,DOUB,CHC,C4B,yes,N,11,,38327,15913,ZNH
12,,SING,CHC,C1C,yes,N,12,,38327,15913,ZNH
13,,SING,CHC,HHC,no,N,13,,38327,15913,ZNH
14,,SING,CHD,C4C,yes,N,14,,38327,15913,ZNH
15,,DOUB,CHD,C1D,yes,N,15,,38327,15913,ZNH
16,,SING,CHD,HHD,no,N,16,,38327,15913,ZNH
17,,SING,NA,C1A,yes,N,17,,38327,15913,ZNH
18,,SING,NA,C4A,yes,N,18,,38327,15913,ZNH
19,,SING,C1A,C2A,yes,N,19,,38327,15913,ZNH
20,,DOUB,C2A,C3A,yes,N,20,,38327,15913,ZNH
21,,SING,C2A,CAA,no,N,21,,38327,15913,ZNH
22,,SING,C3A,C4A,yes,N,22,,38327,15913,ZNH
23,,SING,C3A,CMA,no,N,23,,38327,15913,ZNH
24,,SING,CMA,HMA1,no,N,24,,38327,15913,ZNH
25,,SING,CMA,HMA2,no,N,25,,38327,15913,ZNH
26,,SING,CMA,HMA3,no,N,26,,38327,15913,ZNH
27,,SING,CAA,CBA,no,N,27,,38327,15913,ZNH
28,,SING,CAA,HAA1,no,N,28,,38327,15913,ZNH
29,,SING,CAA,HAA2,no,N,29,,38327,15913,ZNH
30,,SING,CBA,CGA,no,N,30,,38327,15913,ZNH
31,,SING,CBA,HBA1,no,N,31,,38327,15913,ZNH
32,,SING,CBA,HBA2,no,N,32,,38327,15913,ZNH
33,,DOUB,CGA,O1A,no,N,33,,38327,15913,ZNH
34,,SING,CGA,O2A,no,N,34,,38327,15913,ZNH
35,,SING,O2A,H2A,no,N,35,,38327,15913,ZNH
36,,DOUB,NB,C1B,yes,N,36,,38327,15913,ZNH
37,,SING,NB,C4B,yes,N,37,,38327,15913,ZNH
38,,SING,C1B,C2B,no,N,38,,38327,15913,ZNH
39,,DOUB,C2B,C3B,no,N,39,,38327,15913,ZNH
40,,SING,C2B,CMB,no,N,40,,38327,15913,ZNH
41,,SING,C3B,C4B,no,N,41,,38327,15913,ZNH
42,,SING,C3B,CAB,no,N,42,,38327,15913,ZNH
43,,SING,CMB,HMB1,no,N,43,,38327,15913,ZNH
44,,SING,CMB,HMB2,no,N,44,,38327,15913,ZNH
45,,SING,CMB,HMB3,no,N,45,,38327,15913,ZNH
46,,DOUB,CAB,CBB,no,N,46,,38327,15913,ZNH
47,,SING,CAB,HAB,no,N,47,,38327,15913,ZNH
48,,SING,CBB,HBB1,no,N,48,,38327,15913,ZNH
49,,SING,CBB,HBB2,no,N,49,,38327,15913,ZNH
50,,SING,NC,C1C,yes,N,50,,38327,15913,ZNH
51,,SING,NC,C4C,yes,N,51,,38327,15913,ZNH
52,,DOUB,C1C,C2C,yes,N,52,,38327,15913,ZNH
53,,SING,C2C,C3C,yes,N,53,,38327,15913,ZNH
54,,SING,C2C,CMC,no,N,54,,38327,15913,ZNH
55,,DOUB,C3C,C4C,yes,N,55,,38327,15913,ZNH
56,,SING,C3C,CAC,no,N,56,,38327,15913,ZNH
57,,SING,CMC,HMC1,no,N,57,,38327,15913,ZNH
58,,SING,CMC,HMC2,no,N,58,,38327,15913,ZNH
59,,SING,CMC,HMC3,no,N,59,,38327,15913,ZNH
60,,DOUB,CAC,CBC,no,N,60,,38327,15913,ZNH
61,,SING,CAC,HAC,no,N,61,,38327,15913,ZNH
62,,SING,CBC,HBC1,no,N,62,,38327,15913,ZNH
63,,SING,CBC,HBC2,no,N,63,,38327,15913,ZNH
64,,SING,ND,C1D,yes,N,64,,38327,15913,ZNH
65,,DOUB,ND,C4D,yes,N,65,,38327,15913,ZNH
66,,SING,C1D,C2D,no,N,66,,38327,15913,ZNH
67,,DOUB,C2D,C3D,no,N,67,,38327,15913,ZNH
68,,SING,C2D,CMD,no,N,68,,38327,15913,ZNH
69,,SING,C3D,C4D,no,N,69,,38327,15913,ZNH
70,,SING,C3D,CAD,no,N,70,,38327,15913,ZNH
71,,SING,CMD,HMD1,no,N,71,,38327,15913,ZNH
72,,SING,CMD,HMD2,no,N,72,,38327,15913,ZNH
73,,SING,CMD,HMD3,no,N,73,,38327,15913,ZNH
74,,SING,CAD,CBD,no,N,74,,38327,15913,ZNH
75,,SING,CAD,HAD1,no,N,75,,38327,15913,ZNH
76,,SING,CAD,HAD2,no,N,76,,38327,15913,ZNH
77,,SING,CBD,CGD,no,N,77,,38327,15913,ZNH
78,,SING,CBD,HBD1,no,N,78,,38327,15913,ZNH
79,,SING,CBD,HBD2,no,N,79,,38327,15913,ZNH
80,,DOUB,CGD,O1D,no,N,80,,38327,15913,ZNH
81,,SING,CGD,O2D,no,N,81,,38327,15913,ZNH
82,,SING,O2D,H2D,no,N,82,,38327,15913,ZNH
1,,SING,N1,C2,no,N,1,,38372,15915,PSU
2,,SING,N1,C6,no,N,2,,38372,15915,PSU
3,,SING,N1,HN1,no,N,3,,38372,15915,PSU
4,,SING,C2,N3,no,N,4,,38372,15915,PSU
5,,DOUB,C2,O2,no,N,5,,38372,15915,PSU
6,,SING,N3,C4,no,N,6,,38372,15915,PSU
7,,SING,N3,HN3,no,N,7,,38372,15915,PSU
8,,SING,C4,C5,no,N,8,,38372,15915,PSU
9,,DOUB,C4,O4,no,N,9,,38372,15915,PSU
10,,DOUB,C5,C6,no,N,10,,38372,15915,PSU
11,,SING,C5,C1',no,N,11,,38372,15915,PSU
12,,SING,C6,H6,no,N,12,,38372,15915,PSU
13,,SING,C1',C2',no,N,13,,38372,15915,PSU
14,,SING,C1',O4',no,N,14,,38372,15915,PSU
15,,SING,C1',H1',no,N,15,,38372,15915,PSU
16,,SING,C2',O2',no,N,16,,38372,15915,PSU
17,,SING,C2',C3',no,N,17,,38372,15915,PSU
18,,SING,C2',H2',no,N,18,,38372,15915,PSU
19,,SING,O2',HO2',no,N,19,,38372,15915,PSU
20,,SING,C3',C4',no,N,20,,38372,15915,PSU
21,,SING,C3',O3',no,N,21,,38372,15915,PSU
22,,SING,C3',H3',no,N,22,,38372,15915,PSU
23,,SING,C4',O4',no,N,23,,38372,15915,PSU
24,,SING,C4',C5',no,N,24,,38372,15915,PSU
25,,SING,C4',H4',no,N,25,,38372,15915,PSU
26,,SING,O3',HO3',no,N,26,,38372,15915,PSU
27,,SING,C5',O5',no,N,27,,38372,15915,PSU
28,,SING,C5',H5',no,N,28,,38372,15915,PSU
29,,SING,C5',H5'',no,N,29,,38372,15915,PSU
30,,SING,O5',P,no,N,30,,38372,15915,PSU
31,,DOUB,P,OP1,no,N,31,,38372,15915,PSU
32,,SING,P,OP2,no,N,32,,38372,15915,PSU
33,,SING,P,OP3,no,N,33,,38372,15915,PSU
34,,SING,OP2,HOP2,no,N,34,,38372,15915,PSU
35,,SING,OP3,HOP3,no,N,35,,38372,15915,PSU
1,,SING,N,CA,,,,,38464,15919,TPO
2,,SING,N,H,,,,,38464,15919,TPO
3,,SING,N,H2,,,,,38464,15919,TPO
4,,SING,CA,CB,,,,,38464,15919,TPO
5,,SING,CA,C,,,,,38464,15919,TPO
6,,SING,CA,HA,,,,,38464,15919,TPO
7,,SING,CB,CG2,,,,,38464,15919,TPO
8,,SING,CB,OG1,,,,,38464,15919,TPO
9,,SING,CB,HB,,,,,38464,15919,TPO
10,,SING,CG2,HG21,,,,,38464,15919,TPO
11,,SING,CG2,HG22,,,,,38464,15919,TPO
12,,SING,CG2,HG23,,,,,38464,15919,TPO
13,,SING,OG1,P,,,,,38464,15919,TPO
14,,DOUB,P,O1P,,,,,38464,15919,TPO
15,,SING,P,O2P,,,,,38464,15919,TPO
16,,SING,P,O3P,,,,,38464,15919,TPO
17,,SING,O2P,HOP2,,,,,38464,15919,TPO
18,,SING,O3P,HOP3,,,,,38464,15919,TPO
19,,DOUB,C,O,,,,,38464,15919,TPO
20,,SING,C,OXT,,,,,38464,15919,TPO
21,,SING,OXT,HXT,,,,,38464,15919,TPO
1,,SING,C1,C2,no,N,1,,39102,15955,RET
2,,SING,C1,C6,no,N,2,,39102,15955,RET
3,,SING,C1,C16,no,N,3,,39102,15955,RET
4,,SING,C1,C17,no,N,4,,39102,15955,RET
5,,SING,C2,C3,no,N,5,,39102,15955,RET
6,,SING,C2,H21,no,N,6,,39102,15955,RET
7,,SING,C2,H22,no,N,7,,39102,15955,RET
8,,SING,C3,C4,no,N,8,,39102,15955,RET
9,,SING,C3,H31,no,N,9,,39102,15955,RET
10,,SING,C3,H32,no,N,10,,39102,15955,RET
11,,SING,C4,C5,no,N,11,,39102,15955,RET
12,,SING,C4,H41,no,N,12,,39102,15955,RET
13,,SING,C4,H42,no,N,13,,39102,15955,RET
14,,DOUB,C5,C6,no,N,14,,39102,15955,RET
15,,SING,C5,C18,no,N,15,,39102,15955,RET
16,,SING,C6,C7,no,N,16,,39102,15955,RET
17,,DOUB,C7,C8,no,E,17,,39102,15955,RET
18,,SING,C7,H7,no,N,18,,39102,15955,RET
19,,SING,C8,C9,no,N,19,,39102,15955,RET
20,,SING,C8,H8,no,N,20,,39102,15955,RET
21,,DOUB,C9,C10,no,E,21,,39102,15955,RET
22,,SING,C9,C19,no,N,22,,39102,15955,RET
23,,SING,C10,C11,no,N,23,,39102,15955,RET
24,,SING,C10,H10,no,N,24,,39102,15955,RET
25,,DOUB,C11,C12,no,E,25,,39102,15955,RET
26,,SING,C11,H11,no,N,26,,39102,15955,RET
27,,SING,C12,C13,no,N,27,,39102,15955,RET
28,,SING,C12,H12,no,N,28,,39102,15955,RET
29,,DOUB,C13,C14,no,E,29,,39102,15955,RET
30,,SING,C13,C20,no,N,30,,39102,15955,RET
31,,SING,C14,C15,no,N,31,,39102,15955,RET
32,,SING,C14,H14,no,N,32,,39102,15955,RET
33,,DOUB,C15,O1,no,N,33,,39102,15955,RET
34,,SING,C15,H15,no,N,34,,39102,15955,RET
35,,SING,C16,H161,no,N,35,,39102,15955,RET
36,,SING,C16,H162,no,N,36,,39102,15955,RET
37,,SING,C16,H163,no,N,37,,39102,15955,RET
38,,SING,C17,H171,no,N,38,,39102,15955,RET
39,,SING,C17,H172,no,N,39,,39102,15955,RET
40,,SING,C17,H173,no,N,40,,39102,15955,RET
41,,SING,C18,H181,no,N,41,,39102,15955,RET
42,,SING,C18,H182,no,N,42,,39102,15955,RET
43,,SING,C18,H183,no,N,43,,39102,15955,RET
44,,SING,C19,H191,no,N,44,,39102,15955,RET
45,,SING,C19,H192,no,N,45,,39102,15955,RET
46,,SING,C19,H193,no,N,46,,39102,15955,RET
47,,SING,C20,H201,no,N,47,,39102,15955,RET
48,,SING,C20,H202,no,N,48,,39102,15955,RET
49,,SING,C20,H203,no,N,49,,39102,15955,RET
1,,SING,C1,C2,,,,,39199,15960,IHP
2,,SING,C1,C6,,,,,39199,15960,IHP
3,,SING,C1,O11,,,,,39199,15960,IHP
4,,SING,C1,H1,,,,,39199,15960,IHP
5,,SING,C2,C3,,,,,39199,15960,IHP
6,,SING,C2,O12,,,,,39199,15960,IHP
7,,SING,C2,H2,,,,,39199,15960,IHP
8,,SING,C3,C4,,,,,39199,15960,IHP
9,,SING,C3,O13,,,,,39199,15960,IHP
10,,SING,C3,H3,,,,,39199,15960,IHP
11,,SING,C4,C5,,,,,39199,15960,IHP
12,,SING,C4,O14,,,,,39199,15960,IHP
13,,SING,C4,H4,,,,,39199,15960,IHP
14,,SING,C5,C6,,,,,39199,15960,IHP
15,,SING,C5,O15,,,,,39199,15960,IHP
16,,SING,C5,H5,,,,,39199,15960,IHP
17,,SING,C6,O16,,,,,39199,15960,IHP
18,,SING,C6,H6,,,,,39199,15960,IHP
19,,SING,O11,P1,,,,,39199,15960,IHP
20,,DOUB,P1,O21,,,,,39199,15960,IHP
21,,SING,P1,O31,,,,,39199,15960,IHP
22,,SING,P1,O41,,,,,39199,15960,IHP
23,,SING,O31,H31,,,,,39199,15960,IHP
24,,SING,O41,H41,,,,,39199,15960,IHP
25,,SING,O12,P2,,,,,39199,15960,IHP
26,,DOUB,P2,O22,,,,,39199,15960,IHP
27,,SING,P2,O32,,,,,39199,15960,IHP
28,,SING,P2,O42,,,,,39199,15960,IHP
29,,SING,O32,H32,,,,,39199,15960,IHP
30,,SING,O42,H42,,,,,39199,15960,IHP
31,,SING,O13,P3,,,,,39199,15960,IHP
32,,DOUB,P3,O23,,,,,39199,15960,IHP
33,,SING,P3,O33,,,,,39199,15960,IHP
34,,SING,P3,O43,,,,,39199,15960,IHP
35,,SING,O33,H33,,,,,39199,15960,IHP
36,,SING,O43,H43,,,,,39199,15960,IHP
37,,SING,O14,P4,,,,,39199,15960,IHP
38,,DOUB,P4,O24,,,,,39199,15960,IHP
39,,SING,P4,O34,,,,,39199,15960,IHP
40,,SING,P4,O44,,,,,39199,15960,IHP
41,,SING,O34,H34,,,,,39199,15960,IHP
42,,SING,O44,H44,,,,,39199,15960,IHP
43,,SING,O15,P5,,,,,39199,15960,IHP
44,,DOUB,P5,O25,,,,,39199,15960,IHP
45,,SING,P5,O35,,,,,39199,15960,IHP
46,,SING,P5,O45,,,,,39199,15960,IHP
47,,SING,O35,H35,,,,,39199,15960,IHP
48,,SING,O45,H45,,,,,39199,15960,IHP
49,,SING,O16,P6,,,,,39199,15960,IHP
50,,DOUB,P6,O26,,,,,39199,15960,IHP
51,,SING,P6,O36,,,,,39199,15960,IHP
52,,SING,P6,O46,,,,,39199,15960,IHP
53,,SING,O36,H36,,,,,39199,15960,IHP
54,,SING,O46,H46,,,,,39199,15960,IHP
1,,SING,FE,NA,,,,,39231,15962,HEM
2,,SING,FE,NB,,,,,39231,15962,HEM
3,,SING,FE,NC,,,,,39231,15962,HEM
4,,SING,FE,ND,,,,,39231,15962,HEM
5,,DOUB,CHA,C1A,,,,,39231,15962,HEM
6,,SING,CHA,C4D,,,,,39231,15962,HEM
7,,SING,CHA,HHA,,,,,39231,15962,HEM
8,,DOUB,CHB,C4A,,,,,39231,15962,HEM
9,,SING,CHB,C1B,,,,,39231,15962,HEM
10,,SING,CHB,HHB,,,,,39231,15962,HEM
11,,DOUB,CHC,C4B,,,,,39231,15962,HEM
12,,SING,CHC,C1C,,,,,39231,15962,HEM
13,,SING,CHC,HHC,,,,,39231,15962,HEM
14,,SING,CHD,C4C,,,,,39231,15962,HEM
15,,DOUB,CHD,C1D,,,,,39231,15962,HEM
16,,SING,CHD,HHD,,,,,39231,15962,HEM
17,,SING,NA,C1A,,,,,39231,15962,HEM
18,,SING,NA,C4A,,,,,39231,15962,HEM
19,,SING,C1A,C2A,,,,,39231,15962,HEM
20,,DOUB,C2A,C3A,,,,,39231,15962,HEM
21,,SING,C2A,CAA,,,,,39231,15962,HEM
22,,SING,C3A,C4A,,,,,39231,15962,HEM
23,,SING,C3A,CMA,,,,,39231,15962,HEM
24,,SING,CMA,HMA1,,,,,39231,15962,HEM
25,,SING,CMA,HMA2,,,,,39231,15962,HEM
26,,SING,CMA,HMA3,,,,,39231,15962,HEM
27,,SING,CAA,CBA,,,,,39231,15962,HEM
28,,SING,CAA,HAA1,,,,,39231,15962,HEM
29,,SING,CAA,HAA2,,,,,39231,15962,HEM
30,,SING,CBA,CGA,,,,,39231,15962,HEM
31,,SING,CBA,HBA1,,,,,39231,15962,HEM
32,,SING,CBA,HBA2,,,,,39231,15962,HEM
33,,DOUB,CGA,O1A,,,,,39231,15962,HEM
34,,SING,CGA,O2A,,,,,39231,15962,HEM
35,,SING,O2A,H2A,,,,,39231,15962,HEM
36,,DOUB,NB,C1B,,,,,39231,15962,HEM
37,,SING,NB,C4B,,,,,39231,15962,HEM
38,,SING,C1B,C2B,,,,,39231,15962,HEM
39,,DOUB,C2B,C3B,,,,,39231,15962,HEM
40,,SING,C2B,CMB,,,,,39231,15962,HEM
41,,SING,C3B,C4B,,,,,39231,15962,HEM
42,,SING,C3B,CAB,,,,,39231,15962,HEM
43,,SING,CMB,HMB1,,,,,39231,15962,HEM
44,,SING,CMB,HMB2,,,,,39231,15962,HEM
45,,SING,CMB,HMB3,,,,,39231,15962,HEM
46,,DOUB,CAB,CBB,,,,,39231,15962,HEM
47,,SING,CAB,HAB,,,,,39231,15962,HEM
48,,SING,CBB,HBB1,,,,,39231,15962,HEM
49,,SING,CBB,HBB2,,,,,39231,15962,HEM
50,,SING,NC,C1C,,,,,39231,15962,HEM
51,,SING,NC,C4C,,,,,39231,15962,HEM
52,,DOUB,C1C,C2C,,,,,39231,15962,HEM
53,,SING,C2C,C3C,,,,,39231,15962,HEM
54,,SING,C2C,CMC,,,,,39231,15962,HEM
55,,DOUB,C3C,C4C,,,,,39231,15962,HEM
56,,SING,C3C,CAC,,,,,39231,15962,HEM
57,,SING,CMC,HMC1,,,,,39231,15962,HEM
58,,SING,CMC,HMC2,,,,,39231,15962,HEM
59,,SING,CMC,HMC3,,,,,39231,15962,HEM
60,,DOUB,CAC,CBC,,,,,39231,15962,HEM
61,,SING,CAC,HAC,,,,,39231,15962,HEM
62,,SING,CBC,HBC1,,,,,39231,15962,HEM
63,,SING,CBC,HBC2,,,,,39231,15962,HEM
64,,SING,ND,C1D,,,,,39231,15962,HEM
65,,DOUB,ND,C4D,,,,,39231,15962,HEM
66,,SING,C1D,C2D,,,,,39231,15962,HEM
67,,DOUB,C2D,C3D,,,,,39231,15962,HEM
68,,SING,C2D,CMD,,,,,39231,15962,HEM
69,,SING,C3D,C4D,,,,,39231,15962,HEM
70,,SING,C3D,CAD,,,,,39231,15962,HEM
71,,SING,CMD,HMD1,,,,,39231,15962,HEM
72,,SING,CMD,HMD2,,,,,39231,15962,HEM
73,,SING,CMD,HMD3,,,,,39231,15962,HEM
74,,SING,CAD,CBD,,,,,39231,15962,HEM
75,,SING,CAD,HAD1,,,,,39231,15962,HEM
76,,SING,CAD,HAD2,,,,,39231,15962,HEM
77,,SING,CBD,CGD,,,,,39231,15962,HEM
78,,SING,CBD,HBD1,,,,,39231,15962,HEM
79,,SING,CBD,HBD2,,,,,39231,15962,HEM
80,,DOUB,CGD,O1D,,,,,39231,15962,HEM
81,,SING,CGD,O2D,,,,,39231,15962,HEM
82,,SING,O2D,H2D,,,,,39231,15962,HEM
1,,SING,FE,NA,,,,,39256,15963,HEM
2,,SING,FE,NB,,,,,39256,15963,HEM
3,,SING,FE,NC,,,,,39256,15963,HEM
4,,SING,FE,ND,,,,,39256,15963,HEM
5,,DOUB,CHA,C1A,,,,,39256,15963,HEM
6,,SING,CHA,C4D,,,,,39256,15963,HEM
7,,SING,CHA,HHA,,,,,39256,15963,HEM
8,,DOUB,CHB,C4A,,,,,39256,15963,HEM
9,,SING,CHB,C1B,,,,,39256,15963,HEM
10,,SING,CHB,HHB,,,,,39256,15963,HEM
11,,DOUB,CHC,C4B,,,,,39256,15963,HEM
12,,SING,CHC,C1C,,,,,39256,15963,HEM
13,,SING,CHC,HHC,,,,,39256,15963,HEM
14,,SING,CHD,C4C,,,,,39256,15963,HEM
15,,DOUB,CHD,C1D,,,,,39256,15963,HEM
16,,SING,CHD,HHD,,,,,39256,15963,HEM
17,,SING,NA,C1A,,,,,39256,15963,HEM
18,,SING,NA,C4A,,,,,39256,15963,HEM
19,,SING,C1A,C2A,,,,,39256,15963,HEM
20,,DOUB,C2A,C3A,,,,,39256,15963,HEM
21,,SING,C2A,CAA,,,,,39256,15963,HEM
22,,SING,C3A,C4A,,,,,39256,15963,HEM
23,,SING,C3A,CMA,,,,,39256,15963,HEM
24,,SING,CMA,HMA1,,,,,39256,15963,HEM
25,,SING,CMA,HMA2,,,,,39256,15963,HEM
26,,SING,CMA,HMA3,,,,,39256,15963,HEM
27,,SING,CAA,CBA,,,,,39256,15963,HEM
28,,SING,CAA,HAA1,,,,,39256,15963,HEM
29,,SING,CAA,HAA2,,,,,39256,15963,HEM
30,,SING,CBA,CGA,,,,,39256,15963,HEM
31,,SING,CBA,HBA1,,,,,39256,15963,HEM
32,,SING,CBA,HBA2,,,,,39256,15963,HEM
33,,DOUB,CGA,O1A,,,,,39256,15963,HEM
34,,SING,CGA,O2A,,,,,39256,15963,HEM
35,,SING,O2A,H2A,,,,,39256,15963,HEM
36,,DOUB,NB,C1B,,,,,39256,15963,HEM
37,,SING,NB,C4B,,,,,39256,15963,HEM
38,,SING,C1B,C2B,,,,,39256,15963,HEM
39,,DOUB,C2B,C3B,,,,,39256,15963,HEM
40,,SING,C2B,CMB,,,,,39256,15963,HEM
41,,SING,C3B,C4B,,,,,39256,15963,HEM
42,,SING,C3B,CAB,,,,,39256,15963,HEM
43,,SING,CMB,HMB1,,,,,39256,15963,HEM
44,,SING,CMB,HMB2,,,,,39256,15963,HEM
45,,SING,CMB,HMB3,,,,,39256,15963,HEM
46,,DOUB,CAB,CBB,,,,,39256,15963,HEM
47,,SING,CAB,HAB,,,,,39256,15963,HEM
48,,SING,CBB,HBB1,,,,,39256,15963,HEM
49,,SING,CBB,HBB2,,,,,39256,15963,HEM
50,,SING,NC,C1C,,,,,39256,15963,HEM
51,,SING,NC,C4C,,,,,39256,15963,HEM
52,,DOUB,C1C,C2C,,,,,39256,15963,HEM
53,,SING,C2C,C3C,,,,,39256,15963,HEM
54,,SING,C2C,CMC,,,,,39256,15963,HEM
55,,DOUB,C3C,C4C,,,,,39256,15963,HEM
56,,SING,C3C,CAC,,,,,39256,15963,HEM
57,,SING,CMC,HMC1,,,,,39256,15963,HEM
58,,SING,CMC,HMC2,,,,,39256,15963,HEM
59,,SING,CMC,HMC3,,,,,39256,15963,HEM
60,,DOUB,CAC,CBC,,,,,39256,15963,HEM
61,,SING,CAC,HAC,,,,,39256,15963,HEM
62,,SING,CBC,HBC1,,,,,39256,15963,HEM
63,,SING,CBC,HBC2,,,,,39256,15963,HEM
64,,SING,ND,C1D,,,,,39256,15963,HEM
65,,DOUB,ND,C4D,,,,,39256,15963,HEM
66,,SING,C1D,C2D,,,,,39256,15963,HEM
67,,DOUB,C2D,C3D,,,,,39256,15963,HEM
68,,SING,C2D,CMD,,,,,39256,15963,HEM
69,,SING,C3D,C4D,,,,,39256,15963,HEM
70,,SING,C3D,CAD,,,,,39256,15963,HEM
71,,SING,CMD,HMD1,,,,,39256,15963,HEM
72,,SING,CMD,HMD2,,,,,39256,15963,HEM
73,,SING,CMD,HMD3,,,,,39256,15963,HEM
74,,SING,CAD,CBD,,,,,39256,15963,HEM
75,,SING,CAD,HAD1,,,,,39256,15963,HEM
76,,SING,CAD,HAD2,,,,,39256,15963,HEM
77,,SING,CBD,CGD,,,,,39256,15963,HEM
78,,SING,CBD,HBD1,,,,,39256,15963,HEM
79,,SING,CBD,HBD2,,,,,39256,15963,HEM
80,,DOUB,CGD,O1D,,,,,39256,15963,HEM
81,,SING,CGD,O2D,,,,,39256,15963,HEM
82,,SING,O2D,H2D,,,,,39256,15963,HEM
1,,SING,N,CA,no,N,1,,39568,15983,NLE
2,,SING,N,H,no,N,2,,39568,15983,NLE
3,,SING,N,HN2,no,N,3,,39568,15983,NLE
4,,SING,CA,C,no,N,4,,39568,15983,NLE
5,,SING,CA,CB,no,N,5,,39568,15983,NLE
6,,SING,CA,HA,no,N,6,,39568,15983,NLE
7,,DOUB,C,O,no,N,7,,39568,15983,NLE
8,,SING,C,OXT,no,N,8,,39568,15983,NLE
9,,SING,OXT,HXT,no,N,9,,39568,15983,NLE
10,,SING,CB,CG,no,N,10,,39568,15983,NLE
11,,SING,CB,HB2,no,N,11,,39568,15983,NLE
12,,SING,CB,HB3,no,N,12,,39568,15983,NLE
13,,SING,CG,CD,no,N,13,,39568,15983,NLE
14,,SING,CG,HG2,no,N,14,,39568,15983,NLE
15,,SING,CG,HG3,no,N,15,,39568,15983,NLE
16,,SING,CD,CE,no,N,16,,39568,15983,NLE
17,,SING,CD,HD2,no,N,17,,39568,15983,NLE
18,,SING,CD,HD3,no,N,18,,39568,15983,NLE
19,,SING,CE,HE1,no,N,19,,39568,15983,NLE
20,,SING,CE,HE2,no,N,20,,39568,15983,NLE
21,,SING,CE,HE3,no,N,21,,39568,15983,NLE
1,,SING,N,HN1,no,N,1,,39569,15983,NH2
2,,SING,N,HN2,no,N,2,,39569,15983,NH2
1,,SING,N,CA,no,N,1,,39589,15986,HYP
2,,SING,N,CD,no,N,2,,39589,15986,HYP
3,,SING,N,H,no,N,3,,39589,15986,HYP
4,,SING,CA,C,no,N,4,,39589,15986,HYP
5,,SING,CA,CB,no,N,5,,39589,15986,HYP
6,,SING,CA,HA,no,N,6,,39589,15986,HYP
7,,DOUB,C,O,no,N,7,,39589,15986,HYP
8,,SING,C,OXT,no,N,8,,39589,15986,HYP
9,,SING,CB,CG,no,N,9,,39589,15986,HYP
10,,SING,CB,HB2,no,N,10,,39589,15986,HYP
11,,SING,CB,HB3,no,N,11,,39589,15986,HYP
12,,SING,CG,CD,no,N,12,,39589,15986,HYP
13,,SING,CG,OD1,no,N,13,,39589,15986,HYP
14,,SING,CG,HG,no,N,14,,39589,15986,HYP
15,,SING,CD,HD22,no,N,15,,39589,15986,HYP
16,,SING,CD,HD23,no,N,16,,39589,15986,HYP
17,,SING,OD1,HD1,no,N,17,,39589,15986,HYP
18,,SING,OXT,HXT,no,N,18,,39589,15986,HYP
1,,SING,C1,C2,no,N,1,,39590,15986,NAG
2,,SING,C1,O1,no,N,2,,39590,15986,NAG
3,,SING,C1,O5,no,N,3,,39590,15986,NAG
4,,SING,C1,H1,no,N,4,,39590,15986,NAG
5,,SING,C2,C3,no,N,5,,39590,15986,NAG
6,,SING,C2,N2,no,N,6,,39590,15986,NAG
7,,SING,C2,H2,no,N,7,,39590,15986,NAG
8,,SING,C3,C4,no,N,8,,39590,15986,NAG
9,,SING,C3,O3,no,N,9,,39590,15986,NAG
10,,SING,C3,H3,no,N,10,,39590,15986,NAG
11,,SING,C4,C5,no,N,11,,39590,15986,NAG
12,,SING,C4,O4,no,N,12,,39590,15986,NAG
13,,SING,C4,H4,no,N,13,,39590,15986,NAG
14,,SING,C5,C6,no,N,14,,39590,15986,NAG
15,,SING,C5,O5,no,N,15,,39590,15986,NAG
16,,SING,C5,H5,no,N,16,,39590,15986,NAG
17,,SING,C6,O6,no,N,17,,39590,15986,NAG
18,,SING,C6,H61,no,N,18,,39590,15986,NAG
19,,SING,C6,H62,no,N,19,,39590,15986,NAG
20,,SING,C7,C8,no,N,20,,39590,15986,NAG
21,,SING,C7,N2,no,N,21,,39590,15986,NAG
22,,DOUB,C7,O7,no,N,22,,39590,15986,NAG
23,,SING,C8,H81,no,N,23,,39590,15986,NAG
24,,SING,C8,H82,no,N,24,,39590,15986,NAG
25,,SING,C8,H83,no,N,25,,39590,15986,NAG
26,,SING,N2,HN2,no,N,26,,39590,15986,NAG
27,,SING,O1,HO1,no,N,27,,39590,15986,NAG
28,,SING,O3,HO3,no,N,28,,39590,15986,NAG
29,,SING,O4,HO4,no,N,29,,39590,15986,NAG
30,,SING,O6,HO6,no,N,30,,39590,15986,NAG
1,,SING,N1,C10,no,N,1,,40192,16020,308
2,,SING,C10,C7,no,N,2,,40192,16020,308
3,,SING,C10,C8,no,N,3,,40192,16020,308
4,,SING,C10,C9,no,N,4,,40192,16020,308
5,,SING,C7,C1,no,N,5,,40192,16020,308
6,,SING,C1,C6,no,N,6,,40192,16020,308
7,,SING,C1,C2,no,N,7,,40192,16020,308
8,,SING,C8,C5,no,N,8,,40192,16020,308
9,,SING,C5,C6,no,N,9,,40192,16020,308
10,,SING,C5,C4,no,N,10,,40192,16020,308
11,,SING,C4,C3,no,N,11,,40192,16020,308
12,,SING,C9,C3,no,N,12,,40192,16020,308
13,,SING,C3,C2,no,N,13,,40192,16020,308
14,,SING,N1,HN1,no,N,14,,40192,16020,308
15,,SING,N1,HN1A,no,N,15,,40192,16020,308
16,,SING,C7,H7,no,N,16,,40192,16020,308
17,,SING,C7,H7A,no,N,17,,40192,16020,308
18,,SING,C1,H1,no,N,18,,40192,16020,308
19,,SING,C8,H8,no,N,19,,40192,16020,308
20,,SING,C8,H8A,no,N,20,,40192,16020,308
21,,SING,C5,H5,no,N,21,,40192,16020,308
22,,SING,C6,H6,no,N,22,,40192,16020,308
23,,SING,C6,H6A,no,N,23,,40192,16020,308
24,,SING,C4,H4,no,N,24,,40192,16020,308
25,,SING,C4,H4A,no,N,25,,40192,16020,308
26,,SING,C9,H9,no,N,26,,40192,16020,308
27,,SING,C9,H9A,no,N,27,,40192,16020,308
28,,SING,C3,H3,no,N,28,,40192,16020,308
29,,SING,C2,H2,no,N,29,,40192,16020,308
30,,SING,C2,H2A,no,N,30,,40192,16020,308
1,,DOUB,C,O,no,N,1,,40227,16022,ACE
2,,SING,C,CH3,no,N,2,,40227,16022,ACE
3,,SING,C,H,no,N,3,,40227,16022,ACE
4,,SING,CH3,H1,no,N,4,,40227,16022,ACE
5,,SING,CH3,H2,no,N,5,,40227,16022,ACE
6,,SING,CH3,H3,no,N,6,,40227,16022,ACE
1,,SING,N,HN1,no,N,1,,40228,16022,NH2
2,,SING,N,HN2,no,N,2,,40228,16022,NH2
1,,DOUB,C,O,no,N,1,,40248,16023,ACE
2,,SING,C,CH3,no,N,2,,40248,16023,ACE
3,,SING,C,H,no,N,3,,40248,16023,ACE
4,,SING,CH3,H1,no,N,4,,40248,16023,ACE
5,,SING,CH3,H2,no,N,5,,40248,16023,ACE
6,,SING,CH3,H3,no,N,6,,40248,16023,ACE
1,,SING,N,CA,,,,,40249,16023,HIA
2,,SING,N,H,,,,,40249,16023,HIA
3,,SING,N,H2,,,,,40249,16023,HIA
4,,SING,CA,CB,,,,,40249,16023,HIA
5,,SING,CA,C,,,,,40249,16023,HIA
6,,SING,CA,HA,,,,,40249,16023,HIA
7,,SING,CB,CG,,,,,40249,16023,HIA
8,,SING,CB,HB2,,,,,40249,16023,HIA
9,,SING,CB,HB3,,,,,40249,16023,HIA
10,,SING,CG,ND1,,,,,40249,16023,HIA
11,,DOUB,CG,CD2,,,,,40249,16023,HIA
12,,SING,ND1,CE1,,,,,40249,16023,HIA
13,,SING,ND1,HD1,,,,,40249,16023,HIA
14,,SING,CD2,NE2,,,,,40249,16023,HIA
15,,SING,CD2,HD2,,,,,40249,16023,HIA
16,,DOUB,CE1,NE2,,,,,40249,16023,HIA
17,,SING,CE1,HE1,,,,,40249,16023,HIA
18,,DOUB,C,O,,,,,40249,16023,HIA
19,,SING,C,NXT,,,,,40249,16023,HIA
20,,SING,NXT,HXT1,,,,,40249,16023,HIA
21,,SING,NXT,HXT2,,,,,40249,16023,HIA
1,,SING,N,HN1,no,N,1,,40250,16023,NH2
2,,SING,N,HN2,no,N,2,,40250,16023,NH2
1,,SING,N,CA,,,,,40310,16026,DAL
2,,SING,N,H,,,,,40310,16026,DAL
3,,SING,N,H2,,,,,40310,16026,DAL
4,,SING,CA,CB,,,,,40310,16026,DAL
5,,SING,CA,C,,,,,40310,16026,DAL
6,,SING,CA,HA,,,,,40310,16026,DAL
7,,SING,CB,HB1,,,,,40310,16026,DAL
8,,SING,CB,HB2,,,,,40310,16026,DAL
9,,SING,CB,HB3,,,,,40310,16026,DAL
10,,DOUB,C,O,,,,,40310,16026,DAL
11,,SING,C,OXT,,,,,40310,16026,DAL
12,,SING,OXT,HXT,,,,,40310,16026,DAL
1,,SING,N,CN,,,,,40342,16028,FME
2,,SING,N,CA,,,,,40342,16028,FME
3,,SING,N,H,,,,,40342,16028,FME
4,,DOUB,CN,O1,,,,,40342,16028,FME
5,,SING,CN,HCN,,,,,40342,16028,FME
6,,SING,CA,CB,,,,,40342,16028,FME
7,,SING,CA,C,,,,,40342,16028,FME
8,,SING,CA,HA,,,,,40342,16028,FME
9,,SING,CB,CG,,,,,40342,16028,FME
10,,SING,CB,HB2,,,,,40342,16028,FME
11,,SING,CB,HB3,,,,,40342,16028,FME
12,,SING,CG,SD,,,,,40342,16028,FME
13,,SING,CG,HG2,,,,,40342,16028,FME
14,,SING,CG,HG3,,,,,40342,16028,FME
15,,SING,SD,CE,,,,,40342,16028,FME
16,,SING,CE,HE1,,,,,40342,16028,FME
17,,SING,CE,HE2,,,,,40342,16028,FME
18,,SING,CE,HE3,,,,,40342,16028,FME
19,,DOUB,C,O,,,,,40342,16028,FME
20,,SING,C,OXT,,,,,40342,16028,FME
21,,SING,OXT,HXT,,,,,40342,16028,FME
1,,SING,N1,C2,yes,N,1,,40510,16037,FMN
2,,DOUB,N1,C10,yes,N,2,,40510,16037,FMN
3,,DOUB,C2,O2,no,N,3,,40510,16037,FMN
4,,SING,C2,N3,yes,N,4,,40510,16037,FMN
5,,SING,N3,C4,yes,N,5,,40510,16037,FMN
6,,SING,N3,HN3,no,N,6,,40510,16037,FMN
7,,DOUB,C4,O4,no,N,7,,40510,16037,FMN
8,,SING,C4,C4A,yes,N,8,,40510,16037,FMN
9,,DOUB,C4A,N5,yes,N,9,,40510,16037,FMN
10,,SING,C4A,C10,yes,N,10,,40510,16037,FMN
11,,SING,N5,C5A,yes,N,11,,40510,16037,FMN
12,,DOUB,C5A,C6,yes,N,12,,40510,16037,FMN
13,,SING,C5A,C9A,yes,N,13,,40510,16037,FMN
14,,SING,C6,C7,yes,N,14,,40510,16037,FMN
15,,SING,C6,H6,no,N,15,,40510,16037,FMN
16,,SING,C7,C7M,no,N,16,,40510,16037,FMN
17,,DOUB,C7,C8,yes,N,17,,40510,16037,FMN
18,,SING,C7M,HM71,no,N,18,,40510,16037,FMN
19,,SING,C7M,HM72,no,N,19,,40510,16037,FMN
20,,SING,C7M,HM73,no,N,20,,40510,16037,FMN
21,,SING,C8,C8M,no,N,21,,40510,16037,FMN
22,,SING,C8,C9,yes,N,22,,40510,16037,FMN
23,,SING,C8M,HM81,no,N,23,,40510,16037,FMN
24,,SING,C8M,HM82,no,N,24,,40510,16037,FMN
25,,SING,C8M,HM83,no,N,25,,40510,16037,FMN
26,,DOUB,C9,C9A,yes,N,26,,40510,16037,FMN
27,,SING,C9,H9,no,N,27,,40510,16037,FMN
28,,SING,C9A,N10,yes,N,28,,40510,16037,FMN
29,,SING,N10,C10,yes,N,29,,40510,16037,FMN
30,,SING,N10,C1',no,N,30,,40510,16037,FMN
31,,SING,C1',C2',no,N,31,,40510,16037,FMN
32,,SING,C1',H1'1,no,N,32,,40510,16037,FMN
33,,SING,C1',H1'2,no,N,33,,40510,16037,FMN
34,,SING,C2',O2',no,N,34,,40510,16037,FMN
35,,SING,C2',C3',no,N,35,,40510,16037,FMN
36,,SING,C2',H2',no,N,36,,40510,16037,FMN
37,,SING,O2',HO2',no,N,37,,40510,16037,FMN
38,,SING,C3',O3',no,N,38,,40510,16037,FMN
39,,SING,C3',C4',no,N,39,,40510,16037,FMN
40,,SING,C3',H3',no,N,40,,40510,16037,FMN
41,,SING,O3',HO3',no,N,41,,40510,16037,FMN
42,,SING,C4',O4',no,N,42,,40510,16037,FMN
43,,SING,C4',C5',no,N,43,,40510,16037,FMN
44,,SING,C4',H4',no,N,44,,40510,16037,FMN
45,,SING,O4',HO4',no,N,45,,40510,16037,FMN
46,,SING,C5',O5',no,N,46,,40510,16037,FMN
47,,SING,C5',H5'1,no,N,47,,40510,16037,FMN
48,,SING,C5',H5'2,no,N,48,,40510,16037,FMN
49,,SING,O5',P,no,N,49,,40510,16037,FMN
50,,DOUB,P,O1P,no,N,50,,40510,16037,FMN
51,,SING,P,O2P,no,N,51,,40510,16037,FMN
52,,SING,P,O3P,no,N,52,,40510,16037,FMN
53,,SING,O2P,HOP2,no,N,53,,40510,16037,FMN
54,,SING,O3P,HOP3,no,N,54,,40510,16037,FMN
1,,SING,N,CA,,,,,40531,16038,TPO
2,,SING,N,H,,,,,40531,16038,TPO
3,,SING,N,H2,,,,,40531,16038,TPO
4,,SING,CA,CB,,,,,40531,16038,TPO
5,,SING,CA,C,,,,,40531,16038,TPO
6,,SING,CA,HA,,,,,40531,16038,TPO
7,,SING,CB,CG2,,,,,40531,16038,TPO
8,,SING,CB,OG1,,,,,40531,16038,TPO
9,,SING,CB,HB,,,,,40531,16038,TPO
10,,SING,CG2,HG21,,,,,40531,16038,TPO
11,,SING,CG2,HG22,,,,,40531,16038,TPO
12,,SING,CG2,HG23,,,,,40531,16038,TPO
13,,SING,OG1,P,,,,,40531,16038,TPO
14,,DOUB,P,O1P,,,,,40531,16038,TPO
15,,SING,P,O2P,,,,,40531,16038,TPO
16,,SING,P,O3P,,,,,40531,16038,TPO
17,,SING,O2P,HOP2,,,,,40531,16038,TPO
18,,SING,O3P,HOP3,,,,,40531,16038,TPO
19,,DOUB,C,O,,,,,40531,16038,TPO
20,,SING,C,OXT,,,,,40531,16038,TPO
21,,SING,OXT,HXT,,,,,40531,16038,TPO
1,,SING,N,CA,,,,,40563,16040,PCA
2,,SING,N,CD,,,,,40563,16040,PCA
3,,SING,N,H,,,,,40563,16040,PCA
4,,SING,CA,CB,,,,,40563,16040,PCA
5,,SING,CA,C,,,,,40563,16040,PCA
6,,SING,CA,HA,,,,,40563,16040,PCA
7,,SING,CB,CG,,,,,40563,16040,PCA
8,,SING,CB,HB2,,,,,40563,16040,PCA
9,,SING,CB,HB3,,,,,40563,16040,PCA
10,,SING,CG,CD,,,,,40563,16040,PCA
11,,SING,CG,HG2,,,,,40563,16040,PCA
12,,SING,CG,HG3,,,,,40563,16040,PCA
13,,DOUB,CD,OE,,,,,40563,16040,PCA
14,,DOUB,C,O,,,,,40563,16040,PCA
15,,SING,C,OXT,,,,,40563,16040,PCA
16,,SING,OXT,HXT,,,,,40563,16040,PCA
1,,DOUB,C1,O1,,,,,40666,16046,HXA
2,,SING,C1,O2,,,,,40666,16046,HXA
3,,SING,C1,C2,,,,,40666,16046,HXA
4,,SING,O2,HO2,,,,,40666,16046,HXA
5,,SING,C2,C3,,,,,40666,16046,HXA
6,,SING,C2,H21,,,,,40666,16046,HXA
7,,SING,C2,H22,,,,,40666,16046,HXA
8,,SING,C3,C4,,,,,40666,16046,HXA
9,,SING,C3,H31,,,,,40666,16046,HXA
10,,SING,C3,H32,,,,,40666,16046,HXA
11,,DOUB,C4,C5,,,,,40666,16046,HXA
12,,SING,C4,H4,,,,,40666,16046,HXA
13,,SING,C5,C6,,,,,40666,16046,HXA
14,,SING,C5,H5,,,,,40666,16046,HXA
15,,SING,C6,C7,,,,,40666,16046,HXA
16,,SING,C6,H61,,,,,40666,16046,HXA
17,,SING,C6,H62,,,,,40666,16046,HXA
18,,DOUB,C7,C8,,,,,40666,16046,HXA
19,,SING,C7,H7,,,,,40666,16046,HXA
20,,SING,C8,C9,,,,,40666,16046,HXA
21,,SING,C8,H8,,,,,40666,16046,HXA
22,,SING,C9,C10,,,,,40666,16046,HXA
23,,SING,C9,H91,,,,,40666,16046,HXA
24,,SING,C9,H92,,,,,40666,16046,HXA
25,,DOUB,C10,C11,,,,,40666,16046,HXA
26,,SING,C10,H10,,,,,40666,16046,HXA
27,,SING,C11,C12,,,,,40666,16046,HXA
28,,SING,C11,H11,,,,,40666,16046,HXA
29,,SING,C12,C13,,,,,40666,16046,HXA
30,,SING,C12,H121,,,,,40666,16046,HXA
31,,SING,C12,H122,,,,,40666,16046,HXA
32,,DOUB,C13,C14,,,,,40666,16046,HXA
33,,SING,C13,H13,,,,,40666,16046,HXA
34,,SING,C14,C15,,,,,40666,16046,HXA
35,,SING,C14,H14,,,,,40666,16046,HXA
36,,SING,C15,C16,,,,,40666,16046,HXA
37,,SING,C15,H151,,,,,40666,16046,HXA
38,,SING,C15,H152,,,,,40666,16046,HXA
39,,DOUB,C16,C17,,,,,40666,16046,HXA
40,,SING,C16,H16,,,,,40666,16046,HXA
41,,SING,C17,C18,,,,,40666,16046,HXA
42,,SING,C17,H17,,,,,40666,16046,HXA
43,,SING,C18,C19,,,,,40666,16046,HXA
44,,SING,C18,H181,,,,,40666,16046,HXA
45,,SING,C18,H182,,,,,40666,16046,HXA
46,,DOUB,C19,C20,,,,,40666,16046,HXA
47,,SING,C19,H19,,,,,40666,16046,HXA
48,,SING,C20,C21,,,,,40666,16046,HXA
49,,SING,C20,H20,,,,,40666,16046,HXA
50,,SING,C21,C22,,,,,40666,16046,HXA
51,,SING,C21,H211,,,,,40666,16046,HXA
52,,SING,C21,H212,,,,,40666,16046,HXA
53,,SING,C22,H221,,,,,40666,16046,HXA
54,,SING,C22,H222,,,,,40666,16046,HXA
55,,SING,C22,H223,,,,,40666,16046,HXA
1,,SING,CA,C,no,N,1,,40682,16047,ELA
2,,SING,CA,C3,no,N,2,,40682,16047,ELA
3,,SING,CA,HA1,no,N,3,,40682,16047,ELA
4,,SING,CA,HA2,no,N,4,,40682,16047,ELA
5,,DOUB,C,O,no,N,5,,40682,16047,ELA
6,,SING,C,OXT,no,N,6,,40682,16047,ELA
7,,SING,C3,C4,no,N,7,,40682,16047,ELA
8,,SING,C3,H31,no,N,8,,40682,16047,ELA
9,,SING,C3,H32,no,N,9,,40682,16047,ELA
10,,SING,C4,C5,no,N,10,,40682,16047,ELA
11,,SING,C4,H41,no,N,11,,40682,16047,ELA
12,,SING,C4,H42,no,N,12,,40682,16047,ELA
13,,SING,C5,C6,no,N,13,,40682,16047,ELA
14,,SING,C5,H51,no,N,14,,40682,16047,ELA
15,,SING,C5,H52,no,N,15,,40682,16047,ELA
16,,SING,C6,C7,no,N,16,,40682,16047,ELA
17,,SING,C6,H61,no,N,17,,40682,16047,ELA
18,,SING,C6,H62,no,N,18,,40682,16047,ELA
19,,SING,C7,C8,no,N,19,,40682,16047,ELA
20,,SING,C7,H71,no,N,20,,40682,16047,ELA
21,,SING,C7,H72,no,N,21,,40682,16047,ELA
22,,SING,C8,C9,no,N,22,,40682,16047,ELA
23,,SING,C8,H81,no,N,23,,40682,16047,ELA
24,,SING,C8,H82,no,N,24,,40682,16047,ELA
25,,DOUB,C9,C10,no,E,25,,40682,16047,ELA
26,,SING,C9,H9,no,N,26,,40682,16047,ELA
27,,SING,C10,C11,no,N,27,,40682,16047,ELA
28,,SING,C10,H10,no,N,28,,40682,16047,ELA
29,,SING,C11,C12,no,N,29,,40682,16047,ELA
30,,SING,C11,H111,no,N,30,,40682,16047,ELA
31,,SING,C11,H112,no,N,31,,40682,16047,ELA
32,,SING,C12,C13,no,N,32,,40682,16047,ELA
33,,SING,C12,H121,no,N,33,,40682,16047,ELA
34,,SING,C12,H122,no,N,34,,40682,16047,ELA
35,,SING,C13,C14,no,N,35,,40682,16047,ELA
36,,SING,C13,H131,no,N,36,,40682,16047,ELA
37,,SING,C13,H132,no,N,37,,40682,16047,ELA
38,,SING,C14,C15,no,N,38,,40682,16047,ELA
39,,SING,C14,H141,no,N,39,,40682,16047,ELA
40,,SING,C14,H142,no,N,40,,40682,16047,ELA
41,,SING,C15,C16,no,N,41,,40682,16047,ELA
42,,SING,C15,H151,no,N,42,,40682,16047,ELA
43,,SING,C15,H152,no,N,43,,40682,16047,ELA
44,,SING,C16,C17,no,N,44,,40682,16047,ELA
45,,SING,C16,H161,no,N,45,,40682,16047,ELA
46,,SING,C16,H162,no,N,46,,40682,16047,ELA
47,,SING,C17,C18,no,N,47,,40682,16047,ELA
48,,SING,C17,H171,no,N,48,,40682,16047,ELA
49,,SING,C17,H172,no,N,49,,40682,16047,ELA
50,,SING,C18,H181,no,N,50,,40682,16047,ELA
51,,SING,C18,H182,no,N,51,,40682,16047,ELA
52,,SING,C18,H183,no,N,52,,40682,16047,ELA
53,,SING,OXT,HXT,no,N,53,,40682,16047,ELA
1,,DOUB,C1,O1,no,N,1,,40698,16048,OLA
2,,SING,C1,O2,no,N,2,,40698,16048,OLA
3,,SING,C1,C2,no,N,3,,40698,16048,OLA
4,,SING,O2,HO2,no,N,4,,40698,16048,OLA
5,,SING,C2,C3,no,N,5,,40698,16048,OLA
6,,SING,C2,H21,no,N,6,,40698,16048,OLA
7,,SING,C2,H22,no,N,7,,40698,16048,OLA
8,,SING,C3,C4,no,N,8,,40698,16048,OLA
9,,SING,C3,H31,no,N,9,,40698,16048,OLA
10,,SING,C3,H32,no,N,10,,40698,16048,OLA
11,,SING,C4,C5,no,N,11,,40698,16048,OLA
12,,SING,C4,H41,no,N,12,,40698,16048,OLA
13,,SING,C4,H42,no,N,13,,40698,16048,OLA
14,,SING,C5,C6,no,N,14,,40698,16048,OLA
15,,SING,C5,H51,no,N,15,,40698,16048,OLA
16,,SING,C5,H52,no,N,16,,40698,16048,OLA
17,,SING,C6,C7,no,N,17,,40698,16048,OLA
18,,SING,C6,H61,no,N,18,,40698,16048,OLA
19,,SING,C6,H62,no,N,19,,40698,16048,OLA
20,,SING,C7,C8,no,N,20,,40698,16048,OLA
21,,SING,C7,H71,no,N,21,,40698,16048,OLA
22,,SING,C7,H72,no,N,22,,40698,16048,OLA
23,,SING,C8,C9,no,N,23,,40698,16048,OLA
24,,SING,C8,H81,no,N,24,,40698,16048,OLA
25,,SING,C8,H82,no,N,25,,40698,16048,OLA
26,,DOUB,C9,C10,no,Z,26,,40698,16048,OLA
27,,SING,C9,H9,no,N,27,,40698,16048,OLA
28,,SING,C10,C11,no,N,28,,40698,16048,OLA
29,,SING,C10,H10,no,N,29,,40698,16048,OLA
30,,SING,C11,C12,no,N,30,,40698,16048,OLA
31,,SING,C11,H111,no,N,31,,40698,16048,OLA
32,,SING,C11,H112,no,N,32,,40698,16048,OLA
33,,SING,C12,C13,no,N,33,,40698,16048,OLA
34,,SING,C12,H121,no,N,34,,40698,16048,OLA
35,,SING,C12,H122,no,N,35,,40698,16048,OLA
36,,SING,C13,C14,no,N,36,,40698,16048,OLA
37,,SING,C13,H131,no,N,37,,40698,16048,OLA
38,,SING,C13,H132,no,N,38,,40698,16048,OLA
39,,SING,C14,C15,no,N,39,,40698,16048,OLA
40,,SING,C14,H141,no,N,40,,40698,16048,OLA
41,,SING,C14,H142,no,N,41,,40698,16048,OLA
42,,SING,C15,C16,no,N,42,,40698,16048,OLA
43,,SING,C15,H151,no,N,43,,40698,16048,OLA
44,,SING,C15,H152,no,N,44,,40698,16048,OLA
45,,SING,C16,C17,no,N,45,,40698,16048,OLA
46,,SING,C16,H161,no,N,46,,40698,16048,OLA
47,,SING,C16,H162,no,N,47,,40698,16048,OLA
48,,SING,C17,C18,no,N,48,,40698,16048,OLA
49,,SING,C17,H171,no,N,49,,40698,16048,OLA
50,,SING,C17,H172,no,N,50,,40698,16048,OLA
51,,SING,C18,H181,no,N,51,,40698,16048,OLA
52,,SING,C18,H182,no,N,52,,40698,16048,OLA
53,,SING,C18,H183,no,N,53,,40698,16048,OLA
1,,SING,C1,C2,,,,,40714,16049,EIC
2,,DOUB,C1,O1,,,,,40714,16049,EIC
3,,SING,C1,O2,,,,,40714,16049,EIC
4,,SING,C2,C3,,,,,40714,16049,EIC
5,,SING,C2,H21,,,,,40714,16049,EIC
6,,SING,C2,H22,,,,,40714,16049,EIC
7,,SING,C3,C4,,,,,40714,16049,EIC
8,,SING,C3,H31,,,,,40714,16049,EIC
9,,SING,C3,H32,,,,,40714,16049,EIC
10,,SING,C4,C5,,,,,40714,16049,EIC
11,,SING,C4,H41,,,,,40714,16049,EIC
12,,SING,C4,H42,,,,,40714,16049,EIC
13,,SING,C5,C6,,,,,40714,16049,EIC
14,,SING,C5,H51,,,,,40714,16049,EIC
15,,SING,C5,H52,,,,,40714,16049,EIC
16,,SING,C6,C7,,,,,40714,16049,EIC
17,,SING,C6,H61,,,,,40714,16049,EIC
18,,SING,C6,H62,,,,,40714,16049,EIC
19,,SING,C7,C8,,,,,40714,16049,EIC
20,,SING,C7,H71,,,,,40714,16049,EIC
21,,SING,C7,H72,,,,,40714,16049,EIC
22,,SING,C8,C9,,,,,40714,16049,EIC
23,,SING,C8,H81,,,,,40714,16049,EIC
24,,SING,C8,H82,,,,,40714,16049,EIC
25,,DOUB,C9,C10,,,,,40714,16049,EIC
26,,SING,C9,H91,,,,,40714,16049,EIC
27,,SING,C10,C11,,,,,40714,16049,EIC
28,,SING,C10,H1O1,,,,,40714,16049,EIC
29,,SING,C11,C12,,,,,40714,16049,EIC
30,,SING,C11,H111,,,,,40714,16049,EIC
31,,SING,C11,H112,,,,,40714,16049,EIC
32,,DOUB,C12,C13,,,,,40714,16049,EIC
33,,SING,C12,H121,,,,,40714,16049,EIC
34,,SING,C13,C14,,,,,40714,16049,EIC
35,,SING,C13,H131,,,,,40714,16049,EIC
36,,SING,C14,C15,,,,,40714,16049,EIC
37,,SING,C14,H141,,,,,40714,16049,EIC
38,,SING,C14,H142,,,,,40714,16049,EIC
39,,SING,C15,C16,,,,,40714,16049,EIC
40,,SING,C15,H151,,,,,40714,16049,EIC
41,,SING,C15,H152,,,,,40714,16049,EIC
42,,SING,C16,C17,,,,,40714,16049,EIC
43,,SING,C16,H161,,,,,40714,16049,EIC
44,,SING,C16,H162,,,,,40714,16049,EIC
45,,SING,C17,C18,,,,,40714,16049,EIC
46,,SING,C17,H171,,,,,40714,16049,EIC
47,,SING,C17,H172,,,,,40714,16049,EIC
48,,SING,C18,H181,,,,,40714,16049,EIC
49,,SING,C18,H182,,,,,40714,16049,EIC
50,,SING,C18,H183,,,,,40714,16049,EIC
51,,SING,O2,HO2,,,,,40714,16049,EIC
1,,DOUB,C,O,no,N,1,,40842,16056,ACE
2,,SING,C,CH3,no,N,2,,40842,16056,ACE
3,,SING,C,H,no,N,3,,40842,16056,ACE
4,,SING,CH3,H1,no,N,4,,40842,16056,ACE
5,,SING,CH3,H2,no,N,5,,40842,16056,ACE
6,,SING,CH3,H3,no,N,6,,40842,16056,ACE
1,,SING,N,HN1,no,N,1,,40843,16056,NH2
2,,SING,N,HN2,no,N,2,,40843,16056,NH2
1,,DOUB,P,O1P,no,N,1,,40902,16059,AMP
2,,SING,P,O2P,no,N,2,,40902,16059,AMP
3,,SING,P,O3P,no,N,3,,40902,16059,AMP
4,,SING,P,O5',no,N,4,,40902,16059,AMP
5,,SING,O2P,HOP2,no,N,5,,40902,16059,AMP
6,,SING,O3P,HOP3,no,N,6,,40902,16059,AMP
7,,SING,O5',C5',no,N,7,,40902,16059,AMP
8,,SING,C5',C4',no,N,8,,40902,16059,AMP
9,,SING,C5',H5'1,no,N,9,,40902,16059,AMP
10,,SING,C5',H5'2,no,N,10,,40902,16059,AMP
11,,SING,C4',O4',no,N,11,,40902,16059,AMP
12,,SING,C4',C3',no,N,12,,40902,16059,AMP
13,,SING,C4',H4',no,N,13,,40902,16059,AMP
14,,SING,O4',C1',no,N,14,,40902,16059,AMP
15,,SING,C3',O3',no,N,15,,40902,16059,AMP
16,,SING,C3',C2',no,N,16,,40902,16059,AMP
17,,SING,C3',H3',no,N,17,,40902,16059,AMP
18,,SING,O3',HO3',no,N,18,,40902,16059,AMP
19,,SING,C2',O2',no,N,19,,40902,16059,AMP
20,,SING,C2',C1',no,N,20,,40902,16059,AMP
21,,SING,C2',H2',no,N,21,,40902,16059,AMP
22,,SING,O2',HO2',no,N,22,,40902,16059,AMP
23,,SING,C1',N9,no,N,23,,40902,16059,AMP
24,,SING,C1',H1',no,N,24,,40902,16059,AMP
25,,SING,N9,C8,yes,N,25,,40902,16059,AMP
26,,SING,N9,C4,yes,N,26,,40902,16059,AMP
27,,DOUB,C8,N7,yes,N,27,,40902,16059,AMP
28,,SING,C8,H8,no,N,28,,40902,16059,AMP
29,,SING,N7,C5,yes,N,29,,40902,16059,AMP
30,,SING,C5,C6,yes,N,30,,40902,16059,AMP
31,,DOUB,C5,C4,yes,N,31,,40902,16059,AMP
32,,SING,C6,N6,no,N,32,,40902,16059,AMP
33,,DOUB,C6,N1,yes,N,33,,40902,16059,AMP
34,,SING,N6,HN61,no,N,34,,40902,16059,AMP
35,,SING,N6,HN62,no,N,35,,40902,16059,AMP
36,,SING,N1,C2,yes,N,36,,40902,16059,AMP
37,,DOUB,C2,N3,yes,N,37,,40902,16059,AMP
38,,SING,C2,H2,no,N,38,,40902,16059,AMP
39,,SING,N3,C4,yes,N,39,,40902,16059,AMP
1,,SING,C4,H44,no,N,1,,42309,16138,D33
2,,DOUB,C5,C4,yes,N,2,,42309,16138,D33
3,,DOUB,C2,N3,yes,N,3,,42309,16138,D33
4,,SING,N1,C5,yes,N,4,,42309,16138,D33
5,,SING,N1,C2,yes,N,5,,42309,16138,D33
6,,SING,P,O5',no,N,6,,42309,16138,D33
7,,SING,P,OP2,no,N,7,,42309,16138,D33
8,,DOUB,OP1,P,no,N,8,,42309,16138,D33
9,,SING,OP2,HOP2,no,N,9,,42309,16138,D33
10,,SING,C5',O5',no,N,10,,42309,16138,D33
11,,SING,C5',C4',no,N,11,,42309,16138,D33
12,,SING,C5',H25',no,N,12,,42309,16138,D33
13,,SING,C4',O4',no,N,13,,42309,16138,D33
14,,SING,C4',C3',no,N,14,,42309,16138,D33
15,,SING,O4',C1',no,N,15,,42309,16138,D33
16,,SING,C1',N1,no,N,16,,42309,16138,D33
17,,SING,C1',C2',no,N,17,,42309,16138,D33
18,,SING,N3,C4,yes,N,18,,42309,16138,D33
19,,SING,C2',H22',no,N,19,,42309,16138,D33
20,,SING,C2',H12',no,N,20,,42309,16138,D33
21,,SING,C3',C2',no,N,21,,42309,16138,D33
22,,SING,C3',H3',no,N,22,,42309,16138,D33
23,,SING,O3',C3',no,N,23,,42309,16138,D33
24,,SING,O3',HO3',no,N,24,,42309,16138,D33
25,,SING,H15',C5',no,N,25,,42309,16138,D33
26,,SING,H4',C4',no,N,26,,42309,16138,D33
27,,SING,H1',C1',no,N,27,,42309,16138,D33
28,,SING,H55,C5,no,N,28,,42309,16138,D33
29,,SING,H22,C2,no,N,29,,42309,16138,D33
30,,SING,P,OP3,no,N,30,,42309,16138,D33
31,,SING,OP3,HOP3,no,N,31,,42309,16138,D33
1,,SING,N,CA,no,N,1,,42348,16140,SEC
2,,SING,N,H,no,N,2,,42348,16140,SEC
3,,SING,N,H2,no,N,3,,42348,16140,SEC
4,,SING,CA,CB,no,N,4,,42348,16140,SEC
5,,SING,CA,C,no,N,5,,42348,16140,SEC
6,,SING,CA,HA,no,N,6,,42348,16140,SEC
7,,SING,CB,SE,no,N,7,,42348,16140,SEC
8,,SING,CB,HB2,no,N,8,,42348,16140,SEC
9,,SING,CB,HB3,no,N,9,,42348,16140,SEC
10,,SING,SE,HE,no,N,10,,42348,16140,SEC
11,,DOUB,C,O,no,N,11,,42348,16140,SEC
12,,SING,C,OXT,no,N,12,,42348,16140,SEC
13,,SING,OXT,HXT,no,N,13,,42348,16140,SEC
1,,SING,CD1,CG,no,N,1,,43155,16182,NLW
2,,SING,CG,CD2,no,N,2,,43155,16182,NLW
3,,SING,CG,CB,no,N,3,,43155,16182,NLW
4,,SING,CB,CA,no,N,4,,43155,16182,NLW
5,,SING,N,CA,no,N,5,,43155,16182,NLW
6,,SING,CA,C,no,N,6,,43155,16182,NLW
7,,SING,C,NH2,no,N,7,,43155,16182,NLW
8,,DOUB,C,O,no,N,8,,43155,16182,NLW
9,,SING,CD2,H1,no,N,9,,43155,16182,NLW
10,,SING,CD2,H2,no,N,10,,43155,16182,NLW
11,,SING,CD2,H3,no,N,11,,43155,16182,NLW
12,,SING,CG,H4,no,N,12,,43155,16182,NLW
13,,SING,CD1,H5,no,N,13,,43155,16182,NLW
14,,SING,CD1,H6,no,N,14,,43155,16182,NLW
15,,SING,CD1,H7,no,N,15,,43155,16182,NLW
16,,SING,CB,H8,no,N,16,,43155,16182,NLW
17,,SING,CB,H9,no,N,17,,43155,16182,NLW
18,,SING,CA,H10,no,N,18,,43155,16182,NLW
19,,SING,N,H11,no,N,19,,43155,16182,NLW
20,,SING,N,H12,no,N,20,,43155,16182,NLW
21,,SING,NH2,H14,no,N,21,,43155,16182,NLW
22,,SING,NH2,H15,no,N,22,,43155,16182,NLW
1,,DOUB,S1,O1,no,N,1,,43343,16190,WW7
2,,DOUB,S1,O2,no,N,2,,43343,16190,WW7
3,,SING,S1,N1,no,N,3,,43343,16190,WW7
4,,SING,S1,C1,no,N,4,,43343,16190,WW7
5,,SING,N1,C11,no,N,5,,43343,16190,WW7
6,,SING,N1,HN1,no,N,6,,43343,16190,WW7
7,,DOUB,C4,C3,yes,N,7,,43343,16190,WW7
8,,SING,C4,C10,yes,N,8,,43343,16190,WW7
9,,SING,C4,H4,no,N,9,,43343,16190,WW7
10,,SING,C3,C2,yes,N,10,,43343,16190,WW7
11,,SING,C3,H3,no,N,11,,43343,16190,WW7
12,,DOUB,C2,C1,yes,N,12,,43343,16190,WW7
13,,SING,C2,H2,no,N,13,,43343,16190,WW7
14,,SING,C1,C9,yes,N,14,,43343,16190,WW7
15,,DOUB,C9,C10,yes,N,15,,43343,16190,WW7
16,,SING,C9,C8,yes,N,16,,43343,16190,WW7
17,,SING,C10,C5,yes,N,17,,43343,16190,WW7
18,,SING,CL1,C5,no,N,18,,43343,16190,WW7
19,,DOUB,C5,C6,yes,N,19,,43343,16190,WW7
20,,SING,C6,C7,yes,N,20,,43343,16190,WW7
21,,SING,C6,H6,no,N,21,,43343,16190,WW7
22,,DOUB,C7,C8,yes,N,22,,43343,16190,WW7
23,,SING,C7,H7,no,N,23,,43343,16190,WW7
24,,SING,C8,H8,no,N,24,,43343,16190,WW7
25,,SING,C11,C12,no,N,25,,43343,16190,WW7
26,,SING,C11,H111,no,N,26,,43343,16190,WW7
27,,SING,C11,H112,no,N,27,,43343,16190,WW7
28,,SING,C12,C13,no,N,28,,43343,16190,WW7
29,,SING,C12,H121,no,N,29,,43343,16190,WW7
30,,SING,C12,H122,no,N,30,,43343,16190,WW7
31,,SING,C14,C13,no,N,31,,43343,16190,WW7
32,,SING,C14,C15,no,N,32,,43343,16190,WW7
33,,SING,C14,H141,no,N,33,,43343,16190,WW7
34,,SING,C14,H142,no,N,34,,43343,16190,WW7
35,,SING,C13,H131,no,N,35,,43343,16190,WW7
36,,SING,C13,H132,no,N,36,,43343,16190,WW7
37,,SING,C15,C16,no,N,37,,43343,16190,WW7
38,,SING,C15,H151,no,N,38,,43343,16190,WW7
39,,SING,C15,H152,no,N,39,,43343,16190,WW7
40,,SING,C16,N2,no,N,40,,43343,16190,WW7
41,,SING,C16,H161,no,N,41,,43343,16190,WW7
42,,SING,C16,H162,no,N,42,,43343,16190,WW7
43,,SING,N2,HN21,no,N,43,,43343,16190,WW7
44,,SING,N2,HN22,no,N,44,,43343,16190,WW7
1,,SING,P24,O26,no,N,1,,43454,16196,SXA
2,,DOUB,P24,O23,no,N,2,,43454,16196,SXA
3,,SING,P24,O27,no,N,3,,43454,16196,SXA
4,,SING,O27,C28,no,N,4,,43454,16196,SXA
5,,SING,C28,C29,no,N,5,,43454,16196,SXA
6,,SING,C28,H28,no,N,6,,43454,16196,SXA
7,,SING,C28,H28A,no,N,7,,43454,16196,SXA
8,,SING,C29,C30,no,N,8,,43454,16196,SXA
9,,SING,C29,C31,no,N,9,,43454,16196,SXA
10,,SING,C29,C32,no,N,10,,43454,16196,SXA
11,,SING,C30,H30,no,N,11,,43454,16196,SXA
12,,SING,C30,H30A,no,N,12,,43454,16196,SXA
13,,SING,C30,H30B,no,N,13,,43454,16196,SXA
14,,SING,C31,H31,no,N,14,,43454,16196,SXA
15,,SING,C31,H31A,no,N,15,,43454,16196,SXA
16,,SING,C31,H31B,no,N,16,,43454,16196,SXA
17,,SING,C32,O33,no,N,17,,43454,16196,SXA
18,,SING,C32,C34,no,N,18,,43454,16196,SXA
19,,SING,C32,H32,no,N,19,,43454,16196,SXA
20,,SING,O33,HO33,no,N,20,,43454,16196,SXA
21,,DOUB,C34,O35,no,N,21,,43454,16196,SXA
22,,SING,C34,N36,no,N,22,,43454,16196,SXA
23,,SING,N36,C37,no,N,23,,43454,16196,SXA
24,,SING,N36,HN36,no,N,24,,43454,16196,SXA
25,,SING,C37,C38,no,N,25,,43454,16196,SXA
26,,SING,C37,H37,no,N,26,,43454,16196,SXA
27,,SING,C37,H37A,no,N,27,,43454,16196,SXA
28,,SING,C38,C39,no,N,28,,43454,16196,SXA
29,,SING,C38,H38,no,N,29,,43454,16196,SXA
30,,SING,C38,H38A,no,N,30,,43454,16196,SXA
31,,DOUB,C39,O40,no,N,31,,43454,16196,SXA
32,,SING,C39,N41,no,N,32,,43454,16196,SXA
33,,SING,N41,C42,no,N,33,,43454,16196,SXA
34,,SING,N41,HN41,no,N,34,,43454,16196,SXA
35,,SING,C42,C43,no,N,35,,43454,16196,SXA
36,,SING,C42,H42,no,N,36,,43454,16196,SXA
37,,SING,C42,H42A,no,N,37,,43454,16196,SXA
38,,SING,C43,S1,no,N,38,,43454,16196,SXA
39,,SING,C43,H43,no,N,39,,43454,16196,SXA
40,,SING,C43,H43A,no,N,40,,43454,16196,SXA
41,,SING,S1,C1,no,N,41,,43454,16196,SXA
42,,DOUB,C1,O1,no,N,42,,43454,16196,SXA
43,,SING,C1,C2,no,N,43,,43454,16196,SXA
44,,SING,C2,H2,no,N,44,,43454,16196,SXA
45,,SING,C2,H2A,no,N,45,,43454,16196,SXA
46,,SING,C2,H2B,no,N,46,,43454,16196,SXA
47,,SING,P24,O8,no,N,47,,43454,16196,SXA
48,,SING,O26,H24,no,N,48,,43454,16196,SXA
49,,SING,O8,H25,no,N,49,,43454,16196,SXA
1,,SING,P24,O27,no,N,1,,43472,16197,SXM
2,,SING,P24,O23,no,N,2,,43472,16197,SXM
3,,SING,O26,P24,no,N,3,,43472,16197,SXM
4,,SING,O26,HO26,no,N,4,,43472,16197,SXM
5,,SING,O23,HO23,no,N,5,,43472,16197,SXM
6,,SING,C28,O27,no,N,6,,43472,16197,SXM
7,,SING,C28,H28,no,N,7,,43472,16197,SXM
8,,SING,C28,C29,no,N,8,,43472,16197,SXM
9,,SING,C29,C31,no,N,9,,43472,16197,SXM
10,,SING,C30,C29,no,N,10,,43472,16197,SXM
11,,SING,C30,H30,no,N,11,,43472,16197,SXM
12,,SING,C30,H30A,no,N,12,,43472,16197,SXM
13,,SING,C31,H31A,no,N,13,,43472,16197,SXM
14,,SING,C31,H31B,no,N,14,,43472,16197,SXM
15,,SING,C31,H31,no,N,15,,43472,16197,SXM
16,,SING,C32,C29,no,N,16,,43472,16197,SXM
17,,SING,C32,C34,no,N,17,,43472,16197,SXM
18,,SING,C32,H32,no,N,18,,43472,16197,SXM
19,,SING,O33,C32,no,N,19,,43472,16197,SXM
20,,DOUB,C34,O35,no,N,20,,43472,16197,SXM
21,,SING,N36,C34,no,N,21,,43472,16197,SXM
22,,SING,C37,N36,no,N,22,,43472,16197,SXM
23,,SING,C37,H37A,no,N,23,,43472,16197,SXM
24,,SING,C37,H37,no,N,24,,43472,16197,SXM
25,,SING,C38,C37,no,N,25,,43472,16197,SXM
26,,SING,C39,C38,no,N,26,,43472,16197,SXM
27,,DOUB,C39,O40,no,N,27,,43472,16197,SXM
28,,SING,N41,C39,no,N,28,,43472,16197,SXM
29,,SING,C42,N41,no,N,29,,43472,16197,SXM
30,,SING,C42,H42,no,N,30,,43472,16197,SXM
31,,SING,C43,C42,no,N,31,,43472,16197,SXM
32,,SING,C43,H43,no,N,32,,43472,16197,SXM
33,,SING,S1,C43,no,N,33,,43472,16197,SXM
34,,SING,S1,C1,no,N,34,,43472,16197,SXM
35,,DOUB,C1,O1,no,N,35,,43472,16197,SXM
36,,SING,C2,C1,no,N,36,,43472,16197,SXM
37,,SING,C2,C3,no,N,37,,43472,16197,SXM
38,,SING,C2,H2,no,N,38,,43472,16197,SXM
39,,SING,C3,O3B,no,N,39,,43472,16197,SXM
40,,DOUB,O3A,C3,no,N,40,,43472,16197,SXM
41,,SING,O3B,HO3B,no,N,41,,43472,16197,SXM
42,,SING,H28A,C28,no,N,42,,43472,16197,SXM
43,,SING,H30B,C30,no,N,43,,43472,16197,SXM
44,,SING,HO33,O33,no,N,44,,43472,16197,SXM
45,,SING,HN36,N36,no,N,45,,43472,16197,SXM
46,,SING,H38,C38,no,N,46,,43472,16197,SXM
47,,SING,H38A,C38,no,N,47,,43472,16197,SXM
48,,SING,HN41,N41,no,N,48,,43472,16197,SXM
49,,SING,H42A,C42,no,N,49,,43472,16197,SXM
50,,SING,H43A,C43,no,N,50,,43472,16197,SXM
51,,SING,H2A,C2,no,N,51,,43472,16197,SXM
52,,DOUB,P24,O10,no,N,52,,43472,16197,SXM
1,,SING,O23,P24,no,N,1,,43504,16199,PSR
2,,SING,O23,H231,no,N,2,,43504,16199,PSR
3,,DOUB,P24,O25,no,N,3,,43504,16199,PSR
4,,SING,P24,O26,no,N,4,,43504,16199,PSR
5,,SING,P24,O27,no,N,5,,43504,16199,PSR
6,,SING,O26,H261,no,N,6,,43504,16199,PSR
7,,SING,O27,C28,no,N,7,,43504,16199,PSR
8,,SING,C28,C29,no,N,8,,43504,16199,PSR
9,,SING,C28,H281,no,N,9,,43504,16199,PSR
10,,SING,C28,H282,no,N,10,,43504,16199,PSR
11,,SING,C29,C30,no,N,11,,43504,16199,PSR
12,,SING,C29,C31,no,N,12,,43504,16199,PSR
13,,SING,C29,C32,no,N,13,,43504,16199,PSR
14,,SING,C30,H301,no,N,14,,43504,16199,PSR
15,,SING,C30,H302,no,N,15,,43504,16199,PSR
16,,SING,C30,H303,no,N,16,,43504,16199,PSR
17,,SING,C31,H311,no,N,17,,43504,16199,PSR
18,,SING,C31,H312,no,N,18,,43504,16199,PSR
19,,SING,C31,H313,no,N,19,,43504,16199,PSR
20,,SING,C32,O33,no,N,20,,43504,16199,PSR
21,,SING,C32,C34,no,N,21,,43504,16199,PSR
22,,SING,C32,H321,no,N,22,,43504,16199,PSR
23,,SING,O33,H331,no,N,23,,43504,16199,PSR
24,,DOUB,C34,O35,no,N,24,,43504,16199,PSR
25,,SING,C34,N36,no,N,25,,43504,16199,PSR
26,,SING,N36,C37,no,N,26,,43504,16199,PSR
27,,SING,N36,H361,no,N,27,,43504,16199,PSR
28,,SING,C37,C38,no,N,28,,43504,16199,PSR
29,,SING,C37,H371,no,N,29,,43504,16199,PSR
30,,SING,C37,H372,no,N,30,,43504,16199,PSR
31,,SING,C38,C39,no,N,31,,43504,16199,PSR
32,,SING,C38,H381,no,N,32,,43504,16199,PSR
33,,SING,C38,H382,no,N,33,,43504,16199,PSR
34,,DOUB,C39,O40,no,N,34,,43504,16199,PSR
35,,SING,C39,N41,no,N,35,,43504,16199,PSR
36,,SING,N41,C42,no,N,36,,43504,16199,PSR
37,,SING,N41,H411,no,N,37,,43504,16199,PSR
38,,SING,C42,C43,no,N,38,,43504,16199,PSR
39,,SING,C42,H421,no,N,39,,43504,16199,PSR
40,,SING,C42,H422,no,N,40,,43504,16199,PSR
41,,SING,C43,S1,no,N,41,,43504,16199,PSR
42,,SING,C43,H431,no,N,42,,43504,16199,PSR
43,,SING,C43,H432,no,N,43,,43504,16199,PSR
44,,SING,S1,C1,no,N,44,,43504,16199,PSR
45,,DOUB,C1,O1,no,N,45,,43504,16199,PSR
46,,SING,C1,C2,no,N,46,,43504,16199,PSR
47,,SING,C2,C3,no,N,47,,43504,16199,PSR
48,,SING,C2,HC21,no,N,48,,43504,16199,PSR
49,,SING,C2,HC22,no,N,49,,43504,16199,PSR
50,,SING,C3,C4,no,N,50,,43504,16199,PSR
51,,SING,C3,HC31,no,N,51,,43504,16199,PSR
52,,SING,C3,HC32,no,N,52,,43504,16199,PSR
53,,SING,C4,HC41,no,N,53,,43504,16199,PSR
54,,SING,C4,HC42,no,N,54,,43504,16199,PSR
55,,SING,C4,HC43,no,N,55,,43504,16199,PSR
1,,SING,P24,O25,no,N,1,,43548,16200,SXH
2,,SING,O25,HO25,no,N,2,,43548,16200,SXH
3,,DOUB,O26,P24,no,N,3,,43548,16200,SXH
4,,SING,P24,O27,no,N,4,,43548,16200,SXH
5,,SING,P24,O23,no,N,5,,43548,16200,SXH
6,,SING,O23,HO23,no,N,6,,43548,16200,SXH
7,,SING,O27,C28,no,N,7,,43548,16200,SXH
8,,SING,C28,H28A,no,N,8,,43548,16200,SXH
9,,SING,C28,C29,no,N,9,,43548,16200,SXH
10,,SING,C28,H28,no,N,10,,43548,16200,SXH
11,,SING,C31,C29,no,N,11,,43548,16200,SXH
12,,SING,C32,C29,no,N,12,,43548,16200,SXH
13,,SING,C29,C30,no,N,13,,43548,16200,SXH
14,,SING,C30,H30B,no,N,14,,43548,16200,SXH
15,,SING,C30,H30A,no,N,15,,43548,16200,SXH
16,,SING,C30,H30,no,N,16,,43548,16200,SXH
17,,SING,H31B,C31,no,N,17,,43548,16200,SXH
18,,SING,C31,H31,no,N,18,,43548,16200,SXH
19,,SING,C31,H31A,no,N,19,,43548,16200,SXH
20,,SING,O33,C32,no,N,20,,43548,16200,SXH
21,,SING,C32,C34,no,N,21,,43548,16200,SXH
22,,SING,C32,H32,no,N,22,,43548,16200,SXH
23,,SING,HO33,O33,no,N,23,,43548,16200,SXH
24,,DOUB,O35,C34,no,N,24,,43548,16200,SXH
25,,SING,C34,N36,no,N,25,,43548,16200,SXH
26,,SING,N36,C37,no,N,26,,43548,16200,SXH
27,,SING,N36,HN36,no,N,27,,43548,16200,SXH
28,,SING,H37,C37,no,N,28,,43548,16200,SXH
29,,SING,H37A,C37,no,N,29,,43548,16200,SXH
30,,SING,C37,C38,no,N,30,,43548,16200,SXH
31,,SING,C38,H38,no,N,31,,43548,16200,SXH
32,,SING,C38,C39,no,N,32,,43548,16200,SXH
33,,SING,C38,H38A,no,N,33,,43548,16200,SXH
34,,SING,N41,C39,no,N,34,,43548,16200,SXH
35,,DOUB,C39,O40,no,N,35,,43548,16200,SXH
36,,SING,HN41,N41,no,N,36,,43548,16200,SXH
37,,SING,N41,C42,no,N,37,,43548,16200,SXH
38,,SING,C43,C42,no,N,38,,43548,16200,SXH
39,,SING,C42,H42,no,N,39,,43548,16200,SXH
40,,SING,C42,H42A,no,N,40,,43548,16200,SXH
41,,SING,S1,C43,no,N,41,,43548,16200,SXH
42,,SING,C43,H43,no,N,42,,43548,16200,SXH
43,,SING,C43,H43A,no,N,43,,43548,16200,SXH
44,,SING,C1,S1,no,N,44,,43548,16200,SXH
45,,SING,C2,C1,no,N,45,,43548,16200,SXH
46,,DOUB,C1,O1,no,N,46,,43548,16200,SXH
47,,SING,C3,C2,no,N,47,,43548,16200,SXH
48,,SING,H2,C2,no,N,48,,43548,16200,SXH
49,,SING,H2A,C2,no,N,49,,43548,16200,SXH
50,,SING,H3,C3,no,N,50,,43548,16200,SXH
51,,SING,C3,C4,no,N,51,,43548,16200,SXH
52,,SING,C3,H3A,no,N,52,,43548,16200,SXH
53,,SING,C5,C4,no,N,53,,43548,16200,SXH
54,,SING,H4A,C4,no,N,54,,43548,16200,SXH
55,,SING,C4,H4,no,N,55,,43548,16200,SXH
56,,SING,C6,C5,no,N,56,,43548,16200,SXH
57,,SING,C5,H5,no,N,57,,43548,16200,SXH
58,,SING,C5,H5A,no,N,58,,43548,16200,SXH
59,,SING,H6B,C6,no,N,59,,43548,16200,SXH
60,,SING,H6A,C6,no,N,60,,43548,16200,SXH
61,,SING,H6,C6,no,N,61,,43548,16200,SXH
1,,SING,P24,O25,no,N,1,,43566,16201,SXO
2,,SING,O25,HO25,no,N,2,,43566,16201,SXO
3,,DOUB,O23,P24,no,N,3,,43566,16201,SXO
4,,SING,P24,O27,no,N,4,,43566,16201,SXO
5,,SING,P24,O26,no,N,5,,43566,16201,SXO
6,,SING,O26,HO26,no,N,6,,43566,16201,SXO
7,,SING,O27,C28,no,N,7,,43566,16201,SXO
8,,SING,C28,H28A,no,N,8,,43566,16201,SXO
9,,SING,C28,C29,no,N,9,,43566,16201,SXO
10,,SING,C28,H28,no,N,10,,43566,16201,SXO
11,,SING,C31,C29,no,N,11,,43566,16201,SXO
12,,SING,C29,C32,no,N,12,,43566,16201,SXO
13,,SING,C29,C30,no,N,13,,43566,16201,SXO
14,,SING,H30,C30,no,N,14,,43566,16201,SXO
15,,SING,C30,H30B,no,N,15,,43566,16201,SXO
16,,SING,C30,H30A,no,N,16,,43566,16201,SXO
17,,SING,H31,C31,no,N,17,,43566,16201,SXO
18,,SING,H31A,C31,no,N,18,,43566,16201,SXO
19,,SING,C31,H31B,no,N,19,,43566,16201,SXO
20,,SING,O33,C32,no,N,20,,43566,16201,SXO
21,,SING,C32,C34,no,N,21,,43566,16201,SXO
22,,SING,C32,H32,no,N,22,,43566,16201,SXO
23,,SING,HO33,O33,no,N,23,,43566,16201,SXO
24,,DOUB,O35,C34,no,N,24,,43566,16201,SXO
25,,SING,C34,N36,no,N,25,,43566,16201,SXO
26,,SING,N36,C37,no,N,26,,43566,16201,SXO
27,,SING,N36,HN36,no,N,27,,43566,16201,SXO
28,,SING,H37,C37,no,N,28,,43566,16201,SXO
29,,SING,C37,H37A,no,N,29,,43566,16201,SXO
30,,SING,C37,C38,no,N,30,,43566,16201,SXO
31,,SING,C39,C38,no,N,31,,43566,16201,SXO
32,,SING,C38,H38A,no,N,32,,43566,16201,SXO
33,,SING,C38,H38,no,N,33,,43566,16201,SXO
34,,SING,N41,C39,no,N,34,,43566,16201,SXO
35,,DOUB,C39,O40,no,N,35,,43566,16201,SXO
36,,SING,HN41,N41,no,N,36,,43566,16201,SXO
37,,SING,C42,N41,no,N,37,,43566,16201,SXO
38,,SING,C43,C42,no,N,38,,43566,16201,SXO
39,,SING,H42,C42,no,N,39,,43566,16201,SXO
40,,SING,C42,H42A,no,N,40,,43566,16201,SXO
41,,SING,S1,C43,no,N,41,,43566,16201,SXO
42,,SING,H43A,C43,no,N,42,,43566,16201,SXO
43,,SING,C43,H43,no,N,43,,43566,16201,SXO
44,,SING,C1,S1,no,N,44,,43566,16201,SXO
45,,SING,C2,C1,no,N,45,,43566,16201,SXO
46,,DOUB,C1,O1,no,N,46,,43566,16201,SXO
47,,SING,C3,C2,no,N,47,,43566,16201,SXO
48,,SING,H2,C2,no,N,48,,43566,16201,SXO
49,,SING,C2,H2A,no,N,49,,43566,16201,SXO
50,,SING,H3A,C3,no,N,50,,43566,16201,SXO
51,,SING,H3,C3,no,N,51,,43566,16201,SXO
52,,SING,C3,C4,no,N,52,,43566,16201,SXO
53,,SING,C5,C4,no,N,53,,43566,16201,SXO
54,,SING,C4,H4,no,N,54,,43566,16201,SXO
55,,SING,C4,H4A,no,N,55,,43566,16201,SXO
56,,SING,H5A,C5,no,N,56,,43566,16201,SXO
57,,SING,H5,C5,no,N,57,,43566,16201,SXO
58,,SING,C5,C6,no,N,58,,43566,16201,SXO
59,,SING,H6,C6,no,N,59,,43566,16201,SXO
60,,SING,C6,C7,no,N,60,,43566,16201,SXO
61,,SING,C6,H6A,no,N,61,,43566,16201,SXO
62,,SING,C8,C7,no,N,62,,43566,16201,SXO
63,,SING,C7,H7,no,N,63,,43566,16201,SXO
64,,SING,C7,H7A,no,N,64,,43566,16201,SXO
65,,SING,H8A,C8,no,N,65,,43566,16201,SXO
66,,SING,H8,C8,no,N,66,,43566,16201,SXO
67,,SING,C8,H8B,no,N,67,,43566,16201,SXO
1,,DOUB,O25,P24,no,N,1,,43584,16202,SXV
2,,SING,O26,P24,no,N,2,,43584,16202,SXV
3,,SING,P24,O27,no,N,3,,43584,16202,SXV
4,,SING,P24,O23,no,N,4,,43584,16202,SXV
5,,SING,O26,HO26,no,N,5,,43584,16202,SXV
6,,SING,O23,HO23,no,N,6,,43584,16202,SXV
7,,SING,O27,C28,no,N,7,,43584,16202,SXV
8,,SING,H28,C28,no,N,8,,43584,16202,SXV
9,,SING,C29,C28,no,N,9,,43584,16202,SXV
10,,SING,C28,H28A,no,N,10,,43584,16202,SXV
11,,SING,C31,C29,no,N,11,,43584,16202,SXV
12,,SING,C29,C30,no,N,12,,43584,16202,SXV
13,,SING,C29,C32,no,N,13,,43584,16202,SXV
14,,SING,H30B,C30,no,N,14,,43584,16202,SXV
15,,SING,H30A,C30,no,N,15,,43584,16202,SXV
16,,SING,C30,H30,no,N,16,,43584,16202,SXV
17,,SING,H31B,C31,no,N,17,,43584,16202,SXV
18,,SING,H31A,C31,no,N,18,,43584,16202,SXV
19,,SING,H31,C31,no,N,19,,43584,16202,SXV
20,,SING,O33,C32,no,N,20,,43584,16202,SXV
21,,SING,C34,C32,no,N,21,,43584,16202,SXV
22,,SING,C32,H32,no,N,22,,43584,16202,SXV
23,,SING,O33,HO33,no,N,23,,43584,16202,SXV
24,,SING,N36,C34,no,N,24,,43584,16202,SXV
25,,DOUB,C34,O35,no,N,25,,43584,16202,SXV
26,,SING,C37,N36,no,N,26,,43584,16202,SXV
27,,SING,HN36,N36,no,N,27,,43584,16202,SXV
28,,SING,C38,C37,no,N,28,,43584,16202,SXV
29,,SING,H37A,C37,no,N,29,,43584,16202,SXV
30,,SING,C37,H37,no,N,30,,43584,16202,SXV
31,,SING,H38A,C38,no,N,31,,43584,16202,SXV
32,,SING,H38,C38,no,N,32,,43584,16202,SXV
33,,SING,C38,C39,no,N,33,,43584,16202,SXV
34,,SING,N41,C39,no,N,34,,43584,16202,SXV
35,,DOUB,C39,O40,no,N,35,,43584,16202,SXV
36,,SING,HN41,N41,no,N,36,,43584,16202,SXV
37,,SING,N41,C42,no,N,37,,43584,16202,SXV
38,,SING,C43,C42,no,N,38,,43584,16202,SXV
39,,SING,H42A,C42,no,N,39,,43584,16202,SXV
40,,SING,C42,H42,no,N,40,,43584,16202,SXV
41,,SING,H43A,C43,no,N,41,,43584,16202,SXV
42,,SING,S1,C43,no,N,42,,43584,16202,SXV
43,,SING,C43,H43,no,N,43,,43584,16202,SXV
44,,SING,C1,S1,no,N,44,,43584,16202,SXV
45,,SING,H1A,C1,no,N,45,,43584,16202,SXV
46,,SING,C2,C1,no,N,46,,43584,16202,SXV
47,,SING,C1,H1,no,N,47,,43584,16202,SXV
48,,SING,C3,C2,no,N,48,,43584,16202,SXV
49,,SING,H2,C2,no,N,49,,43584,16202,SXV
50,,SING,C2,H2A,no,N,50,,43584,16202,SXV
51,,DOUB,O3,C3,no,N,51,,43584,16202,SXV
52,,SING,C3,C4,no,N,52,,43584,16202,SXV
53,,SING,H4A,C4,no,N,53,,43584,16202,SXV
54,,SING,H4B,C4,no,N,54,,43584,16202,SXV
55,,SING,C4,H4,no,N,55,,43584,16202,SXV
1,,SING,P24,O25,no,N,1,,43602,16203,SXD
2,,SING,O25,HO25,no,N,2,,43602,16203,SXD
3,,DOUB,O23,P24,no,N,3,,43602,16203,SXD
4,,SING,O27,P24,no,N,4,,43602,16203,SXD
5,,SING,P24,O26,no,N,5,,43602,16203,SXD
6,,SING,O26,HO26,no,N,6,,43602,16203,SXD
7,,SING,O27,C28,no,N,7,,43602,16203,SXD
8,,SING,C29,C28,no,N,8,,43602,16203,SXD
9,,SING,C28,H28A,no,N,9,,43602,16203,SXD
10,,SING,C28,H28,no,N,10,,43602,16203,SXD
11,,SING,C31,C29,no,N,11,,43602,16203,SXD
12,,SING,C32,C29,no,N,12,,43602,16203,SXD
13,,SING,C29,C30,no,N,13,,43602,16203,SXD
14,,SING,H30,C30,no,N,14,,43602,16203,SXD
15,,SING,C30,H30B,no,N,15,,43602,16203,SXD
16,,SING,C30,H30A,no,N,16,,43602,16203,SXD
17,,SING,H31,C31,no,N,17,,43602,16203,SXD
18,,SING,H31B,C31,no,N,18,,43602,16203,SXD
19,,SING,C31,H31A,no,N,19,,43602,16203,SXD
20,,SING,H32,C32,no,N,20,,43602,16203,SXD
21,,SING,O33,C32,no,N,21,,43602,16203,SXD
22,,SING,C32,C34,no,N,22,,43602,16203,SXD
23,,SING,O33,HO33,no,N,23,,43602,16203,SXD
24,,DOUB,C34,O35,no,N,24,,43602,16203,SXD
25,,SING,C34,N36,no,N,25,,43602,16203,SXD
26,,SING,HN36,N36,no,N,26,,43602,16203,SXD
27,,SING,N36,C37,no,N,27,,43602,16203,SXD
28,,SING,H37A,C37,no,N,28,,43602,16203,SXD
29,,SING,C37,C38,no,N,29,,43602,16203,SXD
30,,SING,C37,H37,no,N,30,,43602,16203,SXD
31,,SING,C39,C38,no,N,31,,43602,16203,SXD
32,,SING,C38,H38,no,N,32,,43602,16203,SXD
33,,SING,C38,H38A,no,N,33,,43602,16203,SXD
34,,SING,N41,C39,no,N,34,,43602,16203,SXD
35,,DOUB,O40,C39,no,N,35,,43602,16203,SXD
36,,SING,C42,N41,no,N,36,,43602,16203,SXD
37,,SING,N41,HN41,no,N,37,,43602,16203,SXD
38,,SING,C43,C42,no,N,38,,43602,16203,SXD
39,,SING,H42A,C42,no,N,39,,43602,16203,SXD
40,,SING,H42,C42,no,N,40,,43602,16203,SXD
41,,SING,S1,C43,no,N,41,,43602,16203,SXD
42,,SING,C43,H43A,no,N,42,,43602,16203,SXD
43,,SING,C43,H43,no,N,43,,43602,16203,SXD
44,,SING,C1,S1,no,N,44,,43602,16203,SXD
45,,SING,H1,C1,no,N,45,,43602,16203,SXD
46,,SING,C1,C2,no,N,46,,43602,16203,SXD
47,,SING,C1,H1A,no,N,47,,43602,16203,SXD
48,,SING,C3,C2,no,N,48,,43602,16203,SXD
49,,SING,H2,C2,no,N,49,,43602,16203,SXD
50,,SING,C2,H2A,no,N,50,,43602,16203,SXD
51,,SING,C4,C3,no,N,51,,43602,16203,SXD
52,,DOUB,C3,O3,no,N,52,,43602,16203,SXD
53,,SING,H4A,C4,no,N,53,,43602,16203,SXD
54,,SING,H4,C4,no,N,54,,43602,16203,SXD
55,,SING,C4,C5,no,N,55,,43602,16203,SXD
56,,DOUB,C5,O5,no,N,56,,43602,16203,SXD
57,,SING,C5,C6,no,N,57,,43602,16203,SXD
58,,SING,H6B,C6,no,N,58,,43602,16203,SXD
59,,SING,H6,C6,no,N,59,,43602,16203,SXD
60,,SING,C6,H6A,no,N,60,,43602,16203,SXD
1,,SING,N,CA,no,N,1,,43619,16204,HIS
2,,SING,N,H,no,N,2,,43619,16204,HIS
3,,SING,N,H2,no,N,3,,43619,16204,HIS
4,,SING,CA,C,no,N,4,,43619,16204,HIS
5,,SING,CA,CB,no,N,5,,43619,16204,HIS
6,,SING,CA,HA,no,N,6,,43619,16204,HIS
7,,DOUB,C,O,no,N,7,,43619,16204,HIS
8,,SING,C,OXT,no,N,8,,43619,16204,HIS
9,,SING,CB,CG,no,N,9,,43619,16204,HIS
10,,SING,CB,HB2,no,N,10,,43619,16204,HIS
11,,SING,CB,HB3,no,N,11,,43619,16204,HIS
12,,SING,CG,ND1,yes,N,12,,43619,16204,HIS
13,,DOUB,CG,CD2,yes,N,13,,43619,16204,HIS
14,,DOUB,ND1,CE1,yes,N,14,,43619,16204,HIS
15,,SING,ND1,HD1,no,N,15,,43619,16204,HIS
16,,SING,CD2,NE2,yes,N,16,,43619,16204,HIS
17,,SING,CD2,HD2,no,N,17,,43619,16204,HIS
18,,SING,CE1,NE2,yes,N,18,,43619,16204,HIS
19,,SING,CE1,HE1,no,N,19,,43619,16204,HIS
20,,SING,NE2,HE2,no,N,20,,43619,16204,HIS
21,,SING,OXT,HXT,no,N,21,,43619,16204,HIS
1,,SING,N,CA,no,N,1,,43715,16210,M3L
2,,SING,N,H,no,N,2,,43715,16210,M3L
3,,SING,N,H2,no,N,3,,43715,16210,M3L
4,,SING,CA,CB,no,N,4,,43715,16210,M3L
5,,SING,CA,C,no,N,5,,43715,16210,M3L
6,,SING,CA,HA,no,N,6,,43715,16210,M3L
7,,SING,CB,CG,no,N,7,,43715,16210,M3L
8,,SING,CB,HB2,no,N,8,,43715,16210,M3L
9,,SING,CB,HB3,no,N,9,,43715,16210,M3L
10,,SING,CG,CD,no,N,10,,43715,16210,M3L
11,,SING,CG,HG2,no,N,11,,43715,16210,M3L
12,,SING,CG,HG3,no,N,12,,43715,16210,M3L
13,,SING,CD,CE,no,N,13,,43715,16210,M3L
14,,SING,CD,HD2,no,N,14,,43715,16210,M3L
15,,SING,CD,HD3,no,N,15,,43715,16210,M3L
16,,SING,CE,NZ,no,N,16,,43715,16210,M3L
17,,SING,CE,HE2,no,N,17,,43715,16210,M3L
18,,SING,CE,HE3,no,N,18,,43715,16210,M3L
19,,SING,NZ,CM1,no,N,19,,43715,16210,M3L
20,,SING,NZ,CM2,no,N,20,,43715,16210,M3L
21,,SING,NZ,CM3,no,N,21,,43715,16210,M3L
22,,DOUB,C,O,no,N,22,,43715,16210,M3L
23,,SING,C,OXT,no,N,23,,43715,16210,M3L
24,,SING,OXT,HXT,no,N,24,,43715,16210,M3L
25,,SING,CM1,HM11,no,N,25,,43715,16210,M3L
26,,SING,CM1,HM12,no,N,26,,43715,16210,M3L
27,,SING,CM1,HM13,no,N,27,,43715,16210,M3L
28,,SING,CM2,HM21,no,N,28,,43715,16210,M3L
29,,SING,CM2,HM22,no,N,29,,43715,16210,M3L
30,,SING,CM2,HM23,no,N,30,,43715,16210,M3L
31,,SING,CM3,HM31,no,N,31,,43715,16210,M3L
32,,SING,CM3,HM32,no,N,32,,43715,16210,M3L
33,,SING,CM3,HM33,no,N,33,,43715,16210,M3L
1,,SING,C3A,C3,no,N,1,,43924,16222,FAG
2,,SING,C3A,C4A,no,N,2,,43924,16222,FAG
3,,DOUB,C3A,CBA,no,N,3,,43924,16222,FAG
4,,SING,C3,C2A,no,N,4,,43924,16222,FAG
5,,SING,C3,H31,no,N,5,,43924,16222,FAG
6,,SING,C3,H32,no,N,6,,43924,16222,FAG
7,,SING,C2A,C1,no,N,7,,43924,16222,FAG
8,,SING,C2A,H2A1,no,N,8,,43924,16222,FAG
9,,SING,C2A,H2A2,no,N,9,,43924,16222,FAG
10,,DOUB,C1,O1,no,N,10,,43924,16222,FAG
11,,SING,C1,CBA,no,N,11,,43924,16222,FAG
12,,DOUB,P,O1P,no,N,12,,43924,16222,FAG
13,,SING,P,O2P,no,N,13,,43924,16222,FAG
14,,SING,P,O5',no,N,14,,43924,16222,FAG
15,,SING,O2P,HOP2,no,N,15,,43924,16222,FAG
16,,SING,O5',C5',no,N,16,,43924,16222,FAG
17,,SING,C5',C4',no,N,17,,43924,16222,FAG
18,,SING,C5',H5'1,no,N,18,,43924,16222,FAG
19,,SING,C5',H5'2,no,N,19,,43924,16222,FAG
20,,SING,C4',O4',no,N,20,,43924,16222,FAG
21,,SING,C4',C3',no,N,21,,43924,16222,FAG
22,,SING,C4',H4',no,N,22,,43924,16222,FAG
23,,SING,O4',C1',no,N,23,,43924,16222,FAG
24,,SING,C1',N9,no,N,24,,43924,16222,FAG
25,,SING,C1',C2',no,N,25,,43924,16222,FAG
26,,SING,C1',H1',no,N,26,,43924,16222,FAG
27,,SING,N9,C4,no,N,27,,43924,16222,FAG
28,,SING,N9,HN9,no,N,28,,43924,16222,FAG
29,,SING,C4,N3,no,N,29,,43924,16222,FAG
30,,DOUB,C4,C5,no,N,30,,43924,16222,FAG
31,,DOUB,N3,C2,no,N,31,,43924,16222,FAG
32,,SING,C2,N2,no,N,32,,43924,16222,FAG
33,,SING,C2,N1,no,N,33,,43924,16222,FAG
34,,SING,N2,HN21,no,N,34,,43924,16222,FAG
35,,SING,N2,HN22,no,N,35,,43924,16222,FAG
36,,SING,N1,C6,no,N,36,,43924,16222,FAG
37,,SING,N1,H1,no,N,37,,43924,16222,FAG
38,,DOUB,C6,O6,no,N,38,,43924,16222,FAG
39,,SING,C6,C5,no,N,39,,43924,16222,FAG
40,,SING,C5,N7,no,N,40,,43924,16222,FAG
41,,SING,N7,C8,no,N,41,,43924,16222,FAG
42,,SING,N7,C8A,no,N,42,,43924,16222,FAG
43,,DOUB,C8,O8,no,N,43,,43924,16222,FAG
44,,SING,C8,H8,no,N,44,,43924,16222,FAG
45,,SING,C2',C3',no,N,45,,43924,16222,FAG
46,,SING,C2',H2'1,no,N,46,,43924,16222,FAG
47,,SING,C2',H2'2,no,N,47,,43924,16222,FAG
48,,SING,C3',O3',no,N,48,,43924,16222,FAG
49,,SING,C3',H3',no,N,49,,43924,16222,FAG
50,,SING,O3',HO3',no,N,50,,43924,16222,FAG
51,,SING,C8A,C9,no,N,51,,43924,16222,FAG
52,,SING,C8A,O7,no,N,52,,43924,16222,FAG
53,,SING,C8A,H8A,no,N,53,,43924,16222,FAG
54,,SING,C9,O9,no,N,54,,43924,16222,FAG
55,,SING,C9,C9A,no,N,55,,43924,16222,FAG
56,,SING,C9,H9,no,N,56,,43924,16222,FAG
57,,SING,O9,HO9,no,N,57,,43924,16222,FAG
58,,SING,C9A,C9B,no,N,58,,43924,16222,FAG
59,,SING,C9A,C6A,no,N,59,,43924,16222,FAG
60,,SING,C9A,H9A,no,N,60,,43924,16222,FAG
61,,DOUB,C9B,C5M,no,N,61,,43924,16222,FAG
62,,SING,C9B,CAA,yes,N,62,,43924,16222,FAG
63,,SING,O7,C6A,yes,N,63,,43924,16222,FAG
64,,SING,C6A,O6A,no,N,64,,43924,16222,FAG
65,,SING,C6A,H6A,no,N,65,,43924,16222,FAG
66,,SING,O6A,C5M,no,N,66,,43924,16222,FAG
67,,SING,C5M,C5B,no,N,67,,43924,16222,FAG
68,,DOUB,C5B,C4B,yes,N,68,,43924,16222,FAG
69,,SING,C5B,H5B,yes,N,69,,43924,16222,FAG
70,,SING,C4B,O4,no,N,70,,43924,16222,FAG
71,,SING,C4B,C4A,no,N,71,,43924,16222,FAG
72,,SING,O4,CM,yes,N,72,,43924,16222,FAG
73,,SING,CM,HM1,no,N,73,,43924,16222,FAG
74,,SING,CM,HM2,no,N,74,,43924,16222,FAG
75,,SING,CM,HM3,no,N,75,,43924,16222,FAG
76,,DOUB,C4A,CAA,no,N,76,,43924,16222,FAG
77,,SING,CAA,O10,yes,N,77,,43924,16222,FAG
78,,SING,O10,C11,no,N,78,,43924,16222,FAG
79,,DOUB,C11,O11,no,N,79,,43924,16222,FAG
80,,SING,C11,CBA,no,N,80,,43924,16222,FAG
81,,SING,P,O3P,no,N,81,,43924,16222,FAG
82,,SING,O3P,HOP3,no,N,82,,43924,16222,FAG
1,,SING,C3A,C3,no,N,1,,43946,16223,FAG
2,,SING,C3A,C4A,no,N,2,,43946,16223,FAG
3,,DOUB,C3A,CBA,no,N,3,,43946,16223,FAG
4,,SING,C3,C2A,no,N,4,,43946,16223,FAG
5,,SING,C3,H31,no,N,5,,43946,16223,FAG
6,,SING,C3,H32,no,N,6,,43946,16223,FAG
7,,SING,C2A,C1,no,N,7,,43946,16223,FAG
8,,SING,C2A,H2A1,no,N,8,,43946,16223,FAG
9,,SING,C2A,H2A2,no,N,9,,43946,16223,FAG
10,,DOUB,C1,O1,no,N,10,,43946,16223,FAG
11,,SING,C1,CBA,no,N,11,,43946,16223,FAG
12,,DOUB,P,O1P,no,N,12,,43946,16223,FAG
13,,SING,P,O2P,no,N,13,,43946,16223,FAG
14,,SING,P,O5',no,N,14,,43946,16223,FAG
15,,SING,O2P,HOP2,no,N,15,,43946,16223,FAG
16,,SING,O5',C5',no,N,16,,43946,16223,FAG
17,,SING,C5',C4',no,N,17,,43946,16223,FAG
18,,SING,C5',H5'1,no,N,18,,43946,16223,FAG
19,,SING,C5',H5'2,no,N,19,,43946,16223,FAG
20,,SING,C4',O4',no,N,20,,43946,16223,FAG
21,,SING,C4',C3',no,N,21,,43946,16223,FAG
22,,SING,C4',H4',no,N,22,,43946,16223,FAG
23,,SING,O4',C1',no,N,23,,43946,16223,FAG
24,,SING,C1',N9,no,N,24,,43946,16223,FAG
25,,SING,C1',C2',no,N,25,,43946,16223,FAG
26,,SING,C1',H1',no,N,26,,43946,16223,FAG
27,,SING,N9,C4,no,N,27,,43946,16223,FAG
28,,SING,N9,HN9,no,N,28,,43946,16223,FAG
29,,SING,C4,N3,no,N,29,,43946,16223,FAG
30,,DOUB,C4,C5,no,N,30,,43946,16223,FAG
31,,DOUB,N3,C2,no,N,31,,43946,16223,FAG
32,,SING,C2,N2,no,N,32,,43946,16223,FAG
33,,SING,C2,N1,no,N,33,,43946,16223,FAG
34,,SING,N2,HN21,no,N,34,,43946,16223,FAG
35,,SING,N2,HN22,no,N,35,,43946,16223,FAG
36,,SING,N1,C6,no,N,36,,43946,16223,FAG
37,,SING,N1,H1,no,N,37,,43946,16223,FAG
38,,DOUB,C6,O6,no,N,38,,43946,16223,FAG
39,,SING,C6,C5,no,N,39,,43946,16223,FAG
40,,SING,C5,N7,no,N,40,,43946,16223,FAG
41,,SING,N7,C8,no,N,41,,43946,16223,FAG
42,,SING,N7,C8A,no,N,42,,43946,16223,FAG
43,,DOUB,C8,O8,no,N,43,,43946,16223,FAG
44,,SING,C8,H8,no,N,44,,43946,16223,FAG
45,,SING,C2',C3',no,N,45,,43946,16223,FAG
46,,SING,C2',H2'1,no,N,46,,43946,16223,FAG
47,,SING,C2',H2'2,no,N,47,,43946,16223,FAG
48,,SING,C3',O3',no,N,48,,43946,16223,FAG
49,,SING,C3',H3',no,N,49,,43946,16223,FAG
50,,SING,O3',HO3',no,N,50,,43946,16223,FAG
51,,SING,C8A,C9,no,N,51,,43946,16223,FAG
52,,SING,C8A,O7,no,N,52,,43946,16223,FAG
53,,SING,C8A,H8A,no,N,53,,43946,16223,FAG
54,,SING,C9,O9,no,N,54,,43946,16223,FAG
55,,SING,C9,C9A,no,N,55,,43946,16223,FAG
56,,SING,C9,H9,no,N,56,,43946,16223,FAG
57,,SING,O9,HO9,no,N,57,,43946,16223,FAG
58,,SING,C9A,C9B,no,N,58,,43946,16223,FAG
59,,SING,C9A,C6A,no,N,59,,43946,16223,FAG
60,,SING,C9A,H9A,no,N,60,,43946,16223,FAG
61,,DOUB,C9B,C5M,no,N,61,,43946,16223,FAG
62,,SING,C9B,CAA,yes,N,62,,43946,16223,FAG
63,,SING,O7,C6A,yes,N,63,,43946,16223,FAG
64,,SING,C6A,O6A,no,N,64,,43946,16223,FAG
65,,SING,C6A,H6A,no,N,65,,43946,16223,FAG
66,,SING,O6A,C5M,no,N,66,,43946,16223,FAG
67,,SING,C5M,C5B,no,N,67,,43946,16223,FAG
68,,DOUB,C5B,C4B,yes,N,68,,43946,16223,FAG
69,,SING,C5B,H5B,yes,N,69,,43946,16223,FAG
70,,SING,C4B,O4,no,N,70,,43946,16223,FAG
71,,SING,C4B,C4A,no,N,71,,43946,16223,FAG
72,,SING,O4,CM,yes,N,72,,43946,16223,FAG
73,,SING,CM,HM1,no,N,73,,43946,16223,FAG
74,,SING,CM,HM2,no,N,74,,43946,16223,FAG
75,,SING,CM,HM3,no,N,75,,43946,16223,FAG
76,,DOUB,C4A,CAA,no,N,76,,43946,16223,FAG
77,,SING,CAA,O10,yes,N,77,,43946,16223,FAG
78,,SING,O10,C11,no,N,78,,43946,16223,FAG
79,,DOUB,C11,O11,no,N,79,,43946,16223,FAG
80,,SING,C11,CBA,no,N,80,,43946,16223,FAG
81,,SING,P,O3P,no,N,81,,43946,16223,FAG
82,,SING,O3P,HOP3,no,N,82,,43946,16223,FAG
1,,SING,P,O5',,,,,43968,16225,CTG
2,,DOUB,P,OP1,,,,,43968,16225,CTG
3,,SING,P,OP3,,,,,43968,16225,CTG
4,,SING,P,OP2,,,,,43968,16225,CTG
5,,SING,OP2,HOP2,,,,,43968,16225,CTG
6,,SING,O5',C5',,,,,43968,16225,CTG
7,,SING,C5',C4',,,,,43968,16225,CTG
8,,SING,C5',H5',,,,,43968,16225,CTG
9,,SING,C5',H5'',,,,,43968,16225,CTG
10,,SING,C4',C3',,,,,43968,16225,CTG
11,,SING,C4',O4',,,,,43968,16225,CTG
12,,SING,C4',H4',,,,,43968,16225,CTG
13,,SING,O4',C1',,,,,43968,16225,CTG
14,,SING,C1',N1,,,,,43968,16225,CTG
15,,SING,C1',C2',,,,,43968,16225,CTG
16,,SING,C1',H1',,,,,43968,16225,CTG
17,,SING,N1,C2,,,,,43968,16225,CTG
18,,SING,N1,C6,,,,,43968,16225,CTG
19,,SING,C6,C5,,,,,43968,16225,CTG
20,,SING,C6,O6,,,,,43968,16225,CTG
21,,SING,C6,H6,,,,,43968,16225,CTG
22,,SING,O6,HO6,,,,,43968,16225,CTG
23,,SING,C2,N3,,,,,43968,16225,CTG
24,,DOUB,C2,O2,,,,,43968,16225,CTG
25,,SING,N3,C4,,,,,43968,16225,CTG
26,,SING,N3,H3,,,,,43968,16225,CTG
27,,SING,C4,C5,,,,,43968,16225,CTG
28,,DOUB,C4,O4,,,,,43968,16225,CTG
29,,SING,C5,C5M,,,,,43968,16225,CTG
30,,SING,C5,O5,,,,,43968,16225,CTG
31,,SING,C5M,H71,,,,,43968,16225,CTG
32,,SING,C5M,H72,,,,,43968,16225,CTG
33,,SING,C5M,H73,,,,,43968,16225,CTG
34,,SING,O5,HO5,,,,,43968,16225,CTG
35,,SING,C2',C3',,,,,43968,16225,CTG
36,,SING,C2',H2',,,,,43968,16225,CTG
37,,SING,C2',H2'',,,,,43968,16225,CTG
38,,SING,C3',O3',,,,,43968,16225,CTG
39,,SING,C3',H3',,,,,43968,16225,CTG
40,,SING,O3',HO3',,,,,43968,16225,CTG
41,,SING,OP3,HOP3,,,,,43968,16225,CTG
1,,SING,P,O5',no,N,1,,43993,16226,CTG
2,,DOUB,P,OP1,no,N,2,,43993,16226,CTG
3,,SING,P,OP3,no,N,3,,43993,16226,CTG
4,,SING,P,OP2,no,N,4,,43993,16226,CTG
5,,SING,OP2,HOP2,no,N,5,,43993,16226,CTG
6,,SING,O5',C5',no,N,6,,43993,16226,CTG
7,,SING,C5',C4',no,N,7,,43993,16226,CTG
8,,SING,C5',H5',no,N,8,,43993,16226,CTG
9,,SING,C5',H5'',no,N,9,,43993,16226,CTG
10,,SING,C4',C3',no,N,10,,43993,16226,CTG
11,,SING,C4',O4',no,N,11,,43993,16226,CTG
12,,SING,C4',H4',no,N,12,,43993,16226,CTG
13,,SING,O4',C1',no,N,13,,43993,16226,CTG
14,,SING,C1',N1,no,N,14,,43993,16226,CTG
15,,SING,C1',C2',no,N,15,,43993,16226,CTG
16,,SING,C1',H1',no,N,16,,43993,16226,CTG
17,,SING,N1,C2,no,N,17,,43993,16226,CTG
18,,SING,N1,C6,no,N,18,,43993,16226,CTG
19,,SING,C6,C5,no,N,19,,43993,16226,CTG
20,,SING,C6,O6,no,N,20,,43993,16226,CTG
21,,SING,C6,H6,no,N,21,,43993,16226,CTG
22,,SING,O6,HO6,no,N,22,,43993,16226,CTG
23,,SING,C2,N3,no,N,23,,43993,16226,CTG
24,,DOUB,C2,O2,no,N,24,,43993,16226,CTG
25,,SING,N3,C4,no,N,25,,43993,16226,CTG
26,,SING,N3,H3,no,N,26,,43993,16226,CTG
27,,SING,C4,C5,no,N,27,,43993,16226,CTG
28,,DOUB,C4,O4,no,N,28,,43993,16226,CTG
29,,SING,C5,C5M,no,N,29,,43993,16226,CTG
30,,SING,C5,O5,no,N,30,,43993,16226,CTG
31,,SING,C5M,H71,no,N,31,,43993,16226,CTG
32,,SING,C5M,H72,no,N,32,,43993,16226,CTG
33,,SING,C5M,H73,no,N,33,,43993,16226,CTG
34,,SING,O5,HO5,no,N,34,,43993,16226,CTG
35,,SING,C2',C3',no,N,35,,43993,16226,CTG
36,,SING,C2',H2',no,N,36,,43993,16226,CTG
37,,SING,C2',H2'',no,N,37,,43993,16226,CTG
38,,SING,C3',O3',no,N,38,,43993,16226,CTG
39,,SING,C3',H3',no,N,39,,43993,16226,CTG
40,,SING,O3',HO3',no,N,40,,43993,16226,CTG
41,,SING,OP3,HOP3,no,N,41,,43993,16226,CTG
1,,SING,N,CA,no,N,1,,44368,16248,TPO
2,,SING,N,H,no,N,2,,44368,16248,TPO
3,,SING,N,H2,no,N,3,,44368,16248,TPO
4,,SING,CA,CB,no,N,4,,44368,16248,TPO
5,,SING,CA,C,no,N,5,,44368,16248,TPO
6,,SING,CA,HA,no,N,6,,44368,16248,TPO
7,,SING,CB,CG2,no,N,7,,44368,16248,TPO
8,,SING,CB,OG1,no,N,8,,44368,16248,TPO
9,,SING,CB,HB,no,N,9,,44368,16248,TPO
10,,SING,CG2,HG21,no,N,10,,44368,16248,TPO
11,,SING,CG2,HG22,no,N,11,,44368,16248,TPO
12,,SING,CG2,HG23,no,N,12,,44368,16248,TPO
13,,SING,OG1,P,no,N,13,,44368,16248,TPO
14,,DOUB,P,O1P,no,N,14,,44368,16248,TPO
15,,SING,P,O2P,no,N,15,,44368,16248,TPO
16,,SING,P,O3P,no,N,16,,44368,16248,TPO
17,,SING,O2P,HOP2,no,N,17,,44368,16248,TPO
18,,SING,O3P,HOP3,no,N,18,,44368,16248,TPO
19,,DOUB,C,O,no,N,19,,44368,16248,TPO
20,,SING,C,OXT,no,N,20,,44368,16248,TPO
21,,SING,OXT,HXT,no,N,21,,44368,16248,TPO
1,,DOUB,C1,O1,no,N,1,,44819,16270,PHQ
2,,SING,C1,O2,no,N,2,,44819,16270,PHQ
3,,SING,C1,H11,no,N,3,,44819,16270,PHQ
4,,SING,O2,C2,no,N,4,,44819,16270,PHQ
5,,SING,C2,C3,no,N,5,,44819,16270,PHQ
6,,SING,C2,H21,no,N,6,,44819,16270,PHQ
7,,SING,C2,H22,no,N,7,,44819,16270,PHQ
8,,DOUB,C3,C4,yes,N,8,,44819,16270,PHQ
9,,SING,C3,C8,yes,N,9,,44819,16270,PHQ
10,,SING,C4,C5,yes,N,10,,44819,16270,PHQ
11,,SING,C4,H41,no,N,11,,44819,16270,PHQ
12,,DOUB,C5,C6,yes,N,12,,44819,16270,PHQ
13,,SING,C5,H51,no,N,13,,44819,16270,PHQ
14,,SING,C6,C7,yes,N,14,,44819,16270,PHQ
15,,SING,C6,H61,no,N,15,,44819,16270,PHQ
16,,DOUB,C7,C8,yes,N,16,,44819,16270,PHQ
17,,SING,C7,H71,no,N,17,,44819,16270,PHQ
18,,SING,C8,H81,no,N,18,,44819,16270,PHQ
1,,SING,HN,N,no,N,1,,44820,16270,B27
2,,SING,N,CA,no,N,2,,44820,16270,B27
3,,SING,N,HNA,no,N,3,,44820,16270,B27
4,,SING,CX,CA,no,N,4,,44820,16270,B27
5,,SING,CA,CB,no,N,5,,44820,16270,B27
6,,SING,CA,HA,no,N,6,,44820,16270,B27
7,,SING,CG2,CB,no,N,7,,44820,16270,B27
8,,SING,CB,OG1,no,N,8,,44820,16270,B27
9,,SING,CB,HB,no,N,9,,44820,16270,B27
10,,SING,HG2A,CG2,no,N,10,,44820,16270,B27
11,,SING,CG2,HG2B,no,N,11,,44820,16270,B27
12,,SING,CG2,HG2,no,N,12,,44820,16270,B27
13,,SING,HOG1,OG1,no,N,13,,44820,16270,B27
14,,SING,SG,CX,no,N,14,,44820,16270,B27
15,,SING,SG,HSG,no,N,15,,44820,16270,B27
16,,SING,HX,CX,no,N,16,,44820,16270,B27
17,,SING,CX,HXA,no,N,17,,44820,16270,B27
1,,SING,FE,NA,,,1,,44947,16276,HEM
2,,SING,FE,NB,,,2,,44947,16276,HEM
3,,SING,FE,NC,,,3,,44947,16276,HEM
4,,SING,FE,ND,,,4,,44947,16276,HEM
5,,DOUB,CHA,C1A,,,5,,44947,16276,HEM
6,,SING,CHA,C4D,,,6,,44947,16276,HEM
7,,SING,CHA,HHA,,,7,,44947,16276,HEM
8,,DOUB,CHB,C4A,,,8,,44947,16276,HEM
9,,SING,CHB,C1B,,,9,,44947,16276,HEM
10,,SING,CHB,HHB,,,10,,44947,16276,HEM
11,,DOUB,CHC,C4B,,,11,,44947,16276,HEM
12,,SING,CHC,C1C,,,12,,44947,16276,HEM
13,,SING,CHC,HHC,,,13,,44947,16276,HEM
14,,SING,CHD,C4C,,,14,,44947,16276,HEM
15,,DOUB,CHD,C1D,,,15,,44947,16276,HEM
16,,SING,CHD,HHD,,,16,,44947,16276,HEM
17,,SING,NA,C1A,,,17,,44947,16276,HEM
18,,SING,NA,C4A,,,18,,44947,16276,HEM
19,,SING,C1A,C2A,,,19,,44947,16276,HEM
20,,DOUB,C2A,C3A,,,20,,44947,16276,HEM
21,,SING,C2A,CAA,,,21,,44947,16276,HEM
22,,SING,C3A,C4A,,,22,,44947,16276,HEM
23,,SING,C3A,CMA,,,23,,44947,16276,HEM
24,,SING,CMA,HMA1,,,24,,44947,16276,HEM
25,,SING,CMA,HMA2,,,25,,44947,16276,HEM
26,,SING,CMA,HMA3,,,26,,44947,16276,HEM
27,,SING,CAA,CBA,,,27,,44947,16276,HEM
28,,SING,CAA,HAA1,,,28,,44947,16276,HEM
29,,SING,CAA,HAA2,,,29,,44947,16276,HEM
30,,SING,CBA,CGA,,,30,,44947,16276,HEM
31,,SING,CBA,HBA1,,,31,,44947,16276,HEM
32,,SING,CBA,HBA2,,,32,,44947,16276,HEM
33,,DOUB,CGA,O1A,,,33,,44947,16276,HEM
34,,SING,CGA,O2A,,,34,,44947,16276,HEM
35,,SING,O2A,H2A,,,35,,44947,16276,HEM
36,,DOUB,NB,C1B,,,36,,44947,16276,HEM
37,,SING,NB,C4B,,,37,,44947,16276,HEM
38,,SING,C1B,C2B,,,38,,44947,16276,HEM
39,,DOUB,C2B,C3B,,,39,,44947,16276,HEM
40,,SING,C2B,CMB,,,40,,44947,16276,HEM
41,,SING,C3B,C4B,,,41,,44947,16276,HEM
42,,SING,C3B,CAB,,,42,,44947,16276,HEM
43,,SING,CMB,HMB1,,,43,,44947,16276,HEM
44,,SING,CMB,HMB2,,,44,,44947,16276,HEM
45,,SING,CMB,HMB3,,,45,,44947,16276,HEM
46,,DOUB,CAB,CBB,,,46,,44947,16276,HEM
47,,SING,CAB,HAB,,,47,,44947,16276,HEM
48,,SING,CBB,HBB1,,,48,,44947,16276,HEM
49,,SING,CBB,HBB2,,,49,,44947,16276,HEM
50,,SING,NC,C1C,,,50,,44947,16276,HEM
51,,SING,NC,C4C,,,51,,44947,16276,HEM
52,,DOUB,C1C,C2C,,,52,,44947,16276,HEM
53,,SING,C2C,C3C,,,53,,44947,16276,HEM
54,,SING,C2C,CMC,,,54,,44947,16276,HEM
55,,DOUB,C3C,C4C,,,55,,44947,16276,HEM
56,,SING,C3C,CAC,,,56,,44947,16276,HEM
57,,SING,CMC,HMC1,,,57,,44947,16276,HEM
58,,SING,CMC,HMC2,,,58,,44947,16276,HEM
59,,SING,CMC,HMC3,,,59,,44947,16276,HEM
60,,DOUB,CAC,CBC,,,60,,44947,16276,HEM
61,,SING,CAC,HAC,,,61,,44947,16276,HEM
62,,SING,CBC,HBC1,,,62,,44947,16276,HEM
63,,SING,CBC,HBC2,,,63,,44947,16276,HEM
64,,SING,ND,C1D,,,64,,44947,16276,HEM
65,,DOUB,ND,C4D,,,65,,44947,16276,HEM
66,,SING,C1D,C2D,,,66,,44947,16276,HEM
67,,DOUB,C2D,C3D,,,67,,44947,16276,HEM
68,,SING,C2D,CMD,,,68,,44947,16276,HEM
69,,SING,C3D,C4D,,,69,,44947,16276,HEM
70,,SING,C3D,CAD,,,70,,44947,16276,HEM
71,,SING,CMD,HMD1,,,71,,44947,16276,HEM
72,,SING,CMD,HMD2,,,72,,44947,16276,HEM
73,,SING,CMD,HMD3,,,73,,44947,16276,HEM
74,,SING,CAD,CBD,,,74,,44947,16276,HEM
75,,SING,CAD,HAD1,,,75,,44947,16276,HEM
76,,SING,CAD,HAD2,,,76,,44947,16276,HEM
77,,SING,CBD,CGD,,,77,,44947,16276,HEM
78,,SING,CBD,HBD1,,,78,,44947,16276,HEM
79,,SING,CBD,HBD2,,,79,,44947,16276,HEM
80,,DOUB,CGD,O1D,,,80,,44947,16276,HEM
81,,SING,CGD,O2D,,,81,,44947,16276,HEM
82,,SING,O2D,H2D,,,82,,44947,16276,HEM
1,,TRIP,C,O,,,1,,44948,16276,CMO
1,,TRIP,C,O,,,1,,44993,16278,CMO
1,,SING,FE,NA,,,1,,44994,16278,HEM
2,,SING,FE,NB,,,2,,44994,16278,HEM
3,,SING,FE,NC,,,3,,44994,16278,HEM
4,,SING,FE,ND,,,4,,44994,16278,HEM
5,,DOUB,CHA,C1A,,,5,,44994,16278,HEM
6,,SING,CHA,C4D,,,6,,44994,16278,HEM
7,,SING,CHA,HHA,,,7,,44994,16278,HEM
8,,DOUB,CHB,C4A,,,8,,44994,16278,HEM
9,,SING,CHB,C1B,,,9,,44994,16278,HEM
10,,SING,CHB,HHB,,,10,,44994,16278,HEM
11,,DOUB,CHC,C4B,,,11,,44994,16278,HEM
12,,SING,CHC,C1C,,,12,,44994,16278,HEM
13,,SING,CHC,HHC,,,13,,44994,16278,HEM
14,,SING,CHD,C4C,,,14,,44994,16278,HEM
15,,DOUB,CHD,C1D,,,15,,44994,16278,HEM
16,,SING,CHD,HHD,,,16,,44994,16278,HEM
17,,SING,NA,C1A,,,17,,44994,16278,HEM
18,,SING,NA,C4A,,,18,,44994,16278,HEM
19,,SING,C1A,C2A,,,19,,44994,16278,HEM
20,,DOUB,C2A,C3A,,,20,,44994,16278,HEM
21,,SING,C2A,CAA,,,21,,44994,16278,HEM
22,,SING,C3A,C4A,,,22,,44994,16278,HEM
23,,SING,C3A,CMA,,,23,,44994,16278,HEM
24,,SING,CMA,HMA1,,,24,,44994,16278,HEM
25,,SING,CMA,HMA2,,,25,,44994,16278,HEM
26,,SING,CMA,HMA3,,,26,,44994,16278,HEM
27,,SING,CAA,CBA,,,27,,44994,16278,HEM
28,,SING,CAA,HAA1,,,28,,44994,16278,HEM
29,,SING,CAA,HAA2,,,29,,44994,16278,HEM
30,,SING,CBA,CGA,,,30,,44994,16278,HEM
31,,SING,CBA,HBA1,,,31,,44994,16278,HEM
32,,SING,CBA,HBA2,,,32,,44994,16278,HEM
33,,DOUB,CGA,O1A,,,33,,44994,16278,HEM
34,,SING,CGA,O2A,,,34,,44994,16278,HEM
35,,SING,O2A,H2A,,,35,,44994,16278,HEM
36,,DOUB,NB,C1B,,,36,,44994,16278,HEM
37,,SING,NB,C4B,,,37,,44994,16278,HEM
38,,SING,C1B,C2B,,,38,,44994,16278,HEM
39,,DOUB,C2B,C3B,,,39,,44994,16278,HEM
40,,SING,C2B,CMB,,,40,,44994,16278,HEM
41,,SING,C3B,C4B,,,41,,44994,16278,HEM
42,,SING,C3B,CAB,,,42,,44994,16278,HEM
43,,SING,CMB,HMB1,,,43,,44994,16278,HEM
44,,SING,CMB,HMB2,,,44,,44994,16278,HEM
45,,SING,CMB,HMB3,,,45,,44994,16278,HEM
46,,DOUB,CAB,CBB,,,46,,44994,16278,HEM
47,,SING,CAB,HAB,,,47,,44994,16278,HEM
48,,SING,CBB,HBB1,,,48,,44994,16278,HEM
49,,SING,CBB,HBB2,,,49,,44994,16278,HEM
50,,SING,NC,C1C,,,50,,44994,16278,HEM
51,,SING,NC,C4C,,,51,,44994,16278,HEM
52,,DOUB,C1C,C2C,,,52,,44994,16278,HEM
53,,SING,C2C,C3C,,,53,,44994,16278,HEM
54,,SING,C2C,CMC,,,54,,44994,16278,HEM
55,,DOUB,C3C,C4C,,,55,,44994,16278,HEM
56,,SING,C3C,CAC,,,56,,44994,16278,HEM
57,,SING,CMC,HMC1,,,57,,44994,16278,HEM
58,,SING,CMC,HMC2,,,58,,44994,16278,HEM
59,,SING,CMC,HMC3,,,59,,44994,16278,HEM
60,,DOUB,CAC,CBC,,,60,,44994,16278,HEM
61,,SING,CAC,HAC,,,61,,44994,16278,HEM
62,,SING,CBC,HBC1,,,62,,44994,16278,HEM
63,,SING,CBC,HBC2,,,63,,44994,16278,HEM
64,,SING,ND,C1D,,,64,,44994,16278,HEM
65,,DOUB,ND,C4D,,,65,,44994,16278,HEM
66,,SING,C1D,C2D,,,66,,44994,16278,HEM
67,,DOUB,C2D,C3D,,,67,,44994,16278,HEM
68,,SING,C2D,CMD,,,68,,44994,16278,HEM
69,,SING,C3D,C4D,,,69,,44994,16278,HEM
70,,SING,C3D,CAD,,,70,,44994,16278,HEM
71,,SING,CMD,HMD1,,,71,,44994,16278,HEM
72,,SING,CMD,HMD2,,,72,,44994,16278,HEM
73,,SING,CMD,HMD3,,,73,,44994,16278,HEM
74,,SING,CAD,CBD,,,74,,44994,16278,HEM
75,,SING,CAD,HAD1,,,75,,44994,16278,HEM
76,,SING,CAD,HAD2,,,76,,44994,16278,HEM
77,,SING,CBD,CGD,,,77,,44994,16278,HEM
78,,SING,CBD,HBD1,,,78,,44994,16278,HEM
79,,SING,CBD,HBD2,,,79,,44994,16278,HEM
80,,DOUB,CGD,O1D,,,80,,44994,16278,HEM
81,,SING,CGD,O2D,,,81,,44994,16278,HEM
82,,SING,O2D,H2D,,,82,,44994,16278,HEM
1,,SING,N1,C2,,,1,,44995,16278,IMD
2,,SING,N1,C5,,,2,,44995,16278,IMD
3,,SING,N1,HN1,,,3,,44995,16278,IMD
4,,DOUB,C2,N3,,,4,,44995,16278,IMD
5,,SING,C2,H2,,,5,,44995,16278,IMD
6,,SING,N3,C4,,,6,,44995,16278,IMD
7,,SING,N3,HN3,,,7,,44995,16278,IMD
8,,DOUB,C4,C5,,,8,,44995,16278,IMD
9,,SING,C4,H4,,,9,,44995,16278,IMD
10,,SING,C5,H5,,,10,,44995,16278,IMD
1,,SING,FE,NA,no,N,1,,45483,16306,HEB
2,,SING,FE,NB,no,N,2,,45483,16306,HEB
3,,SING,FE,NC,no,N,3,,45483,16306,HEB
4,,SING,FE,ND,no,N,4,,45483,16306,HEB
5,,DOUB,CHA,C1A,yes,N,5,,45483,16306,HEB
6,,SING,CHA,C4D,yes,N,6,,45483,16306,HEB
7,,SING,CHA,HHA,no,N,7,,45483,16306,HEB
8,,DOUB,CHB,C4A,yes,N,8,,45483,16306,HEB
9,,SING,CHB,C1B,yes,N,9,,45483,16306,HEB
10,,SING,CHB,HHB,no,N,10,,45483,16306,HEB
11,,DOUB,CHC,C4B,yes,N,11,,45483,16306,HEB
12,,SING,CHC,C1C,yes,N,12,,45483,16306,HEB
13,,SING,CHC,HHC,no,N,13,,45483,16306,HEB
14,,SING,CHD,C4C,yes,N,14,,45483,16306,HEB
15,,DOUB,CHD,C1D,yes,N,15,,45483,16306,HEB
16,,SING,CHD,HHD,no,N,16,,45483,16306,HEB
17,,SING,NA,C1A,yes,N,17,,45483,16306,HEB
18,,SING,NA,C4A,yes,N,18,,45483,16306,HEB
19,,SING,C1A,C2A,yes,N,19,,45483,16306,HEB
20,,DOUB,C2A,C3A,yes,N,20,,45483,16306,HEB
21,,SING,C2A,CAA,no,N,21,,45483,16306,HEB
22,,SING,C3A,C4A,yes,N,22,,45483,16306,HEB
23,,SING,C3A,CMA,no,N,23,,45483,16306,HEB
24,,SING,CMA,HMA1,no,N,24,,45483,16306,HEB
25,,SING,CMA,HMA2,no,N,25,,45483,16306,HEB
26,,SING,CMA,HMA3,no,N,26,,45483,16306,HEB
27,,SING,CAA,CBA,no,N,27,,45483,16306,HEB
28,,SING,CAA,HAA1,no,N,28,,45483,16306,HEB
29,,SING,CAA,HAA2,no,N,29,,45483,16306,HEB
30,,SING,CBA,CGA,no,N,30,,45483,16306,HEB
31,,SING,CBA,HBA1,no,N,31,,45483,16306,HEB
32,,SING,CBA,HBA2,no,N,32,,45483,16306,HEB
33,,DOUB,CGA,O1A,no,N,33,,45483,16306,HEB
34,,SING,CGA,O2A,no,N,34,,45483,16306,HEB
35,,SING,O2A,H2A,no,N,35,,45483,16306,HEB
36,,DOUB,NB,C1B,yes,N,36,,45483,16306,HEB
37,,SING,NB,C4B,yes,N,37,,45483,16306,HEB
38,,SING,C1B,C2B,no,N,38,,45483,16306,HEB
39,,DOUB,C2B,C3B,no,N,39,,45483,16306,HEB
40,,SING,C2B,CMB,no,N,40,,45483,16306,HEB
41,,SING,C3B,C4B,no,N,41,,45483,16306,HEB
42,,SING,C3B,CAB,no,N,42,,45483,16306,HEB
43,,SING,CMB,HMB1,no,N,43,,45483,16306,HEB
44,,SING,CMB,HMB2,no,N,44,,45483,16306,HEB
45,,SING,CMB,HMB3,no,N,45,,45483,16306,HEB
46,,SING,CAB,CBB,no,N,46,,45483,16306,HEB
47,,SING,CAB,HAB,no,N,47,,45483,16306,HEB
48,,SING,CAB,HAB2,no,N,48,,45483,16306,HEB
49,,SING,CBB,HBB1,no,N,49,,45483,16306,HEB
50,,SING,CBB,HBB2,no,N,50,,45483,16306,HEB
51,,SING,CBB,HBB3,no,N,51,,45483,16306,HEB
52,,SING,NC,C1C,yes,N,52,,45483,16306,HEB
53,,SING,NC,C4C,yes,N,53,,45483,16306,HEB
54,,DOUB,C1C,C2C,yes,N,54,,45483,16306,HEB
55,,SING,C2C,C3C,yes,N,55,,45483,16306,HEB
56,,SING,C2C,CMC,no,N,56,,45483,16306,HEB
57,,DOUB,C3C,C4C,yes,N,57,,45483,16306,HEB
58,,SING,C3C,CAC,no,N,58,,45483,16306,HEB
59,,SING,CMC,HMC1,no,N,59,,45483,16306,HEB
60,,SING,CMC,HMC2,no,N,60,,45483,16306,HEB
61,,SING,CMC,HMC3,no,N,61,,45483,16306,HEB
62,,DOUB,CAC,CBC,no,N,62,,45483,16306,HEB
63,,SING,CAC,HAC,no,N,63,,45483,16306,HEB
64,,SING,CBC,HBC1,no,N,64,,45483,16306,HEB
65,,SING,CBC,HBC2,no,N,65,,45483,16306,HEB
66,,SING,ND,C1D,yes,N,66,,45483,16306,HEB
67,,DOUB,ND,C4D,yes,N,67,,45483,16306,HEB
68,,SING,C1D,C2D,no,N,68,,45483,16306,HEB
69,,DOUB,C2D,C3D,no,N,69,,45483,16306,HEB
70,,SING,C2D,CMD,no,N,70,,45483,16306,HEB
71,,SING,C3D,C4D,no,N,71,,45483,16306,HEB
72,,SING,C3D,CAD,no,N,72,,45483,16306,HEB
73,,SING,CMD,HMD1,no,N,73,,45483,16306,HEB
74,,SING,CMD,HMD2,no,N,74,,45483,16306,HEB
75,,SING,CMD,HMD3,no,N,75,,45483,16306,HEB
76,,SING,CAD,CBD,no,N,76,,45483,16306,HEB
77,,SING,CAD,HAD1,no,N,77,,45483,16306,HEB
78,,SING,CAD,HAD2,no,N,78,,45483,16306,HEB
79,,SING,CBD,CGD,no,N,79,,45483,16306,HEB
80,,SING,CBD,HBD1,no,N,80,,45483,16306,HEB
81,,SING,CBD,HBD2,no,N,81,,45483,16306,HEB
82,,DOUB,CGD,O1D,no,N,82,,45483,16306,HEB
83,,SING,CGD,O2D,no,N,83,,45483,16306,HEB
84,,SING,O2D,H2D,no,N,84,,45483,16306,HEB
1,,SING,CHA,C1A,yes,N,1,,45514,16307,HEM
2,,DOUB,CHA,C4D,yes,N,2,,45514,16307,HEM
3,,SING,CHA,HHA,no,N,3,,45514,16307,HEM
4,,SING,CHB,C4A,yes,N,4,,45514,16307,HEM
5,,DOUB,CHB,C1B,yes,N,5,,45514,16307,HEM
6,,SING,CHB,HHB,no,N,6,,45514,16307,HEM
7,,SING,CHC,C4B,yes,N,7,,45514,16307,HEM
8,,DOUB,CHC,C1C,yes,N,8,,45514,16307,HEM
9,,SING,CHC,HHC,no,N,9,,45514,16307,HEM
10,,DOUB,CHD,C4C,yes,N,10,,45514,16307,HEM
11,,SING,CHD,C1D,yes,N,11,,45514,16307,HEM
12,,SING,CHD,HHD,no,N,12,,45514,16307,HEM
13,,DOUB,C1A,C2A,yes,N,13,,45514,16307,HEM
14,,SING,C1A,NA,yes,N,14,,45514,16307,HEM
15,,SING,C2A,C3A,yes,N,15,,45514,16307,HEM
16,,SING,C2A,CAA,no,N,16,,45514,16307,HEM
17,,DOUB,C3A,C4A,yes,N,17,,45514,16307,HEM
18,,SING,C3A,CMA,no,N,18,,45514,16307,HEM
19,,SING,C4A,NA,yes,N,19,,45514,16307,HEM
20,,SING,CMA,HMA,no,N,20,,45514,16307,HEM
21,,SING,CMA,HMAA,no,N,21,,45514,16307,HEM
22,,SING,CMA,HMAB,no,N,22,,45514,16307,HEM
23,,SING,CAA,CBA,no,N,23,,45514,16307,HEM
24,,SING,CAA,HAA,no,N,24,,45514,16307,HEM
25,,SING,CAA,HAAA,no,N,25,,45514,16307,HEM
26,,SING,CBA,CGA,no,N,26,,45514,16307,HEM
27,,SING,CBA,HBA,no,N,27,,45514,16307,HEM
28,,SING,CBA,HBAA,no,N,28,,45514,16307,HEM
29,,DOUB,CGA,O1A,no,N,29,,45514,16307,HEM
30,,SING,CGA,O2A,no,N,30,,45514,16307,HEM
31,,SING,C1B,C2B,no,N,31,,45514,16307,HEM
32,,SING,C1B,NB,yes,N,32,,45514,16307,HEM
33,,DOUB,C2B,C3B,yes,N,33,,45514,16307,HEM
34,,SING,C2B,CMB,yes,N,34,,45514,16307,HEM
35,,SING,C3B,C4B,no,N,35,,45514,16307,HEM
36,,SING,C3B,CAB,yes,N,36,,45514,16307,HEM
37,,DOUB,C4B,NB,no,N,37,,45514,16307,HEM
38,,SING,CMB,HMB,yes,N,38,,45514,16307,HEM
39,,SING,CMB,HMBA,no,N,39,,45514,16307,HEM
40,,SING,CMB,HMBB,no,N,40,,45514,16307,HEM
41,,DOUB,CAB,CBB,no,N,41,,45514,16307,HEM
42,,SING,CAB,HAB,no,N,42,,45514,16307,HEM
43,,SING,CBB,HBB,no,N,43,,45514,16307,HEM
44,,SING,CBB,HBBA,no,N,44,,45514,16307,HEM
45,,SING,C1C,C2C,no,N,45,,45514,16307,HEM
46,,SING,C1C,NC,yes,N,46,,45514,16307,HEM
47,,DOUB,C2C,C3C,yes,N,47,,45514,16307,HEM
48,,SING,C2C,CMC,yes,N,48,,45514,16307,HEM
49,,SING,C3C,C4C,no,N,49,,45514,16307,HEM
50,,SING,C3C,CAC,yes,N,50,,45514,16307,HEM
51,,SING,C4C,NC,no,N,51,,45514,16307,HEM
52,,SING,CMC,HMC,yes,N,52,,45514,16307,HEM
53,,SING,CMC,HMCA,no,N,53,,45514,16307,HEM
54,,SING,CMC,HMCB,no,N,54,,45514,16307,HEM
55,,DOUB,CAC,CBC,no,N,55,,45514,16307,HEM
56,,SING,CAC,HAC,no,N,56,,45514,16307,HEM
57,,SING,CBC,HBC,no,N,57,,45514,16307,HEM
58,,SING,CBC,HBCA,no,N,58,,45514,16307,HEM
59,,SING,C1D,C2D,no,N,59,,45514,16307,HEM
60,,DOUB,C1D,ND,yes,N,60,,45514,16307,HEM
61,,DOUB,C2D,C3D,yes,N,61,,45514,16307,HEM
62,,SING,C2D,CMD,yes,N,62,,45514,16307,HEM
63,,SING,C3D,C4D,no,N,63,,45514,16307,HEM
64,,SING,C3D,CAD,yes,N,64,,45514,16307,HEM
65,,SING,C4D,ND,no,N,65,,45514,16307,HEM
66,,SING,CMD,HMD,yes,N,66,,45514,16307,HEM
67,,SING,CMD,HMDA,no,N,67,,45514,16307,HEM
68,,SING,CMD,HMDB,no,N,68,,45514,16307,HEM
69,,SING,CAD,CBD,no,N,69,,45514,16307,HEM
70,,SING,CAD,HAD,no,N,70,,45514,16307,HEM
71,,SING,CAD,HADA,no,N,71,,45514,16307,HEM
72,,SING,CBD,CGD,no,N,72,,45514,16307,HEM
73,,SING,CBD,HBD,no,N,73,,45514,16307,HEM
74,,SING,CBD,HBDA,no,N,74,,45514,16307,HEM
75,,DOUB,CGD,O1D,no,N,75,,45514,16307,HEM
76,,SING,CGD,O2D,no,N,76,,45514,16307,HEM
77,,SING,O2A,H2A,no,N,77,,45514,16307,HEM
78,,SING,O2D,H2D,no,N,78,,45514,16307,HEM
79,,SING,FE,NA,no,N,79,,45514,16307,HEM
80,,SING,FE,NB,no,N,80,,45514,16307,HEM
81,,SING,FE,NC,no,N,81,,45514,16307,HEM
82,,SING,FE,ND,no,N,82,,45514,16307,HEM
1,,SING,C1,C2,no,N,1,,45544,16309,JN3
2,,SING,C1,C10,no,N,2,,45544,16309,JN3
3,,SING,C1,H11,no,N,3,,45544,16309,JN3
4,,SING,C1,H12,no,N,4,,45544,16309,JN3
5,,SING,C2,C3,no,N,5,,45544,16309,JN3
6,,SING,C2,H21,no,N,6,,45544,16309,JN3
7,,SING,C2,H22,no,N,7,,45544,16309,JN3
8,,SING,C3,O3,no,N,8,,45544,16309,JN3
9,,SING,C3,C4,no,N,9,,45544,16309,JN3
10,,SING,C3,H3,no,N,10,,45544,16309,JN3
11,,SING,O3,HO3,no,N,11,,45544,16309,JN3
12,,SING,C4,C5,no,N,12,,45544,16309,JN3
13,,SING,C4,H41,no,N,13,,45544,16309,JN3
14,,SING,C4,H42,no,N,14,,45544,16309,JN3
15,,SING,C5,C10,no,N,15,,45544,16309,JN3
16,,SING,C5,C6,no,N,16,,45544,16309,JN3
17,,SING,C5,H5,no,N,17,,45544,16309,JN3
18,,SING,C6,C7,no,N,18,,45544,16309,JN3
19,,SING,C6,H61,no,N,19,,45544,16309,JN3
20,,SING,C6,H62,no,N,20,,45544,16309,JN3
21,,SING,C7,C8,no,N,21,,45544,16309,JN3
22,,SING,C7,O7,no,N,22,,45544,16309,JN3
23,,SING,C7,H7,no,N,23,,45544,16309,JN3
24,,SING,O7,HO7,no,N,24,,45544,16309,JN3
25,,SING,C8,C9,no,N,25,,45544,16309,JN3
26,,SING,C8,C14,no,N,26,,45544,16309,JN3
27,,SING,C8,H8,no,N,27,,45544,16309,JN3
28,,SING,C9,C11,no,N,28,,45544,16309,JN3
29,,SING,C9,C10,no,N,29,,45544,16309,JN3
30,,SING,C9,H9,no,N,30,,45544,16309,JN3
31,,SING,C10,C19,no,N,31,,45544,16309,JN3
32,,SING,C11,C12,no,N,32,,45544,16309,JN3
33,,SING,C11,H111,no,N,33,,45544,16309,JN3
34,,SING,C11,H112,no,N,34,,45544,16309,JN3
35,,SING,C12,C13,no,N,35,,45544,16309,JN3
36,,SING,C12,H121,no,N,36,,45544,16309,JN3
37,,SING,C12,H122,no,N,37,,45544,16309,JN3
38,,SING,C13,C18,no,N,38,,45544,16309,JN3
39,,SING,C13,C17,no,N,39,,45544,16309,JN3
40,,SING,C13,C14,no,N,40,,45544,16309,JN3
41,,SING,C14,C15,no,N,41,,45544,16309,JN3
42,,SING,C14,H14,no,N,42,,45544,16309,JN3
43,,SING,C15,C16,no,N,43,,45544,16309,JN3
44,,SING,C15,H151,no,N,44,,45544,16309,JN3
45,,SING,C15,H152,no,N,45,,45544,16309,JN3
46,,SING,C16,C17,no,N,46,,45544,16309,JN3
47,,SING,C16,H161,no,N,47,,45544,16309,JN3
48,,SING,C16,H162,no,N,48,,45544,16309,JN3
49,,SING,C17,C20,no,N,49,,45544,16309,JN3
50,,SING,C17,H17,no,N,50,,45544,16309,JN3
51,,SING,C18,H181,no,N,51,,45544,16309,JN3
52,,SING,C18,H182,no,N,52,,45544,16309,JN3
53,,SING,C18,H183,no,N,53,,45544,16309,JN3
54,,SING,C19,H191,no,N,54,,45544,16309,JN3
55,,SING,C19,H192,no,N,55,,45544,16309,JN3
56,,SING,C19,H193,no,N,56,,45544,16309,JN3
57,,SING,C20,C21,no,N,57,,45544,16309,JN3
58,,SING,C20,C22,no,N,58,,45544,16309,JN3
59,,SING,C20,H20,no,N,59,,45544,16309,JN3
60,,SING,C21,H211,no,N,60,,45544,16309,JN3
61,,SING,C21,H212,no,N,61,,45544,16309,JN3
62,,SING,C21,H213,no,N,62,,45544,16309,JN3
63,,SING,C22,C23,no,N,63,,45544,16309,JN3
64,,SING,C22,H221,no,N,64,,45544,16309,JN3
65,,SING,C22,H222,no,N,65,,45544,16309,JN3
66,,SING,C23,C24,no,N,66,,45544,16309,JN3
67,,SING,C23,H231,no,N,67,,45544,16309,JN3
68,,SING,C23,H232,no,N,68,,45544,16309,JN3
69,,DOUB,O25,C24,no,N,69,,45544,16309,JN3
70,,SING,C24,O26,no,N,70,,45544,16309,JN3
71,,SING,O26,HO26,no,N,71,,45544,16309,JN3
1,,SING,C11,O11,no,N,1,,46028,16337,TOY
2,,SING,C11,C21,no,N,2,,46028,16337,TOY
3,,SING,C11,O51,no,N,3,,46028,16337,TOY
4,,SING,C11,H11,no,N,4,,46028,16337,TOY
5,,SING,O11,C42,no,N,5,,46028,16337,TOY
6,,SING,C21,N21,no,N,6,,46028,16337,TOY
7,,SING,C21,C31,no,N,7,,46028,16337,TOY
8,,SING,C21,H21,no,N,8,,46028,16337,TOY
9,,SING,N21,HN21,no,N,9,,46028,16337,TOY
10,,SING,N21,HN22,no,N,10,,46028,16337,TOY
11,,SING,C31,C41,no,N,11,,46028,16337,TOY
12,,SING,C31,H311,no,N,12,,46028,16337,TOY
13,,SING,C31,H312,no,N,13,,46028,16337,TOY
14,,SING,C41,O41,no,N,14,,46028,16337,TOY
15,,SING,C41,C51,no,N,15,,46028,16337,TOY
16,,SING,C41,H41,no,N,16,,46028,16337,TOY
17,,SING,O41,H41O,no,N,17,,46028,16337,TOY
18,,SING,C51,O51,no,N,18,,46028,16337,TOY
19,,SING,C51,C61,no,N,19,,46028,16337,TOY
20,,SING,C51,H51,no,N,20,,46028,16337,TOY
21,,SING,C61,N61,no,N,21,,46028,16337,TOY
22,,SING,C61,H611,no,N,22,,46028,16337,TOY
23,,SING,C61,H612,no,N,23,,46028,16337,TOY
24,,SING,N61,HN61,no,N,24,,46028,16337,TOY
25,,SING,N61,HN62,no,N,25,,46028,16337,TOY
26,,SING,C12,N12,no,N,26,,46028,16337,TOY
27,,SING,C12,C22,no,N,27,,46028,16337,TOY
28,,SING,C12,C62,no,N,28,,46028,16337,TOY
29,,SING,C12,H12,no,N,29,,46028,16337,TOY
30,,SING,N12,HN11,no,N,30,,46028,16337,TOY
31,,SING,N12,HN12,no,N,31,,46028,16337,TOY
32,,SING,C22,C32,no,N,32,,46028,16337,TOY
33,,SING,C22,H221,no,N,33,,46028,16337,TOY
34,,SING,C22,H222,no,N,34,,46028,16337,TOY
35,,SING,C32,N32,no,N,35,,46028,16337,TOY
36,,SING,C32,C42,no,N,36,,46028,16337,TOY
37,,SING,C32,H32,no,N,37,,46028,16337,TOY
38,,SING,N32,HN1,no,N,38,,46028,16337,TOY
39,,SING,N32,HN2,no,N,39,,46028,16337,TOY
40,,SING,C42,C52,no,N,40,,46028,16337,TOY
41,,SING,C42,H42,no,N,41,,46028,16337,TOY
42,,SING,C52,O52,no,N,42,,46028,16337,TOY
43,,SING,C52,C62,no,N,43,,46028,16337,TOY
44,,SING,C52,H52,no,N,44,,46028,16337,TOY
45,,SING,O52,H52O,no,N,45,,46028,16337,TOY
46,,SING,C62,O62,no,N,46,,46028,16337,TOY
47,,SING,C62,H62,no,N,47,,46028,16337,TOY
48,,SING,O62,C13,no,N,48,,46028,16337,TOY
49,,SING,C13,C23,no,N,49,,46028,16337,TOY
50,,SING,C13,O53,no,N,50,,46028,16337,TOY
51,,SING,C13,H13,no,N,51,,46028,16337,TOY
52,,SING,C23,O23,no,N,52,,46028,16337,TOY
53,,SING,C23,C33,no,N,53,,46028,16337,TOY
54,,SING,C23,H23,no,N,54,,46028,16337,TOY
55,,SING,O23,H23O,no,N,55,,46028,16337,TOY
56,,SING,C33,N33,no,N,56,,46028,16337,TOY
57,,SING,C33,C43,no,N,57,,46028,16337,TOY
58,,SING,C33,H33,no,N,58,,46028,16337,TOY
59,,SING,N33,HN31,no,N,59,,46028,16337,TOY
60,,SING,N33,HN32,no,N,60,,46028,16337,TOY
61,,SING,C43,O43,no,N,61,,46028,16337,TOY
62,,SING,C43,C53,no,N,62,,46028,16337,TOY
63,,SING,C43,H43,no,N,63,,46028,16337,TOY
64,,SING,O43,H43O,no,N,64,,46028,16337,TOY
65,,SING,C53,O53,no,N,65,,46028,16337,TOY
66,,SING,C53,C63,no,N,66,,46028,16337,TOY
67,,SING,C53,H53,no,N,67,,46028,16337,TOY
68,,SING,C63,O63,no,N,68,,46028,16337,TOY
69,,SING,C63,H631,no,N,69,,46028,16337,TOY
70,,SING,C63,H632,no,N,70,,46028,16337,TOY
71,,SING,O63,H63O,no,N,71,,46028,16337,TOY
1,,SING,N,CA,,,,,46159,16343,DGL
2,,SING,N,H,,,,,46159,16343,DGL
3,,SING,N,H2,,,,,46159,16343,DGL
4,,SING,CA,C,,,,,46159,16343,DGL
5,,SING,CA,CB,,,,,46159,16343,DGL
6,,SING,CA,HA,,,,,46159,16343,DGL
7,,DOUB,C,O,,,,,46159,16343,DGL
8,,SING,C,OXT,,,,,46159,16343,DGL
9,,SING,CB,CG,,,,,46159,16343,DGL
10,,SING,CB,HB2,,,,,46159,16343,DGL
11,,SING,CB,HB3,,,,,46159,16343,DGL
12,,SING,CG,CD,,,,,46159,16343,DGL
13,,SING,CG,HG2,,,,,46159,16343,DGL
14,,SING,CG,HG3,,,,,46159,16343,DGL
15,,DOUB,CD,OE1,,,,,46159,16343,DGL
16,,SING,CD,OE2,,,,,46159,16343,DGL
17,,SING,OE2,HE2,,,,,46159,16343,DGL
18,,SING,OXT,HXT,,,,,46159,16343,DGL
1,,SING,N1,C2,yes,N,1,,46431,16356,INO
2,,DOUB,N1,C6,yes,N,2,,46431,16356,INO
3,,SING,N1,O4,no,N,3,,46431,16356,INO
4,,DOUB,C2,C3,yes,N,4,,46431,16356,INO
5,,SING,C2,O3,no,N,5,,46431,16356,INO
6,,SING,C3,C4,yes,N,6,,46431,16356,INO
7,,SING,C3,H3,no,N,7,,46431,16356,INO
8,,DOUB,C4,C5,yes,N,8,,46431,16356,INO
9,,SING,C4,C7,no,N,9,,46431,16356,INO
10,,SING,C5,C6,yes,N,10,,46431,16356,INO
11,,SING,C5,H5,no,N,11,,46431,16356,INO
12,,SING,C6,H6,no,N,12,,46431,16356,INO
13,,DOUB,C7,O1,no,N,13,,46431,16356,INO
14,,SING,C7,O2,no,N,14,,46431,16356,INO
15,,SING,O2,HO2,no,N,15,,46431,16356,INO
16,,SING,O3,HO3,no,N,16,,46431,16356,INO
1,,DOUB,C,O,no,N,1,,46661,16368,ACE
2,,SING,C,CH3,no,N,2,,46661,16368,ACE
3,,SING,C,H,no,N,3,,46661,16368,ACE
4,,SING,CH3,H1,no,N,4,,46661,16368,ACE
5,,SING,CH3,H2,no,N,5,,46661,16368,ACE
6,,SING,CH3,H3,no,N,6,,46661,16368,ACE
1,,SING,N,CA,no,N,1,,47421,16400,HYP
2,,SING,N,CD,no,N,2,,47421,16400,HYP
3,,SING,N,H,no,N,3,,47421,16400,HYP
4,,SING,CA,C,no,N,4,,47421,16400,HYP
5,,SING,CA,CB,no,N,5,,47421,16400,HYP
6,,SING,CA,HA,no,N,6,,47421,16400,HYP
7,,DOUB,C,O,no,N,7,,47421,16400,HYP
8,,SING,C,OXT,no,N,8,,47421,16400,HYP
9,,SING,CB,CG,no,N,9,,47421,16400,HYP
10,,SING,CB,HB2,no,N,10,,47421,16400,HYP
11,,SING,CB,HB3,no,N,11,,47421,16400,HYP
12,,SING,CG,CD,no,N,12,,47421,16400,HYP
13,,SING,CG,OD1,no,N,13,,47421,16400,HYP
14,,SING,CG,HG,no,N,14,,47421,16400,HYP
15,,SING,CD,HD22,no,N,15,,47421,16400,HYP
16,,SING,CD,HD23,no,N,16,,47421,16400,HYP
17,,SING,OD1,HD1,no,N,17,,47421,16400,HYP
18,,SING,OXT,HXT,no,N,18,,47421,16400,HYP
1,,SING,FE,NA,no,N,1,,47447,16401,HEM
2,,SING,FE,NB,no,N,2,,47447,16401,HEM
3,,SING,FE,NC,no,N,3,,47447,16401,HEM
4,,SING,FE,ND,no,N,4,,47447,16401,HEM
5,,DOUB,CHA,C1A,yes,N,5,,47447,16401,HEM
6,,SING,CHA,C4D,yes,N,6,,47447,16401,HEM
7,,SING,CHA,HHA,no,N,7,,47447,16401,HEM
8,,DOUB,CHB,C4A,yes,N,8,,47447,16401,HEM
9,,SING,CHB,C1B,yes,N,9,,47447,16401,HEM
10,,SING,CHB,HHB,no,N,10,,47447,16401,HEM
11,,DOUB,CHC,C4B,yes,N,11,,47447,16401,HEM
12,,SING,CHC,C1C,yes,N,12,,47447,16401,HEM
13,,SING,CHC,HHC,no,N,13,,47447,16401,HEM
14,,SING,CHD,C4C,yes,N,14,,47447,16401,HEM
15,,DOUB,CHD,C1D,yes,N,15,,47447,16401,HEM
16,,SING,CHD,HHD,no,N,16,,47447,16401,HEM
17,,SING,NA,C1A,yes,N,17,,47447,16401,HEM
18,,SING,NA,C4A,yes,N,18,,47447,16401,HEM
19,,SING,C1A,C2A,yes,N,19,,47447,16401,HEM
20,,DOUB,C2A,C3A,yes,N,20,,47447,16401,HEM
21,,SING,C2A,CAA,no,N,21,,47447,16401,HEM
22,,SING,C3A,C4A,yes,N,22,,47447,16401,HEM
23,,SING,C3A,CMA,no,N,23,,47447,16401,HEM
24,,SING,CMA,HMA1,no,N,24,,47447,16401,HEM
25,,SING,CMA,HMA2,no,N,25,,47447,16401,HEM
26,,SING,CMA,HMA3,no,N,26,,47447,16401,HEM
27,,SING,CAA,CBA,no,N,27,,47447,16401,HEM
28,,SING,CAA,HAA1,no,N,28,,47447,16401,HEM
29,,SING,CAA,HAA2,no,N,29,,47447,16401,HEM
30,,SING,CBA,CGA,no,N,30,,47447,16401,HEM
31,,SING,CBA,HBA1,no,N,31,,47447,16401,HEM
32,,SING,CBA,HBA2,no,N,32,,47447,16401,HEM
33,,DOUB,CGA,O1A,no,N,33,,47447,16401,HEM
34,,SING,CGA,O2A,no,N,34,,47447,16401,HEM
35,,SING,O2A,H2A,no,N,35,,47447,16401,HEM
36,,DOUB,NB,C1B,yes,N,36,,47447,16401,HEM
37,,SING,NB,C4B,yes,N,37,,47447,16401,HEM
38,,SING,C1B,C2B,no,N,38,,47447,16401,HEM
39,,DOUB,C2B,C3B,no,N,39,,47447,16401,HEM
40,,SING,C2B,CMB,no,N,40,,47447,16401,HEM
41,,SING,C3B,C4B,no,N,41,,47447,16401,HEM
42,,SING,C3B,CAB,no,N,42,,47447,16401,HEM
43,,SING,CMB,HMB1,no,N,43,,47447,16401,HEM
44,,SING,CMB,HMB2,no,N,44,,47447,16401,HEM
45,,SING,CMB,HMB3,no,N,45,,47447,16401,HEM
46,,DOUB,CAB,CBB,no,N,46,,47447,16401,HEM
47,,SING,CAB,HAB,no,N,47,,47447,16401,HEM
48,,SING,CBB,HBB1,no,N,48,,47447,16401,HEM
49,,SING,CBB,HBB2,no,N,49,,47447,16401,HEM
50,,SING,NC,C1C,yes,N,50,,47447,16401,HEM
51,,SING,NC,C4C,yes,N,51,,47447,16401,HEM
52,,DOUB,C1C,C2C,yes,N,52,,47447,16401,HEM
53,,SING,C2C,C3C,yes,N,53,,47447,16401,HEM
54,,SING,C2C,CMC,no,N,54,,47447,16401,HEM
55,,DOUB,C3C,C4C,yes,N,55,,47447,16401,HEM
56,,SING,C3C,CAC,no,N,56,,47447,16401,HEM
57,,SING,CMC,HMC1,no,N,57,,47447,16401,HEM
58,,SING,CMC,HMC2,no,N,58,,47447,16401,HEM
59,,SING,CMC,HMC3,no,N,59,,47447,16401,HEM
60,,DOUB,CAC,CBC,no,N,60,,47447,16401,HEM
61,,SING,CAC,HAC,no,N,61,,47447,16401,HEM
62,,SING,CBC,HBC1,no,N,62,,47447,16401,HEM
63,,SING,CBC,HBC2,no,N,63,,47447,16401,HEM
64,,SING,ND,C1D,yes,N,64,,47447,16401,HEM
65,,DOUB,ND,C4D,yes,N,65,,47447,16401,HEM
66,,SING,C1D,C2D,no,N,66,,47447,16401,HEM
67,,DOUB,C2D,C3D,no,N,67,,47447,16401,HEM
68,,SING,C2D,CMD,no,N,68,,47447,16401,HEM
69,,SING,C3D,C4D,no,N,69,,47447,16401,HEM
70,,SING,C3D,CAD,no,N,70,,47447,16401,HEM
71,,SING,CMD,HMD1,no,N,71,,47447,16401,HEM
72,,SING,CMD,HMD2,no,N,72,,47447,16401,HEM
73,,SING,CMD,HMD3,no,N,73,,47447,16401,HEM
74,,SING,CAD,CBD,no,N,74,,47447,16401,HEM
75,,SING,CAD,HAD1,no,N,75,,47447,16401,HEM
76,,SING,CAD,HAD2,no,N,76,,47447,16401,HEM
77,,SING,CBD,CGD,no,N,77,,47447,16401,HEM
78,,SING,CBD,HBD1,no,N,78,,47447,16401,HEM
79,,SING,CBD,HBD2,no,N,79,,47447,16401,HEM
80,,DOUB,CGD,O1D,no,N,80,,47447,16401,HEM
81,,SING,CGD,O2D,no,N,81,,47447,16401,HEM
82,,SING,O2D,H2D,no,N,82,,47447,16401,HEM
1,,SING,C1,C2,no,N,1,,47596,16409,GL1
2,,SING,C1,O1,no,N,2,,47596,16409,GL1
3,,SING,C1,O5,no,N,3,,47596,16409,GL1
4,,SING,C1,H1,no,N,4,,47596,16409,GL1
5,,SING,C2,C3,no,N,5,,47596,16409,GL1
6,,SING,C2,O2,no,N,6,,47596,16409,GL1
7,,SING,C2,H2,no,N,7,,47596,16409,GL1
8,,SING,C3,C4,no,N,8,,47596,16409,GL1
9,,SING,C3,O3,no,N,9,,47596,16409,GL1
10,,SING,C3,H3,no,N,10,,47596,16409,GL1
11,,SING,C4,C5,no,N,11,,47596,16409,GL1
12,,SING,C4,O4,no,N,12,,47596,16409,GL1
13,,SING,C4,H4,no,N,13,,47596,16409,GL1
14,,SING,C5,C6,no,N,14,,47596,16409,GL1
15,,SING,C5,O5,no,N,15,,47596,16409,GL1
16,,SING,C5,H5,no,N,16,,47596,16409,GL1
17,,SING,C6,O6,no,N,17,,47596,16409,GL1
18,,SING,C6,H61,no,N,18,,47596,16409,GL1
19,,SING,C6,H62,no,N,19,,47596,16409,GL1
20,,SING,O1,P,no,N,20,,47596,16409,GL1
21,,SING,O2,HO2,no,N,21,,47596,16409,GL1
22,,SING,O3,HO3,no,N,22,,47596,16409,GL1
23,,SING,O4,HO4,no,N,23,,47596,16409,GL1
24,,SING,O6,HO6,no,N,24,,47596,16409,GL1
25,,SING,P,O1P,no,N,25,,47596,16409,GL1
26,,SING,P,O2P,no,N,26,,47596,16409,GL1
27,,DOUB,P,O3P,no,N,27,,47596,16409,GL1
28,,SING,O1P,H1P,no,N,28,,47596,16409,GL1
29,,SING,O2P,H2P,no,N,29,,47596,16409,GL1
1,,SING,F1,MG,no,N,1,,47597,16409,MGF
2,,SING,MG,F2,no,N,2,,47597,16409,MGF
3,,SING,MG,F3,no,N,3,,47597,16409,MGF
1,,SING,O1,C1,no,N,1,,47685,16415,LHG
2,,SING,O1,HO1,no,N,2,,47685,16415,LHG
3,,SING,C1,C2,no,N,3,,47685,16415,LHG
4,,SING,C1,HC11,no,N,4,,47685,16415,LHG
5,,SING,C1,HC12,no,N,5,,47685,16415,LHG
6,,SING,C2,O2,no,N,6,,47685,16415,LHG
7,,SING,C2,C3,no,N,7,,47685,16415,LHG
8,,SING,C2,HC2,no,N,8,,47685,16415,LHG
9,,SING,O2,H02,no,N,9,,47685,16415,LHG
10,,SING,C3,O3,no,N,10,,47685,16415,LHG
11,,SING,C3,HC31,no,N,11,,47685,16415,LHG
12,,SING,C3,HC32,no,N,12,,47685,16415,LHG
13,,SING,O3,P,no,N,13,,47685,16415,LHG
14,,SING,P,O4,no,N,14,,47685,16415,LHG
15,,DOUB,P,O5,no,N,15,,47685,16415,LHG
16,,SING,P,O6,no,N,16,,47685,16415,LHG
17,,SING,O4,HO4,no,N,17,,47685,16415,LHG
18,,SING,O6,C4,no,N,18,,47685,16415,LHG
19,,SING,C4,C5,no,N,19,,47685,16415,LHG
20,,SING,C4,HC41,no,N,20,,47685,16415,LHG
21,,SING,C4,HC42,no,N,21,,47685,16415,LHG
22,,SING,C5,C6,no,N,22,,47685,16415,LHG
23,,SING,C5,O7,no,N,23,,47685,16415,LHG
24,,SING,C5,HC5,no,N,24,,47685,16415,LHG
25,,SING,C6,O8,no,N,25,,47685,16415,LHG
26,,SING,C6,HC61,no,N,26,,47685,16415,LHG
27,,SING,C6,HC62,no,N,27,,47685,16415,LHG
28,,SING,O7,C7,no,N,28,,47685,16415,LHG
29,,DOUB,C7,O9,no,N,29,,47685,16415,LHG
30,,SING,C7,C8,no,N,30,,47685,16415,LHG
31,,SING,C8,C9,no,N,31,,47685,16415,LHG
32,,SING,C8,HC81,no,N,32,,47685,16415,LHG
33,,SING,C8,HC82,no,N,33,,47685,16415,LHG
34,,SING,C9,C10,no,N,34,,47685,16415,LHG
35,,SING,C9,HC91,no,N,35,,47685,16415,LHG
36,,SING,C9,HC92,no,N,36,,47685,16415,LHG
37,,SING,C10,C11,no,N,37,,47685,16415,LHG
38,,SING,C10,H101,no,N,38,,47685,16415,LHG
39,,SING,C10,H102,no,N,39,,47685,16415,LHG
40,,SING,O8,C23,no,N,40,,47685,16415,LHG
41,,DOUB,C23,O10,no,N,41,,47685,16415,LHG
42,,SING,C23,C24,no,N,42,,47685,16415,LHG
43,,SING,C24,C25,no,N,43,,47685,16415,LHG
44,,SING,C24,H241,no,N,44,,47685,16415,LHG
45,,SING,C24,H242,no,N,45,,47685,16415,LHG
46,,SING,C11,C12,no,N,46,,47685,16415,LHG
47,,SING,C11,H111,no,N,47,,47685,16415,LHG
48,,SING,C11,H112,no,N,48,,47685,16415,LHG
49,,SING,C12,C13,no,N,49,,47685,16415,LHG
50,,SING,C12,H121,no,N,50,,47685,16415,LHG
51,,SING,C12,H122,no,N,51,,47685,16415,LHG
52,,SING,C13,C14,no,N,52,,47685,16415,LHG
53,,SING,C13,H131,no,N,53,,47685,16415,LHG
54,,SING,C13,H132,no,N,54,,47685,16415,LHG
55,,SING,C14,C15,no,N,55,,47685,16415,LHG
56,,SING,C14,H141,no,N,56,,47685,16415,LHG
57,,SING,C14,H142,no,N,57,,47685,16415,LHG
58,,SING,C15,C16,no,N,58,,47685,16415,LHG
59,,SING,C15,H151,no,N,59,,47685,16415,LHG
60,,SING,C15,H152,no,N,60,,47685,16415,LHG
61,,SING,C16,C17,no,N,61,,47685,16415,LHG
62,,SING,C16,H161,no,N,62,,47685,16415,LHG
63,,SING,C16,H162,no,N,63,,47685,16415,LHG
64,,SING,C17,C18,no,N,64,,47685,16415,LHG
65,,SING,C17,H171,no,N,65,,47685,16415,LHG
66,,SING,C17,H172,no,N,66,,47685,16415,LHG
67,,SING,C18,C19,no,N,67,,47685,16415,LHG
68,,SING,C18,H181,no,N,68,,47685,16415,LHG
69,,SING,C18,H182,no,N,69,,47685,16415,LHG
70,,SING,C19,C20,no,N,70,,47685,16415,LHG
71,,SING,C19,H191,no,N,71,,47685,16415,LHG
72,,SING,C19,H192,no,N,72,,47685,16415,LHG
73,,SING,C20,C21,no,N,73,,47685,16415,LHG
74,,SING,C20,H201,no,N,74,,47685,16415,LHG
75,,SING,C20,H202,no,N,75,,47685,16415,LHG
76,,SING,C21,C22,no,N,76,,47685,16415,LHG
77,,SING,C21,H211,no,N,77,,47685,16415,LHG
78,,SING,C21,H212,no,N,78,,47685,16415,LHG
79,,SING,C22,H221,no,N,79,,47685,16415,LHG
80,,SING,C22,H222,no,N,80,,47685,16415,LHG
81,,SING,C22,H223,no,N,81,,47685,16415,LHG
82,,SING,C25,C26,no,N,82,,47685,16415,LHG
83,,SING,C25,H251,no,N,83,,47685,16415,LHG
84,,SING,C25,H252,no,N,84,,47685,16415,LHG
85,,SING,C26,C27,no,N,85,,47685,16415,LHG
86,,SING,C26,H261,no,N,86,,47685,16415,LHG
87,,SING,C26,H262,no,N,87,,47685,16415,LHG
88,,SING,C27,C28,no,N,88,,47685,16415,LHG
89,,SING,C27,H271,no,N,89,,47685,16415,LHG
90,,SING,C27,H272,no,N,90,,47685,16415,LHG
91,,SING,C28,C29,no,N,91,,47685,16415,LHG
92,,SING,C28,H281,no,N,92,,47685,16415,LHG
93,,SING,C28,H282,no,N,93,,47685,16415,LHG
94,,SING,C29,C30,no,N,94,,47685,16415,LHG
95,,SING,C29,H291,no,N,95,,47685,16415,LHG
96,,SING,C29,H292,no,N,96,,47685,16415,LHG
97,,SING,C30,C31,no,N,97,,47685,16415,LHG
98,,SING,C30,H301,no,N,98,,47685,16415,LHG
99,,SING,C30,H302,no,N,99,,47685,16415,LHG
100,,SING,C31,C32,no,N,100,,47685,16415,LHG
101,,SING,C31,H311,no,N,101,,47685,16415,LHG
102,,SING,C31,H312,no,N,102,,47685,16415,LHG
103,,SING,C32,C33,no,N,103,,47685,16415,LHG
104,,SING,C32,H321,no,N,104,,47685,16415,LHG
105,,SING,C32,H322,no,N,105,,47685,16415,LHG
106,,SING,C33,C34,no,N,106,,47685,16415,LHG
107,,SING,C33,H331,no,N,107,,47685,16415,LHG
108,,SING,C33,H332,no,N,108,,47685,16415,LHG
109,,SING,C34,C35,no,N,109,,47685,16415,LHG
110,,SING,C34,H341,no,N,110,,47685,16415,LHG
111,,SING,C34,H342,no,N,111,,47685,16415,LHG
112,,SING,C35,C36,no,N,112,,47685,16415,LHG
113,,SING,C35,H351,no,N,113,,47685,16415,LHG
114,,SING,C35,H352,no,N,114,,47685,16415,LHG
115,,SING,C36,C37,no,N,115,,47685,16415,LHG
116,,SING,C36,H361,no,N,116,,47685,16415,LHG
117,,SING,C36,H362,no,N,117,,47685,16415,LHG
118,,SING,C37,C38,no,N,118,,47685,16415,LHG
119,,SING,C37,H371,no,N,119,,47685,16415,LHG
120,,SING,C37,H372,no,N,120,,47685,16415,LHG
121,,SING,C38,H381,no,N,121,,47685,16415,LHG
122,,SING,C38,H382,no,N,122,,47685,16415,LHG
123,,SING,C38,H383,no,N,123,,47685,16415,LHG
1,,SING,N,CA,no,N,1,,47707,16416,NLE
2,,SING,N,H,no,N,2,,47707,16416,NLE
3,,SING,N,HN2,no,N,3,,47707,16416,NLE
4,,SING,CA,C,no,N,4,,47707,16416,NLE
5,,SING,CA,CB,no,N,5,,47707,16416,NLE
6,,SING,CA,HA,no,N,6,,47707,16416,NLE
7,,DOUB,C,O,no,N,7,,47707,16416,NLE
8,,SING,C,OXT,no,N,8,,47707,16416,NLE
9,,SING,OXT,HXT,no,N,9,,47707,16416,NLE
10,,SING,CB,CG,no,N,10,,47707,16416,NLE
11,,SING,CB,HB2,no,N,11,,47707,16416,NLE
12,,SING,CB,HB3,no,N,12,,47707,16416,NLE
13,,SING,CG,CD,no,N,13,,47707,16416,NLE
14,,SING,CG,HG2,no,N,14,,47707,16416,NLE
15,,SING,CG,HG3,no,N,15,,47707,16416,NLE
16,,SING,CD,CE,no,N,16,,47707,16416,NLE
17,,SING,CD,HD2,no,N,17,,47707,16416,NLE
18,,SING,CD,HD3,no,N,18,,47707,16416,NLE
19,,SING,CE,HE1,no,N,19,,47707,16416,NLE
20,,SING,CE,HE2,no,N,20,,47707,16416,NLE
21,,SING,CE,HE3,no,N,21,,47707,16416,NLE
1,,SING,N,CA,no,N,1,,47708,16416,PPN
2,,SING,N,H,no,N,2,,47708,16416,PPN
3,,SING,N,H2,no,N,3,,47708,16416,PPN
4,,SING,CA,C,no,N,4,,47708,16416,PPN
5,,SING,CA,CB,no,N,5,,47708,16416,PPN
6,,SING,CA,HA,no,N,6,,47708,16416,PPN
7,,DOUB,C,O,no,N,7,,47708,16416,PPN
8,,SING,C,OXT,no,N,8,,47708,16416,PPN
9,,SING,OXT,HXT,no,N,9,,47708,16416,PPN
10,,SING,CB,CG,no,N,10,,47708,16416,PPN
11,,SING,CB,HB2,no,N,11,,47708,16416,PPN
12,,SING,CB,HB3,no,N,12,,47708,16416,PPN
13,,DOUB,CG,CD1,yes,N,13,,47708,16416,PPN
14,,SING,CG,CD2,yes,N,14,,47708,16416,PPN
15,,SING,CD1,CE1,yes,N,15,,47708,16416,PPN
16,,SING,CD1,HD1,no,N,16,,47708,16416,PPN
17,,DOUB,CD2,CE2,yes,N,17,,47708,16416,PPN
18,,SING,CD2,HD2,no,N,18,,47708,16416,PPN
19,,DOUB,CE1,CZ,yes,N,19,,47708,16416,PPN
20,,SING,CE1,HE1,no,N,20,,47708,16416,PPN
21,,SING,CE2,CZ,yes,N,21,,47708,16416,PPN
22,,SING,CE2,HE2,no,N,22,,47708,16416,PPN
23,,SING,CZ,N1,no,N,23,,47708,16416,PPN
24,,DOUB,N1,O1,no,N,24,,47708,16416,PPN
25,,SING,N1,O2,no,N,25,,47708,16416,PPN
1,,SING,C1,C2,no,N,1,,47765,16419,TH3
2,,DOUB,C2,O2,no,N,2,,47765,16419,TH3
3,,SING,C2,N3,no,N,3,,47765,16419,TH3
4,,SING,N3,C4,no,N,4,,47765,16419,TH3
5,,SING,C4,C5,no,N,5,,47765,16419,TH3
6,,SING,C5,S6,no,N,6,,47765,16419,TH3
7,,SING,S6,C7,no,N,7,,47765,16419,TH3
8,,DOUB,C7,O7,no,N,8,,47765,16419,TH3
9,,SING,C7,C8,no,N,9,,47765,16419,TH3
10,,DOUB,C8,C9,no,N,10,,47765,16419,TH3
11,,SING,C9,C10,no,N,11,,47765,16419,TH3
12,,SING,C10,C11,no,N,12,,47765,16419,TH3
13,,SING,C11,C12,no,N,13,,47765,16419,TH3
14,,SING,C12,C13,no,N,14,,47765,16419,TH3
15,,SING,C13,C14,no,N,15,,47765,16419,TH3
16,,SING,C14,C15,no,N,16,,47765,16419,TH3
17,,SING,C15,C16,no,N,17,,47765,16419,TH3
18,,SING,C16,C17,no,E,18,,47765,16419,TH3
19,,SING,C17,C18,no,N,19,,47765,16419,TH3
20,,SING,C18,C19,no,N,20,,47765,16419,TH3
21,,SING,C19,C20,no,N,21,,47765,16419,TH3
22,,SING,C20,C21,no,N,22,,47765,16419,TH3
23,,SING,C21,C22,no,N,23,,47765,16419,TH3
24,,SING,C1,C7P,no,N,24,,47765,16419,TH3
25,,SING,C7P,N8P,no,N,25,,47765,16419,TH3
26,,SING,N8P,C9P,no,N,26,,47765,16419,TH3
27,,DOUB,C9P,O9P,no,N,27,,47765,16419,TH3
28,,SING,C9P,CAP,no,N,28,,47765,16419,TH3
29,,SING,CAP,OAP,no,N,29,,47765,16419,TH3
30,,SING,CAP,CBP,no,N,30,,47765,16419,TH3
31,,SING,CBP,CDP,no,N,31,,47765,16419,TH3
32,,SING,CBP,CEP,no,N,32,,47765,16419,TH3
33,,SING,CBP,CCP,no,N,33,,47765,16419,TH3
34,,SING,CCP,O6A,no,N,34,,47765,16419,TH3
35,,SING,O6A,P2A,no,N,35,,47765,16419,TH3
36,,DOUB,P2A,O4A,no,N,36,,47765,16419,TH3
37,,SING,P2A,O5A,no,N,37,,47765,16419,TH3
38,,SING,P2A,O3A,no,N,38,,47765,16419,TH3
39,,SING,O3A,P1A,no,N,39,,47765,16419,TH3
40,,DOUB,P1A,O1A,no,N,40,,47765,16419,TH3
41,,SING,P1A,O2A,no,N,41,,47765,16419,TH3
42,,SING,P1A,O5B,no,N,42,,47765,16419,TH3
43,,SING,O5B,C5B,no,N,43,,47765,16419,TH3
44,,SING,C5B,C4B,no,N,44,,47765,16419,TH3
45,,SING,C4B,C3B,no,N,45,,47765,16419,TH3
46,,SING,C3B,O3B,no,N,46,,47765,16419,TH3
47,,SING,O3B,P3B,no,N,47,,47765,16419,TH3
48,,DOUB,P3B,O7A,no,N,48,,47765,16419,TH3
49,,SING,P3B,O9A,no,N,49,,47765,16419,TH3
50,,SING,P3B,O8A,no,N,50,,47765,16419,TH3
51,,SING,C4B,O4B,no,N,51,,47765,16419,TH3
52,,SING,O4B,C1B,no,N,52,,47765,16419,TH3
53,,SING,C1B,N9A,no,N,53,,47765,16419,TH3
54,,SING,C4A,N9A,yes,N,54,,47765,16419,TH3
55,,SING,N9A,C8A,yes,N,55,,47765,16419,TH3
56,,DOUB,C8A,N7A,yes,N,56,,47765,16419,TH3
57,,SING,N7A,C5A,yes,N,57,,47765,16419,TH3
58,,SING,C5A,C6A,yes,N,58,,47765,16419,TH3
59,,SING,C6A,N6A,no,N,59,,47765,16419,TH3
60,,DOUB,C6A,N1A,yes,N,60,,47765,16419,TH3
61,,SING,N1A,C2A,yes,N,61,,47765,16419,TH3
62,,DOUB,C2A,N3A,yes,N,62,,47765,16419,TH3
63,,SING,N3A,C4A,yes,N,63,,47765,16419,TH3
64,,DOUB,C5A,C4A,yes,N,64,,47765,16419,TH3
65,,SING,C3B,C2B,no,N,65,,47765,16419,TH3
66,,SING,C1B,C2B,no,N,66,,47765,16419,TH3
67,,SING,C2B,O2B,no,N,67,,47765,16419,TH3
68,,SING,C1,H1C1,no,N,68,,47765,16419,TH3
69,,SING,C1,H1C2,no,N,69,,47765,16419,TH3
70,,SING,N3,H3,no,N,70,,47765,16419,TH3
71,,SING,C4,H4C1,no,N,71,,47765,16419,TH3
72,,SING,C4,H4C2,no,N,72,,47765,16419,TH3
73,,SING,C5,H5C1,no,N,73,,47765,16419,TH3
74,,SING,C5,H5C2,no,N,74,,47765,16419,TH3
75,,SING,C8,H8,no,N,75,,47765,16419,TH3
76,,SING,C9,H9,no,N,76,,47765,16419,TH3
77,,SING,C10,H101,no,N,77,,47765,16419,TH3
78,,SING,C10,H102,no,N,78,,47765,16419,TH3
79,,SING,C11,H111,no,N,79,,47765,16419,TH3
80,,SING,C11,H112,no,N,80,,47765,16419,TH3
81,,SING,C12,H12A,no,N,81,,47765,16419,TH3
82,,SING,C12,H12B,no,N,82,,47765,16419,TH3
83,,SING,C13,H13A,no,N,83,,47765,16419,TH3
84,,SING,C13,H13B,no,N,84,,47765,16419,TH3
85,,SING,C14,H14A,no,N,85,,47765,16419,TH3
86,,SING,C14,H14B,no,N,86,,47765,16419,TH3
87,,SING,C15,H151,no,N,87,,47765,16419,TH3
88,,SING,C15,H152,no,N,88,,47765,16419,TH3
89,,SING,C16,H161,no,N,89,,47765,16419,TH3
90,,SING,C16,H162,no,N,90,,47765,16419,TH3
91,,SING,C17,H171,no,N,91,,47765,16419,TH3
92,,SING,C17,H172,no,N,92,,47765,16419,TH3
93,,SING,C18,H181,no,N,93,,47765,16419,TH3
94,,SING,C18,H182,no,N,94,,47765,16419,TH3
95,,SING,C19,H191,no,N,95,,47765,16419,TH3
96,,SING,C19,H192,no,N,96,,47765,16419,TH3
97,,SING,C20,H201,no,N,97,,47765,16419,TH3
98,,SING,C20,H202,no,N,98,,47765,16419,TH3
99,,SING,C21,H211,no,N,99,,47765,16419,TH3
100,,SING,C21,H212,no,N,100,,47765,16419,TH3
101,,SING,C7P,H71,no,N,101,,47765,16419,TH3
102,,SING,C7P,H72,no,N,102,,47765,16419,TH3
103,,SING,N8P,HN8,no,N,103,,47765,16419,TH3
104,,SING,CAP,H10,no,N,104,,47765,16419,TH3
105,,SING,OAP,HO1,no,N,105,,47765,16419,TH3
106,,SING,CDP,H131,no,N,106,,47765,16419,TH3
107,,SING,CDP,H132,no,N,107,,47765,16419,TH3
108,,SING,CDP,H133,no,N,108,,47765,16419,TH3
109,,SING,CEP,H141,no,N,109,,47765,16419,TH3
110,,SING,CEP,H142,no,N,110,,47765,16419,TH3
111,,SING,CEP,H143,no,N,111,,47765,16419,TH3
112,,SING,CCP,H121,no,N,112,,47765,16419,TH3
113,,SING,CCP,H122,no,N,113,,47765,16419,TH3
114,,SING,O5A,HOA5,no,N,114,,47765,16419,TH3
115,,SING,O2A,HOA2,no,N,115,,47765,16419,TH3
116,,SING,C5B,H51A,no,N,116,,47765,16419,TH3
117,,SING,C5B,H52A,no,N,117,,47765,16419,TH3
118,,SING,C4B,H4B,no,N,118,,47765,16419,TH3
119,,SING,C3B,H3B,no,N,119,,47765,16419,TH3
120,,SING,O9A,HOA9,no,N,120,,47765,16419,TH3
121,,SING,O8A,HOA8,no,N,121,,47765,16419,TH3
122,,SING,C1B,H1B,no,N,122,,47765,16419,TH3
123,,SING,C8A,H8A,no,N,123,,47765,16419,TH3
124,,SING,N6A,H61A,no,N,124,,47765,16419,TH3
125,,SING,N6A,H62A,no,N,125,,47765,16419,TH3
126,,SING,C2A,H2A,no,N,126,,47765,16419,TH3
127,,SING,C2B,H2B,no,N,127,,47765,16419,TH3
128,,SING,O2B,HO2A,no,N,128,,47765,16419,TH3
129,,SING,C22,H22A,no,N,129,,47765,16419,TH3
130,,SING,C22,H22B,no,N,130,,47765,16419,TH3
131,,SING,C22,H22C,no,N,131,,47765,16419,TH3
1,,SING,C1,C2,no,N,1,,47856,16423,SB3
2,,DOUB,C1,O1,no,N,2,,47856,16423,SB3
3,,SING,C1,O2,no,N,3,,47856,16423,SB3
4,,SING,C2,C3,no,N,4,,47856,16423,SB3
5,,SING,C2,N7,no,N,5,,47856,16423,SB3
6,,SING,C2,H2,no,N,6,,47856,16423,SB3
7,,SING,C3,C4,no,N,7,,47856,16423,SB3
8,,SING,C3,H31,no,N,8,,47856,16423,SB3
9,,SING,C3,H32,no,N,9,,47856,16423,SB3
10,,SING,C4,C5,no,N,10,,47856,16423,SB3
11,,SING,C4,H41,no,N,11,,47856,16423,SB3
12,,SING,C4,H42,no,N,12,,47856,16423,SB3
13,,SING,C5,C6,no,N,13,,47856,16423,SB3
14,,SING,C5,H51,no,N,14,,47856,16423,SB3
15,,SING,C5,H52,no,N,15,,47856,16423,SB3
16,,SING,C6,N7,no,N,16,,47856,16423,SB3
17,,SING,C6,H61,no,N,17,,47856,16423,SB3
18,,SING,C6,H62,no,N,18,,47856,16423,SB3
19,,SING,N7,C8,no,N,19,,47856,16423,SB3
20,,SING,O2,C15,no,N,20,,47856,16423,SB3
21,,DOUB,C8,O3,no,N,21,,47856,16423,SB3
22,,SING,C8,C9,no,N,22,,47856,16423,SB3
23,,DOUB,C9,O4,no,N,23,,47856,16423,SB3
24,,SING,C9,C10,no,N,24,,47856,16423,SB3
25,,SING,C10,C11,no,N,25,,47856,16423,SB3
26,,SING,C10,C13,no,N,26,,47856,16423,SB3
27,,SING,C10,C14,no,N,27,,47856,16423,SB3
28,,SING,C11,C12,no,N,28,,47856,16423,SB3
29,,SING,C11,H111,no,N,29,,47856,16423,SB3
30,,SING,C11,H112,no,N,30,,47856,16423,SB3
31,,SING,C12,H121,no,N,31,,47856,16423,SB3
32,,SING,C12,H122,no,N,32,,47856,16423,SB3
33,,SING,C12,H123,no,N,33,,47856,16423,SB3
34,,SING,C13,H131,no,N,34,,47856,16423,SB3
35,,SING,C13,H132,no,N,35,,47856,16423,SB3
36,,SING,C13,H133,no,N,36,,47856,16423,SB3
37,,SING,C14,H141,no,N,37,,47856,16423,SB3
38,,SING,C14,H142,no,N,38,,47856,16423,SB3
39,,SING,C14,H143,no,N,39,,47856,16423,SB3
40,,SING,C15,C16,no,N,40,,47856,16423,SB3
41,,SING,C15,C24,no,N,41,,47856,16423,SB3
42,,SING,C15,H15,no,N,42,,47856,16423,SB3
43,,SING,C16,C17,no,N,43,,47856,16423,SB3
44,,SING,C16,H161,no,N,44,,47856,16423,SB3
45,,SING,C16,H162,no,N,45,,47856,16423,SB3
46,,SING,C17,C18,no,N,46,,47856,16423,SB3
47,,SING,C17,H171,no,N,47,,47856,16423,SB3
48,,SING,C17,H172,no,N,48,,47856,16423,SB3
49,,DOUB,C18,C19,yes,N,49,,47856,16423,SB3
50,,SING,C18,C23,yes,N,50,,47856,16423,SB3
51,,SING,C19,C20,yes,N,51,,47856,16423,SB3
52,,SING,C19,H19,no,N,52,,47856,16423,SB3
53,,DOUB,C20,C21,yes,N,53,,47856,16423,SB3
54,,SING,C20,H20,no,N,54,,47856,16423,SB3
55,,SING,C21,C22,yes,N,55,,47856,16423,SB3
56,,SING,C21,H21,no,N,56,,47856,16423,SB3
57,,DOUB,C22,C23,yes,N,57,,47856,16423,SB3
58,,SING,C22,H22,no,N,58,,47856,16423,SB3
59,,SING,C23,H23,no,N,59,,47856,16423,SB3
60,,DOUB,C24,C25,yes,N,60,,47856,16423,SB3
61,,SING,C24,C29,yes,N,61,,47856,16423,SB3
62,,SING,C25,C26,yes,N,62,,47856,16423,SB3
63,,SING,C25,H25,no,N,63,,47856,16423,SB3
64,,DOUB,C26,C27,yes,N,64,,47856,16423,SB3
65,,SING,C26,H26,no,N,65,,47856,16423,SB3
66,,SING,C27,C28,yes,N,66,,47856,16423,SB3
67,,SING,C27,H27,no,N,67,,47856,16423,SB3
68,,DOUB,C28,C29,yes,N,68,,47856,16423,SB3
69,,SING,C28,H28,no,N,69,,47856,16423,SB3
70,,SING,C29,H29,no,N,70,,47856,16423,SB3
1,,SING,N,CA,no,N,1,,47917,16426,SEP
2,,SING,N,H,no,N,2,,47917,16426,SEP
3,,SING,N,H2,no,N,3,,47917,16426,SEP
4,,SING,CA,CB,no,N,4,,47917,16426,SEP
5,,SING,CA,C,no,N,5,,47917,16426,SEP
6,,SING,CA,HA,no,N,6,,47917,16426,SEP
7,,SING,CB,OG,no,N,7,,47917,16426,SEP
8,,SING,CB,HB2,no,N,8,,47917,16426,SEP
9,,SING,CB,HB3,no,N,9,,47917,16426,SEP
10,,SING,OG,P,no,N,10,,47917,16426,SEP
11,,DOUB,C,O,no,N,11,,47917,16426,SEP
12,,SING,C,OXT,no,N,12,,47917,16426,SEP
13,,SING,OXT,HXT,no,N,13,,47917,16426,SEP
14,,DOUB,P,O1P,no,N,14,,47917,16426,SEP
15,,SING,P,O2P,no,N,15,,47917,16426,SEP
16,,SING,P,O3P,no,N,16,,47917,16426,SEP
17,,SING,O2P,HOP2,no,N,17,,47917,16426,SEP
18,,SING,O3P,HOP3,no,N,18,,47917,16426,SEP
1,,SING,N,CA,no,N,1,,47918,16426,TPO
2,,SING,N,H,no,N,2,,47918,16426,TPO
3,,SING,N,H2,no,N,3,,47918,16426,TPO
4,,SING,CA,CB,no,N,4,,47918,16426,TPO
5,,SING,CA,C,no,N,5,,47918,16426,TPO
6,,SING,CA,HA,no,N,6,,47918,16426,TPO
7,,SING,CB,CG2,no,N,7,,47918,16426,TPO
8,,SING,CB,OG1,no,N,8,,47918,16426,TPO
9,,SING,CB,HB,no,N,9,,47918,16426,TPO
10,,SING,CG2,HG21,no,N,10,,47918,16426,TPO
11,,SING,CG2,HG22,no,N,11,,47918,16426,TPO
12,,SING,CG2,HG23,no,N,12,,47918,16426,TPO
13,,SING,OG1,P,no,N,13,,47918,16426,TPO
14,,DOUB,P,O1P,no,N,14,,47918,16426,TPO
15,,SING,P,O2P,no,N,15,,47918,16426,TPO
16,,SING,P,O3P,no,N,16,,47918,16426,TPO
17,,SING,O2P,HOP2,no,N,17,,47918,16426,TPO
18,,SING,O3P,HOP3,no,N,18,,47918,16426,TPO
19,,DOUB,C,O,no,N,19,,47918,16426,TPO
20,,SING,C,OXT,no,N,20,,47918,16426,TPO
21,,SING,OXT,HXT,no,N,21,,47918,16426,TPO
1,,DOUB,O,C,no,N,1,,47969,1643,LPD
2,,SING,C,N2,no,N,2,,47969,1643,LPD
3,,SING,C,CA,no,N,3,,47969,1643,LPD
4,,SING,N2,HN21,no,N,4,,47969,1643,LPD
5,,SING,N2,HN22,no,N,5,,47969,1643,LPD
6,,SING,CA,N,no,N,6,,47969,1643,LPD
7,,SING,CA,CB,no,N,7,,47969,1643,LPD
8,,SING,CA,HA,no,N,8,,47969,1643,LPD
9,,SING,N,CD,no,N,9,,47969,1643,LPD
10,,SING,N,H,no,N,10,,47969,1643,LPD
11,,SING,CD,CG,no,N,11,,47969,1643,LPD
12,,SING,CD,HD3,no,N,12,,47969,1643,LPD
13,,SING,CD,HD2,no,N,13,,47969,1643,LPD
14,,SING,CG,CB,no,N,14,,47969,1643,LPD
15,,SING,CG,HG3,no,N,15,,47969,1643,LPD
16,,SING,CG,HG2,no,N,16,,47969,1643,LPD
17,,SING,CB,HB2,no,N,17,,47969,1643,LPD
18,,SING,CB,HB3,no,N,18,,47969,1643,LPD
1,,SING,N,CA,no,N,1,,48004,16431,DAR
2,,SING,N,H,no,N,2,,48004,16431,DAR
3,,SING,N,H2,no,N,3,,48004,16431,DAR
4,,SING,CA,CB,no,N,4,,48004,16431,DAR
5,,SING,CA,C,no,N,5,,48004,16431,DAR
6,,SING,CA,HA,no,N,6,,48004,16431,DAR
7,,SING,CB,CG,no,N,7,,48004,16431,DAR
8,,SING,CB,HB2,no,N,8,,48004,16431,DAR
9,,SING,CB,HB3,no,N,9,,48004,16431,DAR
10,,SING,CG,CD,no,N,10,,48004,16431,DAR
11,,SING,CG,HG2,no,N,11,,48004,16431,DAR
12,,SING,CG,HG3,no,N,12,,48004,16431,DAR
13,,SING,CD,NE,no,N,13,,48004,16431,DAR
14,,SING,CD,HD2,no,N,14,,48004,16431,DAR
15,,SING,CD,HD3,no,N,15,,48004,16431,DAR
16,,SING,NE,CZ,no,N,16,,48004,16431,DAR
17,,SING,NE,HE,no,N,17,,48004,16431,DAR
18,,SING,CZ,NH1,no,N,18,,48004,16431,DAR
19,,DOUB,CZ,NH2,no,N,19,,48004,16431,DAR
20,,SING,NH1,HH11,no,N,20,,48004,16431,DAR
21,,SING,NH1,HH12,no,N,21,,48004,16431,DAR
22,,SING,NH2,HH21,no,N,22,,48004,16431,DAR
23,,SING,NH2,HH22,no,N,23,,48004,16431,DAR
24,,DOUB,C,O,no,N,24,,48004,16431,DAR
25,,SING,C,OXT,no,N,25,,48004,16431,DAR
26,,SING,OXT,HXT,no,N,26,,48004,16431,DAR
1,,SING,N,P,no,N,1,,48005,16431,PPA
2,,SING,N,HN1,no,N,2,,48005,16431,PPA
3,,SING,N,HN2,no,N,3,,48005,16431,PPA
4,,DOUB,P,O1,no,N,4,,48005,16431,PPA
5,,SING,P,O2,no,N,5,,48005,16431,PPA
6,,SING,P,C,no,N,6,,48005,16431,PPA
7,,SING,O2,HO2,no,N,7,,48005,16431,PPA
8,,SING,C,H1,no,N,8,,48005,16431,PPA
9,,SING,C,H2,no,N,9,,48005,16431,PPA
10,,SING,C,H3,no,N,10,,48005,16431,PPA
1,,DOUB,PG,O1G,no,N,1,,48155,16441,ATP
2,,SING,PG,O2G,no,N,2,,48155,16441,ATP
3,,SING,PG,O3G,no,N,3,,48155,16441,ATP
4,,SING,PG,O3B,no,N,4,,48155,16441,ATP
5,,SING,O2G,HOG2,no,N,5,,48155,16441,ATP
6,,SING,O3G,HOG3,no,N,6,,48155,16441,ATP
7,,DOUB,PB,O1B,no,N,7,,48155,16441,ATP
8,,SING,PB,O2B,no,N,8,,48155,16441,ATP
9,,SING,PB,O3B,no,N,9,,48155,16441,ATP
10,,SING,PB,O3A,no,N,10,,48155,16441,ATP
11,,SING,O2B,HOB2,no,N,11,,48155,16441,ATP
12,,DOUB,PA,O1A,no,N,12,,48155,16441,ATP
13,,SING,PA,O2A,no,N,13,,48155,16441,ATP
14,,SING,PA,O3A,no,N,14,,48155,16441,ATP
15,,SING,PA,O5',no,N,15,,48155,16441,ATP
16,,SING,O2A,HOA2,no,N,16,,48155,16441,ATP
17,,SING,O5',C5',no,N,17,,48155,16441,ATP
18,,SING,C5',C4',no,N,18,,48155,16441,ATP
19,,SING,C5',H5'1,no,N,19,,48155,16441,ATP
20,,SING,C5',H5'2,no,N,20,,48155,16441,ATP
21,,SING,C4',O4',no,N,21,,48155,16441,ATP
22,,SING,C4',C3',no,N,22,,48155,16441,ATP
23,,SING,C4',H4',no,N,23,,48155,16441,ATP
24,,SING,O4',C1',no,N,24,,48155,16441,ATP
25,,SING,C3',O3',no,N,25,,48155,16441,ATP
26,,SING,C3',C2',no,N,26,,48155,16441,ATP
27,,SING,C3',H3',no,N,27,,48155,16441,ATP
28,,SING,O3',HO3',no,N,28,,48155,16441,ATP
29,,SING,C2',O2',no,N,29,,48155,16441,ATP
30,,SING,C2',C1',no,N,30,,48155,16441,ATP
31,,SING,C2',H2',no,N,31,,48155,16441,ATP
32,,SING,O2',HO2',no,N,32,,48155,16441,ATP
33,,SING,C1',N9,no,N,33,,48155,16441,ATP
34,,SING,C1',H1',no,N,34,,48155,16441,ATP
35,,SING,N9,C8,yes,N,35,,48155,16441,ATP
36,,SING,N9,C4,yes,N,36,,48155,16441,ATP
37,,DOUB,C8,N7,yes,N,37,,48155,16441,ATP
38,,SING,C8,H8,no,N,38,,48155,16441,ATP
39,,SING,N7,C5,yes,N,39,,48155,16441,ATP
40,,SING,C5,C6,yes,N,40,,48155,16441,ATP
41,,DOUB,C5,C4,yes,N,41,,48155,16441,ATP
42,,SING,C6,N6,no,N,42,,48155,16441,ATP
43,,DOUB,C6,N1,yes,N,43,,48155,16441,ATP
44,,SING,N6,HN61,no,N,44,,48155,16441,ATP
45,,SING,N6,HN62,no,N,45,,48155,16441,ATP
46,,SING,N1,C2,yes,N,46,,48155,16441,ATP
47,,DOUB,C2,N3,yes,N,47,,48155,16441,ATP
48,,SING,C2,H2,no,N,48,,48155,16441,ATP
49,,SING,N3,C4,yes,N,49,,48155,16441,ATP
1,,SING,FE,NA,,,,,48197,16443,HEM_ox
2,,SING,FE,NB,,,,,48197,16443,HEM_ox
3,,SING,FE,NC,,,,,48197,16443,HEM_ox
4,,SING,FE,ND,,,,,48197,16443,HEM_ox
5,,DOUB,CHA,C1A,,,,,48197,16443,HEM_ox
6,,SING,CHA,C4D,,,,,48197,16443,HEM_ox
7,,SING,CHA,HHA,,,,,48197,16443,HEM_ox
8,,DOUB,CHB,C4A,,,,,48197,16443,HEM_ox
9,,SING,CHB,C1B,,,,,48197,16443,HEM_ox
10,,SING,CHB,HHB,,,,,48197,16443,HEM_ox
11,,DOUB,CHC,C4B,,,,,48197,16443,HEM_ox
12,,SING,CHC,C1C,,,,,48197,16443,HEM_ox
13,,SING,CHC,HHC,,,,,48197,16443,HEM_ox
14,,SING,CHD,C4C,,,,,48197,16443,HEM_ox
15,,DOUB,CHD,C1D,,,,,48197,16443,HEM_ox
16,,SING,CHD,HHD,,,,,48197,16443,HEM_ox
17,,SING,NA,C1A,,,,,48197,16443,HEM_ox
18,,SING,NA,C4A,,,,,48197,16443,HEM_ox
19,,SING,C1A,C2A,,,,,48197,16443,HEM_ox
20,,DOUB,C2A,C3A,,,,,48197,16443,HEM_ox
21,,SING,C2A,CAA,,,,,48197,16443,HEM_ox
22,,SING,C3A,C4A,,,,,48197,16443,HEM_ox
23,,SING,C3A,CMA,,,,,48197,16443,HEM_ox
24,,SING,CMA,1HMA,,,,,48197,16443,HEM_ox
25,,SING,CMA,2HMA,,,,,48197,16443,HEM_ox
26,,SING,CMA,3HMA,,,,,48197,16443,HEM_ox
27,,SING,CAA,CBA,,,,,48197,16443,HEM_ox
28,,SING,CAA,1HAA,,,,,48197,16443,HEM_ox
29,,SING,CAA,2HAA,,,,,48197,16443,HEM_ox
30,,SING,CBA,CGA,,,,,48197,16443,HEM_ox
31,,SING,CBA,1HBA,,,,,48197,16443,HEM_ox
32,,SING,CBA,2HBA,,,,,48197,16443,HEM_ox
33,,DOUB,CGA,O1A,,,,,48197,16443,HEM_ox
34,,SING,CGA,O2A,,,,,48197,16443,HEM_ox
35,,SING,O2A,H2A,,,,,48197,16443,HEM_ox
36,,DOUB,NB,C1B,,,,,48197,16443,HEM_ox
37,,SING,NB,C4B,,,,,48197,16443,HEM_ox
38,,SING,C1B,C2B,,,,,48197,16443,HEM_ox
39,,DOUB,C2B,C3B,,,,,48197,16443,HEM_ox
40,,SING,C2B,CMB,,,,,48197,16443,HEM_ox
41,,SING,C3B,C4B,,,,,48197,16443,HEM_ox
42,,SING,C3B,CAB,,,,,48197,16443,HEM_ox
43,,SING,CMB,1HMB,,,,,48197,16443,HEM_ox
44,,SING,CMB,2HMB,,,,,48197,16443,HEM_ox
45,,SING,CMB,3HMB,,,,,48197,16443,HEM_ox
46,,DOUB,CAB,CBB,,,,,48197,16443,HEM_ox
47,,SING,CAB,HAB,,,,,48197,16443,HEM_ox
48,,SING,CBB,1HBB,,,,,48197,16443,HEM_ox
49,,SING,CBB,2HBB,,,,,48197,16443,HEM_ox
50,,SING,NC,C1C,,,,,48197,16443,HEM_ox
51,,SING,NC,C4C,,,,,48197,16443,HEM_ox
52,,DOUB,C1C,C2C,,,,,48197,16443,HEM_ox
53,,SING,C2C,C3C,,,,,48197,16443,HEM_ox
54,,SING,C2C,CMC,,,,,48197,16443,HEM_ox
55,,DOUB,C3C,C4C,,,,,48197,16443,HEM_ox
56,,SING,C3C,CAC,,,,,48197,16443,HEM_ox
57,,SING,CMC,1HMC,,,,,48197,16443,HEM_ox
58,,SING,CMC,2HMC,,,,,48197,16443,HEM_ox
59,,SING,CMC,3HMC,,,,,48197,16443,HEM_ox
60,,DOUB,CAC,CBC,,,,,48197,16443,HEM_ox
61,,SING,CAC,HAC,,,,,48197,16443,HEM_ox
62,,SING,CBC,1HBC,,,,,48197,16443,HEM_ox
63,,SING,CBC,2HBC,,,,,48197,16443,HEM_ox
64,,SING,ND,C1D,,,,,48197,16443,HEM_ox
65,,DOUB,ND,C4D,,,,,48197,16443,HEM_ox
66,,SING,C1D,C2D,,,,,48197,16443,HEM_ox
67,,DOUB,C2D,C3D,,,,,48197,16443,HEM_ox
68,,SING,C2D,CMD,,,,,48197,16443,HEM_ox
69,,SING,C3D,C4D,,,,,48197,16443,HEM_ox
70,,SING,C3D,CAD,,,,,48197,16443,HEM_ox
71,,SING,CMD,1HMD,,,,,48197,16443,HEM_ox
72,,SING,CMD,2HMD,,,,,48197,16443,HEM_ox
73,,SING,CMD,3HMD,,,,,48197,16443,HEM_ox
74,,SING,CAD,CBD,,,,,48197,16443,HEM_ox
75,,SING,CAD,1HAD,,,,,48197,16443,HEM_ox
76,,SING,CAD,2HAD,,,,,48197,16443,HEM_ox
77,,SING,CBD,CGD,,,,,48197,16443,HEM_ox
78,,SING,CBD,1HBD,,,,,48197,16443,HEM_ox
79,,SING,CBD,2HBD,,,,,48197,16443,HEM_ox
80,,DOUB,CGD,O1D,,,,,48197,16443,HEM_ox
81,,SING,CGD,O2D,,,,,48197,16443,HEM_ox
82,,SING,O2D,H2D,,,,,48197,16443,HEM_ox
1,,DOUB,PB,O1B,no,N,1,,48333,16451,ADP
2,,SING,PB,O2B,no,N,2,,48333,16451,ADP
3,,SING,PB,O3B,no,N,3,,48333,16451,ADP
4,,SING,PB,O3A,no,N,4,,48333,16451,ADP
5,,SING,O2B,HOB2,no,N,5,,48333,16451,ADP
6,,SING,O3B,HOB3,no,N,6,,48333,16451,ADP
7,,DOUB,PA,O1A,no,N,7,,48333,16451,ADP
8,,SING,PA,O2A,no,N,8,,48333,16451,ADP
9,,SING,PA,O3A,no,N,9,,48333,16451,ADP
10,,SING,PA,O5',no,N,10,,48333,16451,ADP
11,,SING,O2A,HOA2,no,N,11,,48333,16451,ADP
12,,SING,O5',C5',no,N,12,,48333,16451,ADP
13,,SING,C5',C4',no,N,13,,48333,16451,ADP
14,,SING,C5',H5'1,no,N,14,,48333,16451,ADP
15,,SING,C5',H5'2,no,N,15,,48333,16451,ADP
16,,SING,C4',O4',no,N,16,,48333,16451,ADP
17,,SING,C4',C3',no,N,17,,48333,16451,ADP
18,,SING,C4',H4',no,N,18,,48333,16451,ADP
19,,SING,O4',C1',no,N,19,,48333,16451,ADP
20,,SING,C3',O3',no,N,20,,48333,16451,ADP
21,,SING,C3',C2',no,N,21,,48333,16451,ADP
22,,SING,C3',H3',no,N,22,,48333,16451,ADP
23,,SING,O3',HO3',no,N,23,,48333,16451,ADP
24,,SING,C2',O2',no,N,24,,48333,16451,ADP
25,,SING,C2',C1',no,N,25,,48333,16451,ADP
26,,SING,C2',H2',no,N,26,,48333,16451,ADP
27,,SING,O2',HO2',no,N,27,,48333,16451,ADP
28,,SING,C1',N9,no,N,28,,48333,16451,ADP
29,,SING,C1',H1',no,N,29,,48333,16451,ADP
30,,SING,N9,C8,yes,N,30,,48333,16451,ADP
31,,SING,N9,C4,yes,N,31,,48333,16451,ADP
32,,DOUB,C8,N7,yes,N,32,,48333,16451,ADP
33,,SING,C8,H8,no,N,33,,48333,16451,ADP
34,,SING,N7,C5,yes,N,34,,48333,16451,ADP
35,,SING,C5,C6,yes,N,35,,48333,16451,ADP
36,,DOUB,C5,C4,yes,N,36,,48333,16451,ADP
37,,SING,C6,N6,no,N,37,,48333,16451,ADP
38,,DOUB,C6,N1,yes,N,38,,48333,16451,ADP
39,,SING,N6,HN61,no,N,39,,48333,16451,ADP
40,,SING,N6,HN62,no,N,40,,48333,16451,ADP
41,,SING,N1,C2,yes,N,41,,48333,16451,ADP
42,,DOUB,C2,N3,yes,N,42,,48333,16451,ADP
43,,SING,C2,H2,no,N,43,,48333,16451,ADP
44,,SING,N3,C4,yes,N,44,,48333,16451,ADP
1,,DOUB,P,O1,no,N,1,,48365,16453,PO4
2,,SING,P,O2,no,N,2,,48365,16453,PO4
3,,SING,P,O3,no,N,3,,48365,16453,PO4
4,,SING,P,O4,no,N,4,,48365,16453,PO4
1,,SING,C1,C2,no,N,1,,48405,16455,GGP
2,,SING,C1,O6,no,N,2,,48405,16455,GGP
3,,SING,C1,C30,no,N,3,,48405,16455,GGP
4,,SING,C1,HC1,no,N,4,,48405,16455,GGP
5,,SING,C2,C3,no,N,5,,48405,16455,GGP
6,,SING,C2,O32,no,N,6,,48405,16455,GGP
7,,SING,C2,HC2,no,N,7,,48405,16455,GGP
44,,SING,C4',H4',,,,,50952,16579,FMN
8,,SING,C3,C4,no,N,8,,48405,16455,GGP
9,,SING,C3,O56,no,N,9,,48405,16455,GGP
10,,SING,C3,HC3,no,N,10,,48405,16455,GGP
11,,SING,C4,C5,no,N,11,,48405,16455,GGP
12,,SING,C4,O44,no,N,12,,48405,16455,GGP
13,,SING,C4,HC4,no,N,13,,48405,16455,GGP
14,,SING,C5,O6,no,N,14,,48405,16455,GGP
15,,SING,C5,O7,no,N,15,,48405,16455,GGP
16,,SING,C5,HC5,no,N,16,,48405,16455,GGP
17,,SING,O7,C8,no,N,17,,48405,16455,GGP
18,,DOUB,C8,O9,no,N,18,,48405,16455,GGP
19,,SING,C8,C10,no,N,19,,48405,16455,GGP
20,,SING,C10,C11,yes,N,20,,48405,16455,GGP
21,,DOUB,C10,C18,yes,N,21,,48405,16455,GGP
22,,DOUB,C11,C12,yes,N,22,,48405,16455,GGP
23,,SING,C11,H11,no,N,23,,48405,16455,GGP
24,,SING,C12,O13,no,N,24,,48405,16455,GGP
25,,SING,C12,C14,yes,N,25,,48405,16455,GGP
26,,SING,O13,H13,no,N,26,,48405,16455,GGP
27,,SING,C14,O15,no,N,27,,48405,16455,GGP
28,,DOUB,C14,C16,yes,N,28,,48405,16455,GGP
29,,SING,O15,H15,no,N,29,,48405,16455,GGP
30,,SING,C16,O17,no,N,30,,48405,16455,GGP
31,,SING,C16,C18,yes,N,31,,48405,16455,GGP
32,,SING,O17,H17,no,N,32,,48405,16455,GGP
33,,SING,C18,H18,no,N,33,,48405,16455,GGP
34,,DOUB,C19,O20,no,N,34,,48405,16455,GGP
35,,SING,C19,C21,no,N,35,,48405,16455,GGP
36,,SING,C19,O31,no,N,36,,48405,16455,GGP
37,,DOUB,C21,C22,yes,N,37,,48405,16455,GGP
38,,SING,C21,C29,yes,N,38,,48405,16455,GGP
39,,SING,C22,C23,yes,N,39,,48405,16455,GGP
40,,SING,C22,H22,no,N,40,,48405,16455,GGP
41,,SING,C23,O24,no,N,41,,48405,16455,GGP
42,,DOUB,C23,C25,yes,N,42,,48405,16455,GGP
43,,SING,O24,H24,no,N,43,,48405,16455,GGP
44,,SING,C25,O26,no,N,44,,48405,16455,GGP
45,,SING,C25,C27,yes,N,45,,48405,16455,GGP
46,,SING,O26,H26,no,N,46,,48405,16455,GGP
47,,SING,C27,O28,no,N,47,,48405,16455,GGP
48,,DOUB,C27,C29,yes,N,48,,48405,16455,GGP
49,,SING,O28,H28,no,N,49,,48405,16455,GGP
50,,SING,C29,H29,no,N,50,,48405,16455,GGP
51,,SING,C30,O31,no,N,51,,48405,16455,GGP
52,,SING,C30,H301,no,N,52,,48405,16455,GGP
53,,SING,C30,H302,no,N,53,,48405,16455,GGP
54,,SING,O32,C33,no,N,54,,48405,16455,GGP
55,,DOUB,C33,O34,no,N,55,,48405,16455,GGP
56,,SING,C33,C35,no,N,56,,48405,16455,GGP
57,,DOUB,C35,C36,yes,N,57,,48405,16455,GGP
58,,SING,C35,C43,yes,N,58,,48405,16455,GGP
59,,SING,C36,C37,yes,N,59,,48405,16455,GGP
60,,SING,C36,H36,no,N,60,,48405,16455,GGP
61,,SING,C37,O38,no,N,61,,48405,16455,GGP
62,,DOUB,C37,C39,yes,N,62,,48405,16455,GGP
63,,SING,O38,H38,no,N,63,,48405,16455,GGP
64,,SING,C39,O40,no,N,64,,48405,16455,GGP
65,,SING,C39,C41,yes,N,65,,48405,16455,GGP
66,,SING,O40,H40,no,N,66,,48405,16455,GGP
67,,SING,C41,O42,no,N,67,,48405,16455,GGP
68,,DOUB,C41,C43,yes,N,68,,48405,16455,GGP
69,,SING,O42,H42,no,N,69,,48405,16455,GGP
70,,SING,C43,H43,no,N,70,,48405,16455,GGP
71,,SING,O44,C45,no,N,71,,48405,16455,GGP
72,,DOUB,C45,O46,no,N,72,,48405,16455,GGP
73,,SING,C45,C47,no,N,73,,48405,16455,GGP
74,,DOUB,C47,C48,yes,N,74,,48405,16455,GGP
75,,SING,C47,C55,yes,N,75,,48405,16455,GGP
76,,SING,C48,C49,yes,N,76,,48405,16455,GGP
77,,SING,C48,H48,no,N,77,,48405,16455,GGP
78,,SING,C49,O50,no,N,78,,48405,16455,GGP
79,,DOUB,C49,C51,yes,N,79,,48405,16455,GGP
80,,SING,O50,H50,no,N,80,,48405,16455,GGP
81,,SING,C51,O52,no,N,81,,48405,16455,GGP
82,,SING,C51,C53,yes,N,82,,48405,16455,GGP
83,,SING,O52,H52,no,N,83,,48405,16455,GGP
84,,SING,C53,O54,no,N,84,,48405,16455,GGP
85,,DOUB,C53,C55,yes,N,85,,48405,16455,GGP
86,,SING,O54,H54,no,N,86,,48405,16455,GGP
87,,SING,C55,H55,no,N,87,,48405,16455,GGP
88,,SING,O56,C57,no,N,88,,48405,16455,GGP
89,,DOUB,C57,O58,no,N,89,,48405,16455,GGP
90,,SING,C57,C59,no,N,90,,48405,16455,GGP
91,,DOUB,C59,C60,yes,N,91,,48405,16455,GGP
92,,SING,C59,C67,yes,N,92,,48405,16455,GGP
93,,SING,C60,C61,yes,N,93,,48405,16455,GGP
94,,SING,C60,H60,no,N,94,,48405,16455,GGP
95,,SING,C61,O62,no,N,95,,48405,16455,GGP
96,,DOUB,C61,C63,yes,N,96,,48405,16455,GGP
97,,SING,O62,H62,no,N,97,,48405,16455,GGP
98,,SING,C63,O64,no,N,98,,48405,16455,GGP
99,,SING,C63,C65,yes,N,99,,48405,16455,GGP
100,,SING,O64,H64,no,N,100,,48405,16455,GGP
101,,SING,C65,O66,no,N,101,,48405,16455,GGP
102,,DOUB,C65,C67,yes,N,102,,48405,16455,GGP
103,,SING,O66,H66,no,N,103,,48405,16455,GGP
104,,SING,C67,H67,no,N,104,,48405,16455,GGP
1,,SING,C1A,C2A,no,N,1,,48465,16457,CE6
2,,SING,C1A,O5A,no,N,2,,48465,16457,CE6
3,,SING,C1A,O1A,no,N,3,,48465,16457,CE6
4,,SING,C1A,H1A,no,N,4,,48465,16457,CE6
5,,SING,C2A,C3A,no,N,5,,48465,16457,CE6
6,,SING,C2A,O2A,no,N,6,,48465,16457,CE6
7,,SING,C2A,H2A,no,N,7,,48465,16457,CE6
8,,SING,C3A,O3A,no,N,8,,48465,16457,CE6
9,,SING,C3A,C4A,no,N,9,,48465,16457,CE6
10,,SING,C3A,H3A,no,N,10,,48465,16457,CE6
11,,SING,C4A,O4A,no,N,11,,48465,16457,CE6
12,,SING,C4A,C5A,no,N,12,,48465,16457,CE6
13,,SING,C4A,H4A,no,N,13,,48465,16457,CE6
14,,SING,C5A,C6A,no,N,14,,48465,16457,CE6
15,,SING,C5A,O5A,no,N,15,,48465,16457,CE6
16,,SING,C5A,H5A,no,N,16,,48465,16457,CE6
17,,SING,C6A,O6A,no,N,17,,48465,16457,CE6
18,,SING,C6A,H6A1,no,N,18,,48465,16457,CE6
19,,SING,C6A,H6A2,no,N,19,,48465,16457,CE6
20,,SING,O2A,HO2A,no,N,20,,48465,16457,CE6
21,,SING,O3A,HO3A,no,N,21,,48465,16457,CE6
22,,SING,O4A,C1B,no,N,22,,48465,16457,CE6
23,,SING,O6A,HO6A,no,N,23,,48465,16457,CE6
24,,SING,C1B,C2B,no,N,24,,48465,16457,CE6
25,,SING,C1B,O5B,no,N,25,,48465,16457,CE6
26,,SING,C1B,H1B,no,N,26,,48465,16457,CE6
27,,SING,C2B,C3B,no,N,27,,48465,16457,CE6
28,,SING,C2B,O2B,no,N,28,,48465,16457,CE6
29,,SING,C2B,H2B,no,N,29,,48465,16457,CE6
30,,SING,C3B,O3B,no,N,30,,48465,16457,CE6
31,,SING,C3B,C4B,no,N,31,,48465,16457,CE6
32,,SING,C3B,H3B,no,N,32,,48465,16457,CE6
33,,SING,C4B,O4B,no,N,33,,48465,16457,CE6
34,,SING,C4B,C5B,no,N,34,,48465,16457,CE6
35,,SING,C4B,H4B,no,N,35,,48465,16457,CE6
36,,SING,C5B,C6B,no,N,36,,48465,16457,CE6
37,,SING,C5B,O5B,no,N,37,,48465,16457,CE6
38,,SING,C5B,H5B,no,N,38,,48465,16457,CE6
39,,SING,C6B,O6B,no,N,39,,48465,16457,CE6
40,,SING,C6B,H6B1,no,N,40,,48465,16457,CE6
41,,SING,C6B,H6B2,no,N,41,,48465,16457,CE6
42,,SING,O2B,HO2B,no,N,42,,48465,16457,CE6
43,,SING,O3B,HO3B,no,N,43,,48465,16457,CE6
44,,SING,O4B,C1C,no,N,44,,48465,16457,CE6
45,,SING,O6B,HO6B,no,N,45,,48465,16457,CE6
46,,SING,C1C,C2C,no,N,46,,48465,16457,CE6
47,,SING,C1C,O5C,no,N,47,,48465,16457,CE6
48,,SING,C1C,H1C,no,N,48,,48465,16457,CE6
49,,SING,C2C,C3C,no,N,49,,48465,16457,CE6
50,,SING,C2C,O2C,no,N,50,,48465,16457,CE6
51,,SING,C2C,H2C,no,N,51,,48465,16457,CE6
52,,SING,C3C,O3C,no,N,52,,48465,16457,CE6
53,,SING,C3C,C4C,no,N,53,,48465,16457,CE6
54,,SING,C3C,H3C,no,N,54,,48465,16457,CE6
55,,SING,C4C,O4C,no,N,55,,48465,16457,CE6
56,,SING,C4C,C5C,no,N,56,,48465,16457,CE6
57,,SING,C4C,H4C,no,N,57,,48465,16457,CE6
58,,SING,C5C,C6C,no,N,58,,48465,16457,CE6
59,,SING,C5C,O5C,no,N,59,,48465,16457,CE6
60,,SING,C5C,H5C,no,N,60,,48465,16457,CE6
61,,SING,C6C,O6C,no,N,61,,48465,16457,CE6
62,,SING,C6C,H6C1,no,N,62,,48465,16457,CE6
63,,SING,C6C,H6C2,no,N,63,,48465,16457,CE6
64,,SING,O2C,HO2C,no,N,64,,48465,16457,CE6
65,,SING,O3C,HO3C,no,N,65,,48465,16457,CE6
66,,SING,O4C,C1D,no,N,66,,48465,16457,CE6
67,,SING,O6C,HO6C,no,N,67,,48465,16457,CE6
68,,SING,C1D,O5D,no,N,68,,48465,16457,CE6
69,,SING,C1D,C2D,no,N,69,,48465,16457,CE6
70,,SING,C1D,H1D,no,N,70,,48465,16457,CE6
71,,SING,C2D,C3D,no,N,71,,48465,16457,CE6
72,,SING,C2D,O2D,no,N,72,,48465,16457,CE6
73,,SING,C2D,H2D,no,N,73,,48465,16457,CE6
74,,SING,C3D,C4D,no,N,74,,48465,16457,CE6
75,,SING,C3D,O3D,no,N,75,,48465,16457,CE6
76,,SING,C3D,H3D,no,N,76,,48465,16457,CE6
77,,SING,C4D,O4D,no,N,77,,48465,16457,CE6
78,,SING,C4D,C5D,no,N,78,,48465,16457,CE6
79,,SING,C4D,H4D,no,N,79,,48465,16457,CE6
80,,SING,C5D,C6D,no,N,80,,48465,16457,CE6
81,,SING,C5D,O5D,no,N,81,,48465,16457,CE6
82,,SING,C5D,H5D,no,N,82,,48465,16457,CE6
83,,SING,C6D,O6D,no,N,83,,48465,16457,CE6
84,,SING,C6D,H6D1,no,N,84,,48465,16457,CE6
85,,SING,C6D,H6D2,no,N,85,,48465,16457,CE6
86,,SING,O2D,HO2D,no,N,86,,48465,16457,CE6
87,,SING,O3D,HO3D,no,N,87,,48465,16457,CE6
88,,SING,O4D,C1E,no,N,88,,48465,16457,CE6
89,,SING,O6D,HO6D,no,N,89,,48465,16457,CE6
90,,SING,O2F,C2F,no,N,90,,48465,16457,CE6
91,,SING,O2F,HO2F,no,N,91,,48465,16457,CE6
92,,SING,C2F,C3F,no,N,92,,48465,16457,CE6
93,,SING,C2F,C1F,no,N,93,,48465,16457,CE6
94,,SING,C2F,H2F,no,N,94,,48465,16457,CE6
95,,SING,C3F,C4F,no,N,95,,48465,16457,CE6
96,,SING,C3F,O3F,no,N,96,,48465,16457,CE6
97,,SING,C3F,H3F,no,N,97,,48465,16457,CE6
98,,SING,O3F,HO3F,no,N,98,,48465,16457,CE6
99,,SING,C4F,O4F,no,N,99,,48465,16457,CE6
100,,SING,C4F,C5F,no,N,100,,48465,16457,CE6
101,,SING,C4F,H4F,no,N,101,,48465,16457,CE6
102,,SING,O4F,HO4F,no,N,102,,48465,16457,CE6
103,,SING,C5F,C6F,no,N,103,,48465,16457,CE6
104,,SING,C5F,O5F,no,N,104,,48465,16457,CE6
105,,SING,C5F,H5F,no,N,105,,48465,16457,CE6
106,,SING,C6F,O6F,no,N,106,,48465,16457,CE6
107,,SING,C6F,H6F1,no,N,107,,48465,16457,CE6
108,,SING,C6F,H6F2,no,N,108,,48465,16457,CE6
109,,SING,O6F,HO6F,no,N,109,,48465,16457,CE6
110,,SING,O5F,C1F,no,N,110,,48465,16457,CE6
111,,SING,C1F,O4E,no,N,111,,48465,16457,CE6
112,,SING,C1F,H1F,no,N,112,,48465,16457,CE6
113,,SING,O4E,C4E,no,N,113,,48465,16457,CE6
114,,SING,C4E,C3E,no,N,114,,48465,16457,CE6
115,,SING,C4E,C5E,no,N,115,,48465,16457,CE6
116,,SING,C4E,H4E,no,N,116,,48465,16457,CE6
117,,SING,C5E,C6E,no,N,117,,48465,16457,CE6
118,,SING,C5E,O5E,no,N,118,,48465,16457,CE6
119,,SING,C5E,H5E,no,N,119,,48465,16457,CE6
120,,SING,O5E,C1E,no,N,120,,48465,16457,CE6
121,,SING,C6E,O6E,no,N,121,,48465,16457,CE6
122,,SING,C6E,H6E1,no,N,122,,48465,16457,CE6
123,,SING,C6E,H6E2,no,N,123,,48465,16457,CE6
124,,SING,O6E,HO6E,no,N,124,,48465,16457,CE6
125,,SING,C3E,O3E,no,N,125,,48465,16457,CE6
126,,SING,C3E,C2E,no,N,126,,48465,16457,CE6
127,,SING,C3E,H3E,no,N,127,,48465,16457,CE6
128,,SING,O3E,HO3E,no,N,128,,48465,16457,CE6
129,,SING,C2E,O2E,no,N,129,,48465,16457,CE6
130,,SING,C2E,C1E,no,N,130,,48465,16457,CE6
131,,SING,C2E,H2E,no,N,131,,48465,16457,CE6
132,,SING,O2E,HO2E,no,N,132,,48465,16457,CE6
133,,SING,C1E,H1E,no,N,133,,48465,16457,CE6
134,,SING,O1A,HO1A,no,N,134,,48465,16457,CE6
1,,SING,C1,C2,no,N,1,,48487,16458,CHO
2,,SING,C1,C10,no,N,2,,48487,16458,CHO
3,,SING,C1,H11,no,N,3,,48487,16458,CHO
4,,SING,C1,H12,no,N,4,,48487,16458,CHO
5,,SING,C2,C3,no,N,5,,48487,16458,CHO
6,,SING,C2,H21,no,N,6,,48487,16458,CHO
7,,SING,C2,H22,no,N,7,,48487,16458,CHO
8,,SING,C3,O3,no,N,8,,48487,16458,CHO
9,,SING,C3,C4,no,N,9,,48487,16458,CHO
10,,SING,C3,H3,no,N,10,,48487,16458,CHO
11,,SING,O3,HO3,no,N,11,,48487,16458,CHO
12,,SING,C4,C5,no,N,12,,48487,16458,CHO
13,,SING,C4,H41,no,N,13,,48487,16458,CHO
14,,SING,C4,H42,no,N,14,,48487,16458,CHO
15,,SING,C5,C6,no,N,15,,48487,16458,CHO
16,,SING,C5,C10,no,N,16,,48487,16458,CHO
17,,SING,C5,H5,no,N,17,,48487,16458,CHO
18,,SING,C6,C7,no,N,18,,48487,16458,CHO
19,,SING,C6,H61,no,N,19,,48487,16458,CHO
20,,SING,C6,H62,no,N,20,,48487,16458,CHO
21,,SING,C7,O7,no,N,21,,48487,16458,CHO
22,,SING,C7,C8,no,N,22,,48487,16458,CHO
23,,SING,C7,H7,no,N,23,,48487,16458,CHO
24,,SING,O7,HO7,no,N,24,,48487,16458,CHO
25,,SING,C8,C9,no,N,25,,48487,16458,CHO
26,,SING,C8,C14,no,N,26,,48487,16458,CHO
27,,SING,C8,H8,no,N,27,,48487,16458,CHO
28,,SING,C9,C10,no,N,28,,48487,16458,CHO
29,,SING,C9,C11,no,N,29,,48487,16458,CHO
30,,SING,C9,H9,no,N,30,,48487,16458,CHO
31,,SING,C10,C19,no,N,31,,48487,16458,CHO
32,,SING,C11,C12,no,N,32,,48487,16458,CHO
33,,SING,C11,H111,no,N,33,,48487,16458,CHO
34,,SING,C11,H112,no,N,34,,48487,16458,CHO
35,,SING,C12,C13,no,N,35,,48487,16458,CHO
36,,SING,C12,H121,no,N,36,,48487,16458,CHO
37,,SING,C12,H122,no,N,37,,48487,16458,CHO
38,,SING,C13,C14,no,N,38,,48487,16458,CHO
39,,SING,C13,C17,no,N,39,,48487,16458,CHO
40,,SING,C13,C18,no,N,40,,48487,16458,CHO
41,,SING,C14,C15,no,N,41,,48487,16458,CHO
42,,SING,C14,H14,no,N,42,,48487,16458,CHO
43,,SING,C15,C16,no,N,43,,48487,16458,CHO
44,,SING,C15,H151,no,N,44,,48487,16458,CHO
45,,SING,C15,H152,no,N,45,,48487,16458,CHO
46,,SING,C16,C17,no,N,46,,48487,16458,CHO
47,,SING,C16,H161,no,N,47,,48487,16458,CHO
48,,SING,C16,H162,no,N,48,,48487,16458,CHO
49,,SING,C17,C20,no,N,49,,48487,16458,CHO
50,,SING,C17,H17,no,N,50,,48487,16458,CHO
51,,SING,C18,H181,no,N,51,,48487,16458,CHO
52,,SING,C18,H182,no,N,52,,48487,16458,CHO
53,,SING,C18,H183,no,N,53,,48487,16458,CHO
54,,SING,C19,H191,no,N,54,,48487,16458,CHO
55,,SING,C19,H192,no,N,55,,48487,16458,CHO
56,,SING,C19,H193,no,N,56,,48487,16458,CHO
57,,SING,C20,C21,no,N,57,,48487,16458,CHO
58,,SING,C20,C22,no,N,58,,48487,16458,CHO
59,,SING,C20,H20,no,N,59,,48487,16458,CHO
60,,SING,C21,H211,no,N,60,,48487,16458,CHO
61,,SING,C21,H212,no,N,61,,48487,16458,CHO
62,,SING,C21,H213,no,N,62,,48487,16458,CHO
63,,SING,C22,C23,no,N,63,,48487,16458,CHO
64,,SING,C22,H221,no,N,64,,48487,16458,CHO
65,,SING,C22,H222,no,N,65,,48487,16458,CHO
66,,SING,C23,C24,no,N,66,,48487,16458,CHO
67,,SING,C23,H231,no,N,67,,48487,16458,CHO
68,,SING,C23,H232,no,N,68,,48487,16458,CHO
69,,DOUB,C24,O24,no,N,69,,48487,16458,CHO
70,,SING,C24,N25,no,N,70,,48487,16458,CHO
71,,SING,N25,C26,no,N,71,,48487,16458,CHO
72,,SING,N25,HN,no,N,72,,48487,16458,CHO
73,,SING,C26,C27,no,N,73,,48487,16458,CHO
74,,SING,C26,H261,no,N,74,,48487,16458,CHO
75,,SING,C26,H262,no,N,75,,48487,16458,CHO
76,,DOUB,C27,OT1,no,N,76,,48487,16458,CHO
77,,SING,C27,OT2,no,N,77,,48487,16458,CHO
78,,SING,OT2,HOT,no,N,78,,48487,16458,CHO
1,,SING,FE,NA,no,N,1,,48528,1646,HEC
2,,SING,FE,NB,no,N,2,,48528,1646,HEC
3,,SING,FE,NC,no,N,3,,48528,1646,HEC
4,,SING,FE,ND,no,N,4,,48528,1646,HEC
5,,DOUB,CHA,C1A,no,N,5,,48528,1646,HEC
6,,SING,CHA,C4D,no,N,6,,48528,1646,HEC
7,,SING,CHA,HHA,no,N,7,,48528,1646,HEC
8,,DOUB,CHB,C4A,no,N,8,,48528,1646,HEC
9,,SING,CHB,C1B,no,N,9,,48528,1646,HEC
10,,SING,CHB,HHB,no,N,10,,48528,1646,HEC
11,,DOUB,CHC,C4B,no,N,11,,48528,1646,HEC
12,,SING,CHC,C1C,no,N,12,,48528,1646,HEC
13,,SING,CHC,HHC,no,N,13,,48528,1646,HEC
14,,DOUB,CHD,C4C,no,N,14,,48528,1646,HEC
15,,SING,CHD,C1D,no,N,15,,48528,1646,HEC
16,,SING,CHD,HHD,no,N,16,,48528,1646,HEC
17,,SING,NA,C1A,yes,N,17,,48528,1646,HEC
18,,SING,NA,C4A,yes,N,18,,48528,1646,HEC
19,,SING,C1A,C2A,yes,N,19,,48528,1646,HEC
20,,DOUB,C2A,C3A,yes,N,20,,48528,1646,HEC
21,,SING,C2A,CAA,no,N,21,,48528,1646,HEC
22,,SING,C3A,C4A,yes,N,22,,48528,1646,HEC
23,,SING,C3A,CMA,no,N,23,,48528,1646,HEC
24,,SING,CMA,HMA1,no,N,24,,48528,1646,HEC
25,,SING,CMA,HMA2,no,N,25,,48528,1646,HEC
26,,SING,CMA,HMA3,no,N,26,,48528,1646,HEC
27,,SING,CAA,CBA,no,N,27,,48528,1646,HEC
28,,SING,CAA,HAA1,no,N,28,,48528,1646,HEC
29,,SING,CAA,HAA2,no,N,29,,48528,1646,HEC
30,,SING,CBA,CGA,no,N,30,,48528,1646,HEC
31,,SING,CBA,HBA1,no,N,31,,48528,1646,HEC
32,,SING,CBA,HBA2,no,N,32,,48528,1646,HEC
33,,DOUB,CGA,O1A,no,N,33,,48528,1646,HEC
34,,SING,CGA,O2A,no,N,34,,48528,1646,HEC
35,,SING,O2A,H2A,no,N,35,,48528,1646,HEC
36,,SING,NB,C1B,yes,N,36,,48528,1646,HEC
37,,SING,NB,C4B,yes,N,37,,48528,1646,HEC
38,,DOUB,C1B,C2B,yes,N,38,,48528,1646,HEC
39,,SING,C2B,C3B,yes,N,39,,48528,1646,HEC
40,,SING,C2B,CMB,no,N,40,,48528,1646,HEC
41,,SING,C3B,C4B,yes,N,41,,48528,1646,HEC
42,,DOUB,C3B,CAB,no,E,42,,48528,1646,HEC
43,,SING,CMB,HMB1,no,N,43,,48528,1646,HEC
44,,SING,CMB,HMB2,no,N,44,,48528,1646,HEC
45,,SING,CMB,HMB3,no,N,45,,48528,1646,HEC
46,,SING,CAB,CBB,no,N,46,,48528,1646,HEC
47,,SING,CAB,HAB,no,N,47,,48528,1646,HEC
48,,SING,CBB,HBB1,no,N,48,,48528,1646,HEC
49,,SING,CBB,HBB2,no,N,49,,48528,1646,HEC
50,,SING,CBB,HBB3,no,N,50,,48528,1646,HEC
51,,SING,NC,C1C,yes,N,51,,48528,1646,HEC
52,,SING,NC,C4C,yes,N,52,,48528,1646,HEC
53,,DOUB,C1C,C2C,yes,N,53,,48528,1646,HEC
54,,SING,C2C,C3C,yes,N,54,,48528,1646,HEC
55,,SING,C2C,CMC,no,N,55,,48528,1646,HEC
56,,SING,C3C,C4C,yes,N,56,,48528,1646,HEC
57,,DOUB,C3C,CAC,no,E,57,,48528,1646,HEC
58,,SING,CMC,HMC1,no,N,58,,48528,1646,HEC
59,,SING,CMC,HMC2,no,N,59,,48528,1646,HEC
60,,SING,CMC,HMC3,no,N,60,,48528,1646,HEC
61,,SING,CAC,CBC,no,N,61,,48528,1646,HEC
62,,SING,CAC,HAC,no,N,62,,48528,1646,HEC
63,,SING,CBC,HBC1,no,N,63,,48528,1646,HEC
64,,SING,CBC,HBC2,no,N,64,,48528,1646,HEC
65,,SING,CBC,HBC3,no,N,65,,48528,1646,HEC
66,,SING,ND,C1D,yes,N,66,,48528,1646,HEC
67,,SING,ND,C4D,yes,N,67,,48528,1646,HEC
68,,DOUB,C1D,C2D,yes,N,68,,48528,1646,HEC
69,,SING,C2D,C3D,yes,N,69,,48528,1646,HEC
70,,SING,C2D,CMD,no,N,70,,48528,1646,HEC
71,,DOUB,C3D,C4D,yes,N,71,,48528,1646,HEC
72,,SING,C3D,CAD,no,N,72,,48528,1646,HEC
73,,SING,CMD,HMD1,no,N,73,,48528,1646,HEC
74,,SING,CMD,HMD2,no,N,74,,48528,1646,HEC
75,,SING,CMD,HMD3,no,N,75,,48528,1646,HEC
76,,SING,CAD,CBD,no,N,76,,48528,1646,HEC
77,,SING,CAD,HAD1,no,N,77,,48528,1646,HEC
78,,SING,CAD,HAD2,no,N,78,,48528,1646,HEC
79,,SING,CBD,CGD,no,N,79,,48528,1646,HEC
80,,SING,CBD,HBD1,no,N,80,,48528,1646,HEC
81,,SING,CBD,HBD2,no,N,81,,48528,1646,HEC
82,,DOUB,CGD,O1D,no,N,82,,48528,1646,HEC
83,,SING,CGD,O2D,no,N,83,,48528,1646,HEC
84,,SING,O2D,H2D,no,N,84,,48528,1646,HEC
1,,DOUB,C,O,,,,,48577,16462,ACE
2,,SING,C,CH3,,,,,48577,16462,ACE
3,,SING,C,H,,,,,48577,16462,ACE
4,,SING,CH3,H1,,,,,48577,16462,ACE
5,,SING,CH3,H2,,,,,48577,16462,ACE
6,,SING,CH3,H3,,,,,48577,16462,ACE
1,,DOUB,PB,O1B,no,N,1,,48617,16464,ADP
2,,SING,PB,O2B,no,N,2,,48617,16464,ADP
3,,SING,PB,O3B,no,N,3,,48617,16464,ADP
4,,SING,PB,O3A,no,N,4,,48617,16464,ADP
5,,SING,O2B,HOB2,no,N,5,,48617,16464,ADP
6,,SING,O3B,HOB3,no,N,6,,48617,16464,ADP
7,,DOUB,PA,O1A,no,N,7,,48617,16464,ADP
8,,SING,PA,O2A,no,N,8,,48617,16464,ADP
9,,SING,PA,O3A,no,N,9,,48617,16464,ADP
10,,SING,PA,O5',no,N,10,,48617,16464,ADP
11,,SING,O2A,HOA2,no,N,11,,48617,16464,ADP
12,,SING,O5',C5',no,N,12,,48617,16464,ADP
13,,SING,C5',C4',no,N,13,,48617,16464,ADP
14,,SING,C5',H5'1,no,N,14,,48617,16464,ADP
15,,SING,C5',H5'2,no,N,15,,48617,16464,ADP
16,,SING,C4',O4',no,N,16,,48617,16464,ADP
17,,SING,C4',C3',no,N,17,,48617,16464,ADP
18,,SING,C4',H4',no,N,18,,48617,16464,ADP
19,,SING,O4',C1',no,N,19,,48617,16464,ADP
20,,SING,C3',O3',no,N,20,,48617,16464,ADP
21,,SING,C3',C2',no,N,21,,48617,16464,ADP
22,,SING,C3',H3',no,N,22,,48617,16464,ADP
23,,SING,O3',HO3',no,N,23,,48617,16464,ADP
24,,SING,C2',O2',no,N,24,,48617,16464,ADP
25,,SING,C2',C1',no,N,25,,48617,16464,ADP
26,,SING,C2',H2',no,N,26,,48617,16464,ADP
27,,SING,O2',HO2',no,N,27,,48617,16464,ADP
28,,SING,C1',N9,no,N,28,,48617,16464,ADP
29,,SING,C1',H1',no,N,29,,48617,16464,ADP
30,,SING,N9,C8,yes,N,30,,48617,16464,ADP
31,,SING,N9,C4,yes,N,31,,48617,16464,ADP
32,,DOUB,C8,N7,yes,N,32,,48617,16464,ADP
33,,SING,C8,H8,no,N,33,,48617,16464,ADP
34,,SING,N7,C5,yes,N,34,,48617,16464,ADP
35,,SING,C5,C6,yes,N,35,,48617,16464,ADP
36,,DOUB,C5,C4,yes,N,36,,48617,16464,ADP
37,,SING,C6,N6,no,N,37,,48617,16464,ADP
38,,DOUB,C6,N1,yes,N,38,,48617,16464,ADP
39,,SING,N6,HN61,no,N,39,,48617,16464,ADP
40,,SING,N6,HN62,no,N,40,,48617,16464,ADP
41,,SING,N1,C2,yes,N,41,,48617,16464,ADP
42,,DOUB,C2,N3,yes,N,42,,48617,16464,ADP
43,,SING,C2,H2,no,N,43,,48617,16464,ADP
44,,SING,N3,C4,yes,N,44,,48617,16464,ADP
1,,DOUB,C1,O1,no,N,1,,48619,16464,3PG
2,,SING,C1,O2,no,N,2,,48619,16464,3PG
3,,SING,C1,C2,no,N,3,,48619,16464,3PG
4,,SING,O2,HO2,no,N,4,,48619,16464,3PG
5,,SING,C2,O3,no,N,5,,48619,16464,3PG
6,,SING,C2,C3,no,N,6,,48619,16464,3PG
7,,SING,C2,H2,no,N,7,,48619,16464,3PG
8,,SING,O3,HO3,no,N,8,,48619,16464,3PG
9,,SING,C3,O1P,no,N,9,,48619,16464,3PG
10,,SING,C3,H31,no,N,10,,48619,16464,3PG
11,,SING,C3,H32,no,N,11,,48619,16464,3PG
12,,SING,O1P,P,no,N,12,,48619,16464,3PG
13,,DOUB,P,O2P,no,N,13,,48619,16464,3PG
14,,SING,P,O3P,no,N,14,,48619,16464,3PG
15,,SING,P,O4P,no,N,15,,48619,16464,3PG
16,,SING,O3P,HOP3,no,N,16,,48619,16464,3PG
17,,SING,O4P,HOP4,no,N,17,,48619,16464,3PG
1,,SING,AL,F1,no,N,1,,48620,16464,ALF
2,,SING,AL,F2,no,N,2,,48620,16464,ALF
3,,SING,AL,F3,no,N,3,,48620,16464,ALF
4,,SING,AL,F4,no,N,4,,48620,16464,ALF
1,,SING,FE,NA,no,N,1,,48737,1647,HEC
2,,SING,FE,NB,no,N,2,,48737,1647,HEC
3,,SING,FE,NC,no,N,3,,48737,1647,HEC
4,,SING,FE,ND,no,N,4,,48737,1647,HEC
5,,DOUB,CHA,C1A,no,N,5,,48737,1647,HEC
6,,SING,CHA,C4D,no,N,6,,48737,1647,HEC
7,,SING,CHA,HHA,no,N,7,,48737,1647,HEC
8,,DOUB,CHB,C4A,no,N,8,,48737,1647,HEC
9,,SING,CHB,C1B,no,N,9,,48737,1647,HEC
10,,SING,CHB,HHB,no,N,10,,48737,1647,HEC
11,,DOUB,CHC,C4B,no,N,11,,48737,1647,HEC
12,,SING,CHC,C1C,no,N,12,,48737,1647,HEC
13,,SING,CHC,HHC,no,N,13,,48737,1647,HEC
14,,DOUB,CHD,C4C,no,N,14,,48737,1647,HEC
15,,SING,CHD,C1D,no,N,15,,48737,1647,HEC
16,,SING,CHD,HHD,no,N,16,,48737,1647,HEC
17,,SING,NA,C1A,yes,N,17,,48737,1647,HEC
18,,SING,NA,C4A,yes,N,18,,48737,1647,HEC
19,,SING,C1A,C2A,yes,N,19,,48737,1647,HEC
20,,DOUB,C2A,C3A,yes,N,20,,48737,1647,HEC
21,,SING,C2A,CAA,no,N,21,,48737,1647,HEC
22,,SING,C3A,C4A,yes,N,22,,48737,1647,HEC
23,,SING,C3A,CMA,no,N,23,,48737,1647,HEC
24,,SING,CMA,HMA1,no,N,24,,48737,1647,HEC
25,,SING,CMA,HMA2,no,N,25,,48737,1647,HEC
26,,SING,CMA,HMA3,no,N,26,,48737,1647,HEC
27,,SING,CAA,CBA,no,N,27,,48737,1647,HEC
28,,SING,CAA,HAA1,no,N,28,,48737,1647,HEC
29,,SING,CAA,HAA2,no,N,29,,48737,1647,HEC
30,,SING,CBA,CGA,no,N,30,,48737,1647,HEC
31,,SING,CBA,HBA1,no,N,31,,48737,1647,HEC
32,,SING,CBA,HBA2,no,N,32,,48737,1647,HEC
33,,DOUB,CGA,O1A,no,N,33,,48737,1647,HEC
34,,SING,CGA,O2A,no,N,34,,48737,1647,HEC
35,,SING,O2A,H2A,no,N,35,,48737,1647,HEC
36,,SING,NB,C1B,yes,N,36,,48737,1647,HEC
37,,SING,NB,C4B,yes,N,37,,48737,1647,HEC
38,,DOUB,C1B,C2B,yes,N,38,,48737,1647,HEC
39,,SING,C2B,C3B,yes,N,39,,48737,1647,HEC
40,,SING,C2B,CMB,no,N,40,,48737,1647,HEC
41,,SING,C3B,C4B,yes,N,41,,48737,1647,HEC
42,,DOUB,C3B,CAB,no,E,42,,48737,1647,HEC
43,,SING,CMB,HMB1,no,N,43,,48737,1647,HEC
44,,SING,CMB,HMB2,no,N,44,,48737,1647,HEC
45,,SING,CMB,HMB3,no,N,45,,48737,1647,HEC
46,,SING,CAB,CBB,no,N,46,,48737,1647,HEC
47,,SING,CAB,HAB,no,N,47,,48737,1647,HEC
48,,SING,CBB,HBB1,no,N,48,,48737,1647,HEC
49,,SING,CBB,HBB2,no,N,49,,48737,1647,HEC
50,,SING,CBB,HBB3,no,N,50,,48737,1647,HEC
51,,SING,NC,C1C,yes,N,51,,48737,1647,HEC
52,,SING,NC,C4C,yes,N,52,,48737,1647,HEC
53,,DOUB,C1C,C2C,yes,N,53,,48737,1647,HEC
54,,SING,C2C,C3C,yes,N,54,,48737,1647,HEC
55,,SING,C2C,CMC,no,N,55,,48737,1647,HEC
56,,SING,C3C,C4C,yes,N,56,,48737,1647,HEC
57,,DOUB,C3C,CAC,no,E,57,,48737,1647,HEC
58,,SING,CMC,HMC1,no,N,58,,48737,1647,HEC
59,,SING,CMC,HMC2,no,N,59,,48737,1647,HEC
60,,SING,CMC,HMC3,no,N,60,,48737,1647,HEC
61,,SING,CAC,CBC,no,N,61,,48737,1647,HEC
62,,SING,CAC,HAC,no,N,62,,48737,1647,HEC
63,,SING,CBC,HBC1,no,N,63,,48737,1647,HEC
64,,SING,CBC,HBC2,no,N,64,,48737,1647,HEC
65,,SING,CBC,HBC3,no,N,65,,48737,1647,HEC
66,,SING,ND,C1D,yes,N,66,,48737,1647,HEC
67,,SING,ND,C4D,yes,N,67,,48737,1647,HEC
68,,DOUB,C1D,C2D,yes,N,68,,48737,1647,HEC
69,,SING,C2D,C3D,yes,N,69,,48737,1647,HEC
70,,SING,C2D,CMD,no,N,70,,48737,1647,HEC
71,,DOUB,C3D,C4D,yes,N,71,,48737,1647,HEC
72,,SING,C3D,CAD,no,N,72,,48737,1647,HEC
73,,SING,CMD,HMD1,no,N,73,,48737,1647,HEC
74,,SING,CMD,HMD2,no,N,74,,48737,1647,HEC
75,,SING,CMD,HMD3,no,N,75,,48737,1647,HEC
76,,SING,CAD,CBD,no,N,76,,48737,1647,HEC
77,,SING,CAD,HAD1,no,N,77,,48737,1647,HEC
78,,SING,CAD,HAD2,no,N,78,,48737,1647,HEC
79,,SING,CBD,CGD,no,N,79,,48737,1647,HEC
80,,SING,CBD,HBD1,no,N,80,,48737,1647,HEC
81,,SING,CBD,HBD2,no,N,81,,48737,1647,HEC
82,,DOUB,CGD,O1D,no,N,82,,48737,1647,HEC
83,,SING,CGD,O2D,no,N,83,,48737,1647,HEC
84,,SING,O2D,H2D,no,N,84,,48737,1647,HEC
1,,SING,N1,C2,no,N,1,,49186,16491,JZF
2,,SING,N1,C6,no,N,2,,49186,16491,JZF
3,,SING,N1,C15,no,N,3,,49186,16491,JZF
4,,DOUB,O1,C10,no,N,4,,49186,16491,JZF
5,,DOUB,C2,O2,no,N,5,,49186,16491,JZF
6,,SING,C2,C3,no,N,6,,49186,16491,JZF
7,,SING,C3,C4,no,N,7,,49186,16491,JZF
8,,SING,C3,H13,no,N,8,,49186,16491,JZF
9,,SING,C3,H23,no,N,9,,49186,16491,JZF
10,,DOUB,O3,C6,no,N,10,,49186,16491,JZF
11,,SING,C4,C5,no,N,11,,49186,16491,JZF
12,,SING,C4,C7,no,N,12,,49186,16491,JZF
13,,SING,C4,H4,no,N,13,,49186,16491,JZF
14,,DOUB,O4,C21,no,N,14,,49186,16491,JZF
15,,SING,C5,C6,no,N,15,,49186,16491,JZF
16,,SING,C5,H15,no,N,16,,49186,16491,JZF
17,,SING,C5,H25,no,N,17,,49186,16491,JZF
18,,SING,O5,C16,no,N,18,,49186,16491,JZF
19,,SING,O5,C21,no,N,19,,49186,16491,JZF
20,,SING,C7,C8,no,N,20,,49186,16491,JZF
21,,SING,C7,H17,no,N,21,,49186,16491,JZF
22,,SING,C7,H27,no,N,22,,49186,16491,JZF
23,,SING,C8,C9,no,N,23,,49186,16491,JZF
24,,SING,C8,OH,no,N,24,,49186,16491,JZF
25,,SING,C8,H8,no,N,25,,49186,16491,JZF
26,,SING,C9,C10,no,N,26,,49186,16491,JZF
27,,SING,C9,C14,no,N,27,,49186,16491,JZF
28,,SING,C9,H9,no,N,28,,49186,16491,JZF
29,,SING,OH,H1OH,no,N,29,,49186,16491,JZF
30,,SING,C10,C11,no,N,30,,49186,16491,JZF
31,,SING,C11,C12,no,N,31,,49186,16491,JZF
32,,SING,C11,C18,no,N,32,,49186,16491,JZF
33,,SING,C11,H11,no,N,33,,49186,16491,JZF
34,,SING,C12,C13,no,N,34,,49186,16491,JZF
35,,SING,C12,H112,no,N,35,,49186,16491,JZF
36,,SING,C12,H212,no,N,36,,49186,16491,JZF
37,,SING,C13,C14,no,N,37,,49186,16491,JZF
38,,SING,C13,C19,no,N,38,,49186,16491,JZF
39,,SING,C13,H13A,no,N,39,,49186,16491,JZF
40,,SING,C14,H114,no,N,40,,49186,16491,JZF
41,,SING,C14,H214,no,N,41,,49186,16491,JZF
42,,SING,C15,C21,no,N,42,,49186,16491,JZF
43,,SING,C15,H115,no,N,43,,49186,16491,JZF
44,,SING,C15,H215,no,N,44,,49186,16491,JZF
45,,SING,C16,C17,no,N,45,,49186,16491,JZF
46,,SING,C16,H116,no,N,46,,49186,16491,JZF
47,,SING,C16,H216,no,N,47,,49186,16491,JZF
48,,SING,C17,H117,no,N,48,,49186,16491,JZF
49,,SING,C17,H217,no,N,49,,49186,16491,JZF
50,,SING,C17,H317,no,N,50,,49186,16491,JZF
51,,SING,C18,H118,no,N,51,,49186,16491,JZF
52,,SING,C18,H218,no,N,52,,49186,16491,JZF
53,,SING,C18,H318,no,N,53,,49186,16491,JZF
54,,SING,C19,H119,no,N,54,,49186,16491,JZF
55,,SING,C19,H219,no,N,55,,49186,16491,JZF
56,,SING,C19,H319,no,N,56,,49186,16491,JZF
1,,SING,N,CN,,,,,49211,16492,FME
2,,SING,N,CA,,,,,49211,16492,FME
3,,SING,N,H,,,,,49211,16492,FME
4,,DOUB,CN,O1,,,,,49211,16492,FME
5,,SING,CN,HCN,,,,,49211,16492,FME
6,,SING,CA,CB,,,,,49211,16492,FME
7,,SING,CA,C,,,,,49211,16492,FME
8,,SING,CA,HA,,,,,49211,16492,FME
9,,SING,CB,CG,,,,,49211,16492,FME
10,,SING,CB,HB2,,,,,49211,16492,FME
11,,SING,CB,HB3,,,,,49211,16492,FME
12,,SING,CG,SD,,,,,49211,16492,FME
13,,SING,CG,HG2,,,,,49211,16492,FME
14,,SING,CG,HG3,,,,,49211,16492,FME
15,,SING,SD,CE,,,,,49211,16492,FME
16,,SING,CE,HE1,,,,,49211,16492,FME
17,,SING,CE,HE2,,,,,49211,16492,FME
18,,SING,CE,HE3,,,,,49211,16492,FME
19,,DOUB,C,O,,,,,49211,16492,FME
20,,SING,C,OXT,,,,,49211,16492,FME
21,,SING,OXT,HXT,,,,,49211,16492,FME
1,,SING,C1,O1,no,N,1,,49234,16493,IHS
2,,SING,C1,C2,no,N,2,,49234,16493,IHS
3,,SING,C1,C6,no,N,3,,49234,16493,IHS
4,,SING,C1,HC1,no,N,4,,49234,16493,IHS
5,,SING,O1,S1,no,N,5,,49234,16493,IHS
6,,SING,S1,O4,no,N,6,,49234,16493,IHS
7,,DOUB,S1,O3,no,N,7,,49234,16493,IHS
8,,DOUB,S1,O2,no,N,8,,49234,16493,IHS
9,,SING,O4,HO4,no,N,9,,49234,16493,IHS
10,,SING,C2,O12,no,N,10,,49234,16493,IHS
11,,SING,C2,C3,no,N,11,,49234,16493,IHS
12,,SING,C2,HC2,no,N,12,,49234,16493,IHS
13,,SING,O12,S2,no,N,13,,49234,16493,IHS
14,,DOUB,S2,O32,no,N,14,,49234,16493,IHS
15,,DOUB,S2,O22,no,N,15,,49234,16493,IHS
16,,SING,S2,O42,no,N,16,,49234,16493,IHS
17,,SING,O42,HO42,no,N,17,,49234,16493,IHS
18,,SING,C3,O13,no,N,18,,49234,16493,IHS
19,,SING,C3,C4,no,N,19,,49234,16493,IHS
20,,SING,C3,HC3,no,N,20,,49234,16493,IHS
21,,SING,O13,S3,no,N,21,,49234,16493,IHS
22,,DOUB,S3,O33,no,N,22,,49234,16493,IHS
23,,DOUB,S3,O23,no,N,23,,49234,16493,IHS
24,,SING,S3,O43,no,N,24,,49234,16493,IHS
25,,SING,O43,HO43,no,N,25,,49234,16493,IHS
26,,SING,C4,O14,no,N,26,,49234,16493,IHS
27,,SING,C4,C5,no,N,27,,49234,16493,IHS
28,,SING,C4,HC4,no,N,28,,49234,16493,IHS
29,,SING,O14,S4,no,N,29,,49234,16493,IHS
30,,DOUB,S4,O34,no,N,30,,49234,16493,IHS
31,,DOUB,S4,O24,no,N,31,,49234,16493,IHS
32,,SING,S4,O44,no,N,32,,49234,16493,IHS
33,,SING,O44,HO44,no,N,33,,49234,16493,IHS
34,,SING,C5,O15,no,N,34,,49234,16493,IHS
35,,SING,C5,C6,no,N,35,,49234,16493,IHS
36,,SING,C5,HC5,no,N,36,,49234,16493,IHS
37,,SING,O15,S5,no,N,37,,49234,16493,IHS
38,,DOUB,S5,O35,no,N,38,,49234,16493,IHS
39,,DOUB,S5,O25,no,N,39,,49234,16493,IHS
40,,SING,S5,O45,no,N,40,,49234,16493,IHS
41,,SING,O45,HO45,no,N,41,,49234,16493,IHS
42,,SING,C6,O16,no,N,42,,49234,16493,IHS
43,,SING,C6,HC6,no,N,43,,49234,16493,IHS
44,,SING,O16,S6,no,N,44,,49234,16493,IHS
45,,DOUB,S6,O36,no,N,45,,49234,16493,IHS
46,,DOUB,S6,O26,no,N,46,,49234,16493,IHS
47,,SING,S6,O46,no,N,47,,49234,16493,IHS
48,,SING,O46,HO46,no,N,48,,49234,16493,IHS
1,,DOUB,C1,C2,yes,N,1,,49425,16502,NTS
2,,SING,C1,C9,yes,N,2,,49425,16502,NTS
3,,SING,C1,S1,no,N,3,,49425,16502,NTS
4,,SING,C2,C3,yes,N,4,,49425,16502,NTS
5,,SING,C2,H2,no,N,5,,49425,16502,NTS
6,,DOUB,C3,C4,yes,N,6,,49425,16502,NTS
7,,SING,C3,S3,no,N,7,,49425,16502,NTS
8,,SING,C4,C10,yes,N,8,,49425,16502,NTS
9,,SING,C4,H4,no,N,9,,49425,16502,NTS
10,,DOUB,C5,C6,yes,N,10,,49425,16502,NTS
11,,SING,C5,C10,yes,N,11,,49425,16502,NTS
12,,SING,C5,H5,no,N,12,,49425,16502,NTS
13,,SING,C6,C7,yes,N,13,,49425,16502,NTS
14,,SING,C6,S6,no,N,14,,49425,16502,NTS
15,,DOUB,C7,C8,yes,N,15,,49425,16502,NTS
16,,SING,C7,H7,no,N,16,,49425,16502,NTS
17,,SING,C8,C9,yes,N,17,,49425,16502,NTS
18,,SING,C8,H8,no,N,18,,49425,16502,NTS
19,,DOUB,C9,C10,yes,N,19,,49425,16502,NTS
20,,DOUB,O11,S1,no,N,20,,49425,16502,NTS
21,,DOUB,O12,S1,no,N,21,,49425,16502,NTS
22,,SING,O13,S1,no,N,22,,49425,16502,NTS
23,,DOUB,O31,S3,no,N,23,,49425,16502,NTS
24,,DOUB,O32,S3,no,N,24,,49425,16502,NTS
25,,SING,O33,S3,no,N,25,,49425,16502,NTS
26,,DOUB,O61,S6,no,N,26,,49425,16502,NTS
27,,DOUB,O62,S6,no,N,27,,49425,16502,NTS
28,,SING,O63,S6,no,N,28,,49425,16502,NTS
1,,SING,O23,P24,no,N,1,,49495,16506,PNS
2,,SING,O23,HOP1,no,N,2,,49495,16506,PNS
3,,SING,P24,O25,no,N,3,,49495,16506,PNS
4,,DOUB,P24,O26,no,N,4,,49495,16506,PNS
5,,SING,P24,O27,no,N,5,,49495,16506,PNS
6,,SING,O25,HOP2,no,N,6,,49495,16506,PNS
7,,SING,O27,C28,no,N,7,,49495,16506,PNS
8,,SING,C28,C29,no,N,8,,49495,16506,PNS
9,,SING,C28,H282,no,N,9,,49495,16506,PNS
10,,SING,C28,H281,no,N,10,,49495,16506,PNS
11,,SING,C29,C30,no,N,11,,49495,16506,PNS
12,,SING,C29,C31,no,N,12,,49495,16506,PNS
13,,SING,C29,C32,no,N,13,,49495,16506,PNS
14,,SING,C30,H303,no,N,14,,49495,16506,PNS
15,,SING,C30,H302,no,N,15,,49495,16506,PNS
16,,SING,C30,H301,no,N,16,,49495,16506,PNS
17,,SING,C31,H313,no,N,17,,49495,16506,PNS
18,,SING,C31,H312,no,N,18,,49495,16506,PNS
19,,SING,C31,H311,no,N,19,,49495,16506,PNS
20,,SING,C32,O33,no,N,20,,49495,16506,PNS
21,,SING,C32,C34,no,N,21,,49495,16506,PNS
22,,SING,C32,H32,no,N,22,,49495,16506,PNS
23,,SING,O33,H33,no,N,23,,49495,16506,PNS
24,,DOUB,C34,O35,no,N,24,,49495,16506,PNS
25,,SING,C34,N36,no,N,25,,49495,16506,PNS
26,,SING,N36,C37,no,N,26,,49495,16506,PNS
27,,SING,N36,H36,no,N,27,,49495,16506,PNS
28,,SING,C37,C38,no,N,28,,49495,16506,PNS
29,,SING,C37,H372,no,N,29,,49495,16506,PNS
30,,SING,C37,H371,no,N,30,,49495,16506,PNS
31,,SING,C38,C39,no,N,31,,49495,16506,PNS
32,,SING,C38,H382,no,N,32,,49495,16506,PNS
33,,SING,C38,H381,no,N,33,,49495,16506,PNS
34,,DOUB,C39,O40,no,N,34,,49495,16506,PNS
35,,SING,C39,N41,no,N,35,,49495,16506,PNS
36,,SING,N41,C42,no,N,36,,49495,16506,PNS
37,,SING,N41,H41,no,N,37,,49495,16506,PNS
38,,SING,C42,C43,no,N,38,,49495,16506,PNS
39,,SING,C42,H422,no,N,39,,49495,16506,PNS
40,,SING,C42,H421,no,N,40,,49495,16506,PNS
41,,SING,C43,S44,no,N,41,,49495,16506,PNS
42,,SING,C43,H431,no,N,42,,49495,16506,PNS
43,,SING,C43,H432,no,N,43,,49495,16506,PNS
44,,SING,S44,H44,no,N,44,,49495,16506,PNS
1,,SING,P24,O25,no,N,1,,49839,16524,SXH
2,,SING,O25,HO25,no,N,2,,49839,16524,SXH
3,,DOUB,O26,P24,no,N,3,,49839,16524,SXH
4,,SING,P24,O27,no,N,4,,49839,16524,SXH
5,,SING,P24,O23,no,N,5,,49839,16524,SXH
6,,SING,O23,HO23,no,N,6,,49839,16524,SXH
7,,SING,O27,C28,no,N,7,,49839,16524,SXH
8,,SING,C28,H28A,no,N,8,,49839,16524,SXH
9,,SING,C28,C29,no,N,9,,49839,16524,SXH
10,,SING,C28,H28,no,N,10,,49839,16524,SXH
11,,SING,C31,C29,no,N,11,,49839,16524,SXH
12,,SING,C32,C29,no,N,12,,49839,16524,SXH
13,,SING,C29,C30,no,N,13,,49839,16524,SXH
14,,SING,C30,H30B,no,N,14,,49839,16524,SXH
15,,SING,C30,H30A,no,N,15,,49839,16524,SXH
16,,SING,C30,H30,no,N,16,,49839,16524,SXH
17,,SING,H31B,C31,no,N,17,,49839,16524,SXH
18,,SING,C31,H31,no,N,18,,49839,16524,SXH
19,,SING,C31,H31A,no,N,19,,49839,16524,SXH
20,,SING,O33,C32,no,N,20,,49839,16524,SXH
21,,SING,C32,C34,no,N,21,,49839,16524,SXH
22,,SING,C32,H32,no,N,22,,49839,16524,SXH
23,,SING,HO33,O33,no,N,23,,49839,16524,SXH
24,,DOUB,O35,C34,no,N,24,,49839,16524,SXH
25,,SING,C34,N36,no,N,25,,49839,16524,SXH
26,,SING,N36,C37,no,N,26,,49839,16524,SXH
27,,SING,N36,HN36,no,N,27,,49839,16524,SXH
28,,SING,H37,C37,no,N,28,,49839,16524,SXH
29,,SING,H37A,C37,no,N,29,,49839,16524,SXH
30,,SING,C37,C38,no,N,30,,49839,16524,SXH
31,,SING,C38,H38,no,N,31,,49839,16524,SXH
32,,SING,C38,C39,no,N,32,,49839,16524,SXH
33,,SING,C38,H38A,no,N,33,,49839,16524,SXH
34,,SING,N41,C39,no,N,34,,49839,16524,SXH
35,,DOUB,C39,O40,no,N,35,,49839,16524,SXH
36,,SING,HN41,N41,no,N,36,,49839,16524,SXH
37,,SING,N41,C42,no,N,37,,49839,16524,SXH
38,,SING,C43,C42,no,N,38,,49839,16524,SXH
39,,SING,C42,H42,no,N,39,,49839,16524,SXH
40,,SING,C42,H42A,no,N,40,,49839,16524,SXH
41,,SING,S1,C43,no,N,41,,49839,16524,SXH
42,,SING,C43,H43,no,N,42,,49839,16524,SXH
43,,SING,C43,H43A,no,N,43,,49839,16524,SXH
44,,SING,C1,S1,no,N,44,,49839,16524,SXH
45,,SING,C2,C1,no,N,45,,49839,16524,SXH
46,,DOUB,C1,O1,no,N,46,,49839,16524,SXH
47,,SING,C3,C2,no,N,47,,49839,16524,SXH
48,,SING,H2,C2,no,N,48,,49839,16524,SXH
49,,SING,H2A,C2,no,N,49,,49839,16524,SXH
50,,SING,H3,C3,no,N,50,,49839,16524,SXH
51,,SING,C3,C4,no,N,51,,49839,16524,SXH
52,,SING,C3,H3A,no,N,52,,49839,16524,SXH
53,,SING,C5,C4,no,N,53,,49839,16524,SXH
54,,SING,H4A,C4,no,N,54,,49839,16524,SXH
55,,SING,C4,H4,no,N,55,,49839,16524,SXH
56,,SING,C6,C5,no,N,56,,49839,16524,SXH
57,,SING,C5,H5,no,N,57,,49839,16524,SXH
58,,SING,C5,H5A,no,N,58,,49839,16524,SXH
59,,SING,H6B,C6,no,N,59,,49839,16524,SXH
60,,SING,H6A,C6,no,N,60,,49839,16524,SXH
61,,SING,H6,C6,no,N,61,,49839,16524,SXH
1,,SING,C1,S1,no,N,1,,49858,16525,SYO
2,,SING,C1,C2,no,N,2,,49858,16525,SYO
3,,SING,S1,C43,no,N,3,,49858,16525,SYO
4,,SING,C2,C3,no,N,4,,49858,16525,SYO
5,,DOUB,C3,O3,no,N,5,,49858,16525,SYO
6,,SING,C3,C4,no,N,6,,49858,16525,SYO
7,,SING,C4,C5,no,N,7,,49858,16525,SYO
8,,SING,C5,C6,no,N,8,,49858,16525,SYO
9,,SING,C6,C7,no,N,9,,49858,16525,SYO
10,,SING,C7,C8,no,N,10,,49858,16525,SYO
11,,DOUB,O23,P24,no,N,11,,49858,16525,SYO
12,,SING,P24,O26,no,N,12,,49858,16525,SYO
13,,SING,P24,O27,no,N,13,,49858,16525,SYO
14,,SING,P24,O29,no,N,14,,49858,16525,SYO
15,,SING,O27,C28,no,N,15,,49858,16525,SYO
16,,SING,C28,C29,no,N,16,,49858,16525,SYO
17,,SING,C29,C30,no,N,17,,49858,16525,SYO
18,,SING,C29,C31,no,N,18,,49858,16525,SYO
19,,SING,C29,C32,no,N,19,,49858,16525,SYO
20,,SING,C32,O33,no,N,20,,49858,16525,SYO
21,,SING,C32,C34,no,N,21,,49858,16525,SYO
22,,DOUB,C34,O35,no,N,22,,49858,16525,SYO
23,,SING,C34,N36,no,N,23,,49858,16525,SYO
24,,SING,N36,C37,no,N,24,,49858,16525,SYO
25,,SING,C37,C38,no,N,25,,49858,16525,SYO
26,,SING,C38,C39,no,N,26,,49858,16525,SYO
27,,DOUB,C39,O40,no,N,27,,49858,16525,SYO
28,,SING,C39,N41,no,N,28,,49858,16525,SYO
29,,SING,N41,C42,no,N,29,,49858,16525,SYO
30,,SING,C42,C43,no,N,30,,49858,16525,SYO
31,,SING,C1,H1,no,N,31,,49858,16525,SYO
32,,SING,C1,H1A,no,N,32,,49858,16525,SYO
33,,SING,C2,H2,no,N,33,,49858,16525,SYO
34,,SING,C2,H2A,no,N,34,,49858,16525,SYO
18,,SING,NA,C4A,,,,,52988,16674,HEM
35,,SING,C4,H4,no,N,35,,49858,16525,SYO
36,,SING,C4,H4A,no,N,36,,49858,16525,SYO
37,,SING,C5,H5,no,N,37,,49858,16525,SYO
38,,SING,C5,H5A,no,N,38,,49858,16525,SYO
39,,SING,C6,H6,no,N,39,,49858,16525,SYO
40,,SING,C6,H6A,no,N,40,,49858,16525,SYO
41,,SING,C7,H7,no,N,41,,49858,16525,SYO
42,,SING,C7,H7A,no,N,42,,49858,16525,SYO
43,,SING,C8,H8,no,N,43,,49858,16525,SYO
44,,SING,C8,H8A,no,N,44,,49858,16525,SYO
45,,SING,C8,H8B,no,N,45,,49858,16525,SYO
46,,SING,O26,HO26,no,N,46,,49858,16525,SYO
47,,SING,C28,H28,no,N,47,,49858,16525,SYO
48,,SING,C28,H28A,no,N,48,,49858,16525,SYO
49,,SING,O29,HO29,no,N,49,,49858,16525,SYO
50,,SING,C30,H30,no,N,50,,49858,16525,SYO
51,,SING,C30,H30A,no,N,51,,49858,16525,SYO
52,,SING,C30,H30B,no,N,52,,49858,16525,SYO
53,,SING,C31,H31,no,N,53,,49858,16525,SYO
54,,SING,C31,H31A,no,N,54,,49858,16525,SYO
55,,SING,C31,H31B,no,N,55,,49858,16525,SYO
56,,SING,C32,H32,no,N,56,,49858,16525,SYO
57,,SING,O33,HO33,no,N,57,,49858,16525,SYO
58,,SING,N36,HN36,no,N,58,,49858,16525,SYO
59,,SING,C37,H37,no,N,59,,49858,16525,SYO
60,,SING,C37,H37A,no,N,60,,49858,16525,SYO
61,,SING,C38,H38,no,N,61,,49858,16525,SYO
62,,SING,C38,H38A,no,N,62,,49858,16525,SYO
63,,SING,N41,HN41,no,N,63,,49858,16525,SYO
64,,SING,C42,H42,no,N,64,,49858,16525,SYO
65,,SING,C42,H42A,no,N,65,,49858,16525,SYO
66,,SING,C43,H43,no,N,66,,49858,16525,SYO
67,,SING,C43,H43A,no,N,67,,49858,16525,SYO
1,,SING,CA,CB,no,N,1,,49877,16526,SHO
2,,SING,CA,C,no,N,2,,49877,16526,SHO
3,,SING,CA,HAC1,no,N,3,,49877,16526,SHO
4,,SING,CA,HAC2,no,N,4,,49877,16526,SHO
5,,SING,CB,CG,no,N,5,,49877,16526,SHO
6,,SING,CB,HBC1,no,N,6,,49877,16526,SHO
7,,SING,CB,HBC2,no,N,7,,49877,16526,SHO
8,,SING,CG,CD,no,N,8,,49877,16526,SHO
9,,SING,CG,HGC1,no,N,9,,49877,16526,SHO
10,,SING,CG,HGC2,no,N,10,,49877,16526,SHO
11,,SING,CD,OE1,no,N,11,,49877,16526,SHO
12,,SING,CD,HDC1,no,N,12,,49877,16526,SHO
13,,SING,CD,HDC2,no,N,13,,49877,16526,SHO
14,,SING,C,O,no,N,14,,49877,16526,SHO
15,,DOUB,C,OXT,no,N,15,,49877,16526,SHO
16,,SING,O,H,no,N,16,,49877,16526,SHO
17,,SING,OE1,HE1,no,N,17,,49877,16526,SHO
1,,SING,C1,C5,no,N,1,,49898,16527,SOD
2,,SING,C1,C4,no,N,2,,49898,16527,SOD
3,,SING,C1,C3,no,N,3,,49898,16527,SOD
4,,SING,C1,C2,no,N,4,,49898,16527,SOD
5,,SING,C2,C7,no,N,5,,49898,16527,SOD
6,,SING,C2,C6,no,N,6,,49898,16527,SOD
7,,SING,C2,C8,no,N,7,,49898,16527,SOD
8,,SING,C3,C10,no,N,8,,49898,16527,SOD
9,,SING,C3,C11,no,N,9,,49898,16527,SOD
10,,SING,C3,C9,no,N,10,,49898,16527,SOD
11,,DOUB,C4,C12,no,N,11,,49898,16527,SOD
12,,SING,C4,C13,no,N,12,,49898,16527,SOD
13,,SING,C5,O14,no,N,13,,49898,16527,SOD
14,,DOUB,C5,O15,no,N,14,,49898,16527,SOD
15,,SING,C6,C12,no,N,15,,49898,16527,SOD
16,,SING,C6,H6,no,N,16,,49898,16527,SOD
17,,SING,C6,C10,no,N,17,,49898,16527,SOD
18,,SING,C7,C16,no,N,18,,49898,16527,SOD
19,,SING,C7,H71,no,N,19,,49898,16527,SOD
20,,SING,C7,H72,no,N,20,,49898,16527,SOD
21,,SING,C8,H81,no,N,21,,49898,16527,SOD
22,,SING,C8,H82,no,N,22,,49898,16527,SOD
23,,SING,C8,O17,no,N,23,,49898,16527,SOD
24,,SING,C9,H9,no,N,24,,49898,16527,SOD
25,,SING,C9,C18,no,N,25,,49898,16527,SOD
26,,SING,C9,C16,no,N,26,,49898,16527,SOD
27,,SING,C10,H101,no,N,27,,49898,16527,SOD
28,,SING,C10,H102,no,N,28,,49898,16527,SOD
29,,SING,C11,H11,no,N,29,,49898,16527,SOD
30,,DOUB,C11,O19,no,N,30,,49898,16527,SOD
31,,SING,C12,H12,no,N,31,,49898,16527,SOD
32,,SING,C13,H13,no,N,32,,49898,16527,SOD
33,,SING,C13,C20,no,N,33,,49898,16527,SOD
34,,SING,C13,C21,no,N,34,,49898,16527,SOD
35,,SING,O14,H14,no,N,35,,49898,16527,SOD
36,,SING,C16,C22,no,N,36,,49898,16527,SOD
37,,SING,C16,H16,no,N,37,,49898,16527,SOD
38,,SING,O17,C52,no,N,38,,49898,16527,SOD
39,,SING,C18,H181,no,N,39,,49898,16527,SOD
40,,SING,C18,H182,no,N,40,,49898,16527,SOD
41,,SING,C18,C24,no,N,41,,49898,16527,SOD
42,,SING,C20,H201,no,N,42,,49898,16527,SOD
43,,SING,C20,H202,no,N,43,,49898,16527,SOD
44,,SING,C20,H203,no,N,44,,49898,16527,SOD
45,,SING,C21,H211,no,N,45,,49898,16527,SOD
46,,SING,C21,H212,no,N,46,,49898,16527,SOD
47,,SING,C21,H213,no,N,47,,49898,16527,SOD
48,,SING,C22,C24,no,N,48,,49898,16527,SOD
49,,SING,C22,H22,no,N,49,,49898,16527,SOD
50,,SING,C22,C25,no,N,50,,49898,16527,SOD
51,,SING,C24,H24,no,N,51,,49898,16527,SOD
52,,SING,C24,CL5,no,N,52,,49898,16527,SOD
53,,SING,C25,H251,no,N,53,,49898,16527,SOD
54,,SING,C25,H252,no,N,54,,49898,16527,SOD
55,,SING,C25,H253,no,N,55,,49898,16527,SOD
56,,SING,C52,H52,no,N,56,,49898,16527,SOD
57,,SING,C52,O56,no,N,57,,49898,16527,SOD
58,,SING,C52,C53,no,N,58,,49898,16527,SOD
59,,SING,C53,C54,no,N,59,,49898,16527,SOD
60,,SING,C53,H531,no,N,60,,49898,16527,SOD
61,,SING,C53,H532,no,N,61,,49898,16527,SOD
62,,SING,C54,C64,no,N,62,,49898,16527,SOD
63,,SING,C54,C55,no,N,63,,49898,16527,SOD
64,,SING,C54,H54,no,N,64,,49898,16527,SOD
65,,SING,C55,C56,no,N,65,,49898,16527,SOD
66,,SING,C55,H55,no,N,66,,49898,16527,SOD
67,,SING,C55,O64,no,N,67,,49898,16527,SOD
68,,SING,C56,O56,no,N,68,,49898,16527,SOD
69,,SING,C56,H56,no,N,69,,49898,16527,SOD
70,,SING,C56,C61,no,N,70,,49898,16527,SOD
71,,SING,C61,H611,no,N,71,,49898,16527,SOD
72,,SING,C61,H612,no,N,72,,49898,16527,SOD
73,,SING,C61,H613,no,N,73,,49898,16527,SOD
74,,SING,O64,C65,no,N,74,,49898,16527,SOD
75,,SING,C65,H651,no,N,75,,49898,16527,SOD
76,,SING,C65,H652,no,N,76,,49898,16527,SOD
77,,SING,C65,C64,no,N,77,,49898,16527,SOD
78,,DOUB,C64,C70,no,N,78,,49898,16527,SOD
79,,SING,C70,H701,no,N,79,,49898,16527,SOD
80,,SING,C70,H702,no,N,80,,49898,16527,SOD
1,,SING,P24,O25,no,N,1,,49917,16528,SXO
2,,SING,O25,HO25,no,N,2,,49917,16528,SXO
3,,DOUB,O23,P24,no,N,3,,49917,16528,SXO
4,,SING,P24,O27,no,N,4,,49917,16528,SXO
5,,SING,P24,O26,no,N,5,,49917,16528,SXO
6,,SING,O26,HO26,no,N,6,,49917,16528,SXO
7,,SING,O27,C28,no,N,7,,49917,16528,SXO
8,,SING,C28,H28A,no,N,8,,49917,16528,SXO
9,,SING,C28,C29,no,N,9,,49917,16528,SXO
10,,SING,C28,H28,no,N,10,,49917,16528,SXO
11,,SING,C31,C29,no,N,11,,49917,16528,SXO
12,,SING,C29,C32,no,N,12,,49917,16528,SXO
13,,SING,C29,C30,no,N,13,,49917,16528,SXO
14,,SING,H30,C30,no,N,14,,49917,16528,SXO
15,,SING,C30,H30B,no,N,15,,49917,16528,SXO
16,,SING,C30,H30A,no,N,16,,49917,16528,SXO
17,,SING,H31,C31,no,N,17,,49917,16528,SXO
18,,SING,H31A,C31,no,N,18,,49917,16528,SXO
19,,SING,C31,H31B,no,N,19,,49917,16528,SXO
20,,SING,O33,C32,no,N,20,,49917,16528,SXO
21,,SING,C32,C34,no,N,21,,49917,16528,SXO
22,,SING,C32,H32,no,N,22,,49917,16528,SXO
23,,SING,HO33,O33,no,N,23,,49917,16528,SXO
24,,DOUB,O35,C34,no,N,24,,49917,16528,SXO
25,,SING,C34,N36,no,N,25,,49917,16528,SXO
26,,SING,N36,C37,no,N,26,,49917,16528,SXO
27,,SING,N36,HN36,no,N,27,,49917,16528,SXO
28,,SING,H37,C37,no,N,28,,49917,16528,SXO
29,,SING,C37,H37A,no,N,29,,49917,16528,SXO
30,,SING,C37,C38,no,N,30,,49917,16528,SXO
31,,SING,C39,C38,no,N,31,,49917,16528,SXO
32,,SING,C38,H38A,no,N,32,,49917,16528,SXO
33,,SING,C38,H38,no,N,33,,49917,16528,SXO
34,,SING,N41,C39,no,N,34,,49917,16528,SXO
35,,DOUB,C39,O40,no,N,35,,49917,16528,SXO
36,,SING,HN41,N41,no,N,36,,49917,16528,SXO
37,,SING,C42,N41,no,N,37,,49917,16528,SXO
38,,SING,C43,C42,no,N,38,,49917,16528,SXO
39,,SING,H42,C42,no,N,39,,49917,16528,SXO
40,,SING,C42,H42A,no,N,40,,49917,16528,SXO
41,,SING,S1,C43,no,N,41,,49917,16528,SXO
42,,SING,H43A,C43,no,N,42,,49917,16528,SXO
43,,SING,C43,H43,no,N,43,,49917,16528,SXO
44,,SING,C1,S1,no,N,44,,49917,16528,SXO
45,,SING,C2,C1,no,N,45,,49917,16528,SXO
46,,DOUB,C1,O1,no,N,46,,49917,16528,SXO
47,,SING,C3,C2,no,N,47,,49917,16528,SXO
48,,SING,H2,C2,no,N,48,,49917,16528,SXO
49,,SING,C2,H2A,no,N,49,,49917,16528,SXO
50,,SING,H3A,C3,no,N,50,,49917,16528,SXO
51,,SING,H3,C3,no,N,51,,49917,16528,SXO
52,,SING,C3,C4,no,N,52,,49917,16528,SXO
53,,SING,C5,C4,no,N,53,,49917,16528,SXO
54,,SING,C4,H4,no,N,54,,49917,16528,SXO
55,,SING,C4,H4A,no,N,55,,49917,16528,SXO
56,,SING,H5A,C5,no,N,56,,49917,16528,SXO
57,,SING,H5,C5,no,N,57,,49917,16528,SXO
58,,SING,C5,C6,no,N,58,,49917,16528,SXO
59,,SING,H6,C6,no,N,59,,49917,16528,SXO
60,,SING,C6,C7,no,N,60,,49917,16528,SXO
61,,SING,C6,H6A,no,N,61,,49917,16528,SXO
62,,SING,C8,C7,no,N,62,,49917,16528,SXO
63,,SING,C7,H7,no,N,63,,49917,16528,SXO
64,,SING,C7,H7A,no,N,64,,49917,16528,SXO
65,,SING,H8A,C8,no,N,65,,49917,16528,SXO
66,,SING,H8,C8,no,N,66,,49917,16528,SXO
67,,SING,C8,H8B,no,N,67,,49917,16528,SXO
1,,,,,,,1,,50017,16533,PNS-x
1,,SING,N,CA,no,N,1,,50120,1654,NLE
2,,SING,N,H,no,N,2,,50120,1654,NLE
3,,SING,N,HN2,no,N,3,,50120,1654,NLE
4,,SING,CA,C,no,N,4,,50120,1654,NLE
5,,SING,CA,CB,no,N,5,,50120,1654,NLE
6,,SING,CA,HA,no,N,6,,50120,1654,NLE
7,,DOUB,C,O,no,N,7,,50120,1654,NLE
8,,SING,C,OXT,no,N,8,,50120,1654,NLE
9,,SING,OXT,HXT,no,N,9,,50120,1654,NLE
10,,SING,CB,CG,no,N,10,,50120,1654,NLE
11,,SING,CB,HB2,no,N,11,,50120,1654,NLE
12,,SING,CB,HB3,no,N,12,,50120,1654,NLE
13,,SING,CG,CD,no,N,13,,50120,1654,NLE
14,,SING,CG,HG2,no,N,14,,50120,1654,NLE
15,,SING,CG,HG3,no,N,15,,50120,1654,NLE
16,,SING,CD,CE,no,N,16,,50120,1654,NLE
17,,SING,CD,HD2,no,N,17,,50120,1654,NLE
18,,SING,CD,HD3,no,N,18,,50120,1654,NLE
19,,SING,CE,HE1,no,N,19,,50120,1654,NLE
20,,SING,CE,HE2,no,N,20,,50120,1654,NLE
21,,SING,CE,HE3,no,N,21,,50120,1654,NLE
1,,SING,N,CA,no,N,1,,50307,1655,NLE
2,,SING,N,H,no,N,2,,50307,1655,NLE
3,,SING,N,HN2,no,N,3,,50307,1655,NLE
4,,SING,CA,C,no,N,4,,50307,1655,NLE
5,,SING,CA,CB,no,N,5,,50307,1655,NLE
6,,SING,CA,HA,no,N,6,,50307,1655,NLE
7,,DOUB,C,O,no,N,7,,50307,1655,NLE
8,,SING,C,OXT,no,N,8,,50307,1655,NLE
9,,SING,OXT,HXT,no,N,9,,50307,1655,NLE
10,,SING,CB,CG,no,N,10,,50307,1655,NLE
11,,SING,CB,HB2,no,N,11,,50307,1655,NLE
12,,SING,CB,HB3,no,N,12,,50307,1655,NLE
13,,SING,CG,CD,no,N,13,,50307,1655,NLE
14,,SING,CG,HG2,no,N,14,,50307,1655,NLE
15,,SING,CG,HG3,no,N,15,,50307,1655,NLE
16,,SING,CD,CE,no,N,16,,50307,1655,NLE
17,,SING,CD,HD2,no,N,17,,50307,1655,NLE
18,,SING,CD,HD3,no,N,18,,50307,1655,NLE
19,,SING,CE,HE1,no,N,19,,50307,1655,NLE
20,,SING,CE,HE2,no,N,20,,50307,1655,NLE
21,,SING,CE,HE3,no,N,21,,50307,1655,NLE
1,,SING,N,CA,no,N,1,,50335,16551,SEP
2,,SING,N,H,no,N,2,,50335,16551,SEP
3,,SING,N,H2,no,N,3,,50335,16551,SEP
4,,SING,CA,CB,no,N,4,,50335,16551,SEP
5,,SING,CA,C,no,N,5,,50335,16551,SEP
6,,SING,CA,HA,no,N,6,,50335,16551,SEP
7,,SING,CB,OG,no,N,7,,50335,16551,SEP
8,,SING,CB,HB2,no,N,8,,50335,16551,SEP
9,,SING,CB,HB3,no,N,9,,50335,16551,SEP
10,,SING,OG,P,no,N,10,,50335,16551,SEP
11,,DOUB,C,O,no,N,11,,50335,16551,SEP
12,,SING,C,OXT,no,N,12,,50335,16551,SEP
13,,SING,OXT,HXT,no,N,13,,50335,16551,SEP
14,,DOUB,P,O1P,no,N,14,,50335,16551,SEP
15,,SING,P,O2P,no,N,15,,50335,16551,SEP
16,,SING,P,O3P,no,N,16,,50335,16551,SEP
17,,SING,O2P,HOP2,no,N,17,,50335,16551,SEP
18,,SING,O3P,HOP3,no,N,18,,50335,16551,SEP
1,,SING,O1,C1,no,N,1,,50663,16566,G3P
2,,SING,C1,C2,no,N,2,,50663,16566,G3P
3,,SING,C2,O2,no,N,3,,50663,16566,G3P
4,,SING,C2,C3,no,N,4,,50663,16566,G3P
5,,SING,C3,O1P,no,N,5,,50663,16566,G3P
6,,SING,O1P,P,no,N,6,,50663,16566,G3P
7,,SING,O4P,P,no,N,7,,50663,16566,G3P
8,,DOUB,O2P,P,no,N,8,,50663,16566,G3P
9,,SING,O3P,P,no,N,9,,50663,16566,G3P
10,,SING,O1,HO1,no,N,10,,50663,16566,G3P
11,,SING,C1,H11,no,N,11,,50663,16566,G3P
12,,SING,C1,H12,no,N,12,,50663,16566,G3P
13,,SING,C2,H2,no,N,13,,50663,16566,G3P
14,,SING,O2,HO2,no,N,14,,50663,16566,G3P
15,,SING,C3,H31,no,N,15,,50663,16566,G3P
16,,SING,C3,H32,no,N,16,,50663,16566,G3P
17,,SING,O3P,HOP3,no,N,17,,50663,16566,G3P
18,,SING,O4P,HOP4,no,N,18,,50663,16566,G3P
1,,SING,N1,C2,,,,,50952,16579,FMN
2,,DOUB,N1,C10,,,,,50952,16579,FMN
3,,DOUB,C2,O2,,,,,50952,16579,FMN
4,,SING,C2,N3,,,,,50952,16579,FMN
5,,SING,N3,C4,,,,,50952,16579,FMN
6,,SING,N3,HN3,,,,,50952,16579,FMN
7,,DOUB,C4,O4,,,,,50952,16579,FMN
8,,SING,C4,C4A,,,,,50952,16579,FMN
9,,DOUB,C4A,N5,,,,,50952,16579,FMN
10,,SING,C4A,C10,,,,,50952,16579,FMN
11,,SING,N5,C5A,,,,,50952,16579,FMN
12,,DOUB,C5A,C6,,,,,50952,16579,FMN
13,,SING,C5A,C9A,,,,,50952,16579,FMN
14,,SING,C6,C7,,,,,50952,16579,FMN
15,,SING,C6,H6,,,,,50952,16579,FMN
16,,SING,C7,C7M,,,,,50952,16579,FMN
17,,DOUB,C7,C8,,,,,50952,16579,FMN
18,,SING,C7M,HM71,,,,,50952,16579,FMN
19,,SING,C7M,HM72,,,,,50952,16579,FMN
20,,SING,C7M,HM73,,,,,50952,16579,FMN
21,,SING,C8,C8M,,,,,50952,16579,FMN
22,,SING,C8,C9,,,,,50952,16579,FMN
23,,SING,C8M,HM81,,,,,50952,16579,FMN
24,,SING,C8M,HM82,,,,,50952,16579,FMN
25,,SING,C8M,HM83,,,,,50952,16579,FMN
26,,DOUB,C9,C9A,,,,,50952,16579,FMN
27,,SING,C9,H9,,,,,50952,16579,FMN
28,,SING,C9A,N10,,,,,50952,16579,FMN
29,,SING,N10,C10,,,,,50952,16579,FMN
30,,SING,N10,C1',,,,,50952,16579,FMN
31,,SING,C1',C2',,,,,50952,16579,FMN
32,,SING,C1',H1'1,,,,,50952,16579,FMN
33,,SING,C1',H1'2,,,,,50952,16579,FMN
34,,SING,C2',O2',,,,,50952,16579,FMN
35,,SING,C2',C3',,,,,50952,16579,FMN
36,,SING,C2',H2',,,,,50952,16579,FMN
37,,SING,O2',HO2',,,,,50952,16579,FMN
38,,SING,C3',O3',,,,,50952,16579,FMN
39,,SING,C3',C4',,,,,50952,16579,FMN
40,,SING,C3',H3',,,,,50952,16579,FMN
41,,SING,O3',HO3',,,,,50952,16579,FMN
42,,SING,C4',O4',,,,,50952,16579,FMN
43,,SING,C4',C5',,,,,50952,16579,FMN
45,,SING,O4',HO4',,,,,50952,16579,FMN
46,,SING,C5',O5',,,,,50952,16579,FMN
47,,SING,C5',H5'1,,,,,50952,16579,FMN
48,,SING,C5',H5'2,,,,,50952,16579,FMN
49,,SING,O5',P,,,,,50952,16579,FMN
50,,DOUB,P,O1P,,,,,50952,16579,FMN
51,,SING,P,O2P,,,,,50952,16579,FMN
52,,SING,P,O3P,,,,,50952,16579,FMN
53,,SING,O2P,HOP2,,,,,50952,16579,FMN
54,,SING,O3P,HOP3,,,,,50952,16579,FMN
1,,SING,N1,C2,,,,,51432,16599,CZH
2,,DOUB,N1,C9,,,,,51432,16599,CZH
3,,SING,C2,C3,,,,,51432,16599,CZH
4,,SING,C2,C10,,,,,51432,16599,CZH
5,,SING,C2,O33,,,,,51432,16599,CZH
6,,SING,C3,N4,,,,,51432,16599,CZH
7,,DOUB,C3,O18,,,,,51432,16599,CZH
8,,SING,N4,C5,,,,,51432,16599,CZH
9,,SING,N4,C9,,,,,51432,16599,CZH
10,,DOUB,C5,C6,,,,,51432,16599,CZH
11,,SING,C5,H5,,,,,51432,16599,CZH
12,,SING,C6,N7,,,,,51432,16599,CZH
13,,SING,C6,C19,,,,,51432,16599,CZH
14,,DOUB,N7,C8,,,,,51432,16599,CZH
15,,SING,C8,C9,,,,,51432,16599,CZH
16,,SING,C8,C26,,,,,51432,16599,CZH
17,,SING,C10,C11,,,,,51432,16599,CZH
18,,SING,C10,H101,,,,,51432,16599,CZH
19,,SING,C10,H102,,,,,51432,16599,CZH
20,,DOUB,C11,C12,,,,,51432,16599,CZH
21,,SING,C11,C16,,,,,51432,16599,CZH
22,,SING,C12,C13,,,,,51432,16599,CZH
23,,SING,C12,H12,,,,,51432,16599,CZH
24,,DOUB,C13,C14,,,,,51432,16599,CZH
25,,SING,C13,H13,,,,,51432,16599,CZH
26,,SING,C14,C15,,,,,51432,16599,CZH
27,,SING,C14,O17,,,,,51432,16599,CZH
28,,DOUB,C15,C16,,,,,51432,16599,CZH
29,,SING,C15,H15,,,,,51432,16599,CZH
30,,SING,C16,H16,,,,,51432,16599,CZH
31,,SING,O17,H17,,,,,51432,16599,CZH
32,,DOUB,C19,C20,,,,,51432,16599,CZH
33,,SING,C19,C24,,,,,51432,16599,CZH
34,,SING,C20,C21,,,,,51432,16599,CZH
35,,SING,C20,H20,,,,,51432,16599,CZH
36,,DOUB,C21,C22,,,,,51432,16599,CZH
37,,SING,C21,H21,,,,,51432,16599,CZH
38,,SING,C22,C23,,,,,51432,16599,CZH
39,,SING,C22,O25,,,,,51432,16599,CZH
40,,DOUB,C23,C24,,,,,51432,16599,CZH
41,,SING,C23,H23,,,,,51432,16599,CZH
42,,SING,C24,H24,,,,,51432,16599,CZH
43,,SING,O25,H25,,,,,51432,16599,CZH
44,,SING,C26,C27,,,,,51432,16599,CZH
45,,SING,C26,H261,,,,,51432,16599,CZH
46,,SING,C26,H262,,,,,51432,16599,CZH
47,,DOUB,C27,C28,,,,,51432,16599,CZH
48,,SING,C27,C32,,,,,51432,16599,CZH
49,,SING,C28,C29,,,,,51432,16599,CZH
50,,SING,C28,H28,,,,,51432,16599,CZH
51,,DOUB,C29,C30,,,,,51432,16599,CZH
52,,SING,C29,H29,,,,,51432,16599,CZH
53,,SING,C30,C31,,,,,51432,16599,CZH
54,,SING,C30,H30,,,,,51432,16599,CZH
55,,DOUB,C31,C32,,,,,51432,16599,CZH
56,,SING,C31,H31,,,,,51432,16599,CZH
57,,SING,C32,H32,,,,,51432,16599,CZH
58,,SING,O33,O34,,,,,51432,16599,CZH
59,,SING,O34,H34,,,,,51432,16599,CZH
1,,SING,C11,O11,no,N,1,,51535,16604,TOY
2,,SING,C11,C21,no,N,2,,51535,16604,TOY
3,,SING,C11,O51,no,N,3,,51535,16604,TOY
4,,SING,C11,H11,no,N,4,,51535,16604,TOY
5,,SING,O11,C42,no,N,5,,51535,16604,TOY
6,,SING,C21,N21,no,N,6,,51535,16604,TOY
7,,SING,C21,C31,no,N,7,,51535,16604,TOY
8,,SING,C21,H21,no,N,8,,51535,16604,TOY
9,,SING,N21,HN21,no,N,9,,51535,16604,TOY
10,,SING,N21,HN22,no,N,10,,51535,16604,TOY
11,,SING,C31,C41,no,N,11,,51535,16604,TOY
12,,SING,C31,H311,no,N,12,,51535,16604,TOY
13,,SING,C31,H312,no,N,13,,51535,16604,TOY
14,,SING,C41,O41,no,N,14,,51535,16604,TOY
15,,SING,C41,C51,no,N,15,,51535,16604,TOY
16,,SING,C41,H41,no,N,16,,51535,16604,TOY
17,,SING,O41,H41O,no,N,17,,51535,16604,TOY
18,,SING,C51,O51,no,N,18,,51535,16604,TOY
19,,SING,C51,C61,no,N,19,,51535,16604,TOY
20,,SING,C51,H51,no,N,20,,51535,16604,TOY
21,,SING,C61,N61,no,N,21,,51535,16604,TOY
22,,SING,C61,H611,no,N,22,,51535,16604,TOY
23,,SING,C61,H612,no,N,23,,51535,16604,TOY
24,,SING,N61,HN61,no,N,24,,51535,16604,TOY
25,,SING,N61,HN62,no,N,25,,51535,16604,TOY
26,,SING,C12,N12,no,N,26,,51535,16604,TOY
27,,SING,C12,C22,no,N,27,,51535,16604,TOY
28,,SING,C12,C62,no,N,28,,51535,16604,TOY
29,,SING,C12,H12,no,N,29,,51535,16604,TOY
30,,SING,N12,HN11,no,N,30,,51535,16604,TOY
31,,SING,N12,HN12,no,N,31,,51535,16604,TOY
32,,SING,C22,C32,no,N,32,,51535,16604,TOY
33,,SING,C22,H221,no,N,33,,51535,16604,TOY
34,,SING,C22,H222,no,N,34,,51535,16604,TOY
35,,SING,C32,N32,no,N,35,,51535,16604,TOY
36,,SING,C32,C42,no,N,36,,51535,16604,TOY
37,,SING,C32,H32,no,N,37,,51535,16604,TOY
38,,SING,N32,HN1,no,N,38,,51535,16604,TOY
39,,SING,N32,HN2,no,N,39,,51535,16604,TOY
40,,SING,C42,C52,no,N,40,,51535,16604,TOY
41,,SING,C42,H42,no,N,41,,51535,16604,TOY
42,,SING,C52,O52,no,N,42,,51535,16604,TOY
43,,SING,C52,C62,no,N,43,,51535,16604,TOY
44,,SING,C52,H52,no,N,44,,51535,16604,TOY
45,,SING,O52,H52O,no,N,45,,51535,16604,TOY
46,,SING,C62,O62,no,N,46,,51535,16604,TOY
47,,SING,C62,H62,no,N,47,,51535,16604,TOY
48,,SING,O62,C13,no,N,48,,51535,16604,TOY
49,,SING,C13,C23,no,N,49,,51535,16604,TOY
50,,SING,C13,O53,no,N,50,,51535,16604,TOY
51,,SING,C13,H13,no,N,51,,51535,16604,TOY
52,,SING,C23,O23,no,N,52,,51535,16604,TOY
53,,SING,C23,C33,no,N,53,,51535,16604,TOY
54,,SING,C23,H23,no,N,54,,51535,16604,TOY
55,,SING,O23,H23O,no,N,55,,51535,16604,TOY
56,,SING,C33,N33,no,N,56,,51535,16604,TOY
57,,SING,C33,C43,no,N,57,,51535,16604,TOY
58,,SING,C33,H33,no,N,58,,51535,16604,TOY
59,,SING,N33,HN31,no,N,59,,51535,16604,TOY
60,,SING,N33,HN32,no,N,60,,51535,16604,TOY
61,,SING,C43,O43,no,N,61,,51535,16604,TOY
62,,SING,C43,C53,no,N,62,,51535,16604,TOY
63,,SING,C43,H43,no,N,63,,51535,16604,TOY
64,,SING,O43,H43O,no,N,64,,51535,16604,TOY
65,,SING,C53,O53,no,N,65,,51535,16604,TOY
66,,SING,C53,C63,no,N,66,,51535,16604,TOY
67,,SING,C53,H53,no,N,67,,51535,16604,TOY
68,,SING,C63,O63,no,N,68,,51535,16604,TOY
69,,SING,C63,H631,no,N,69,,51535,16604,TOY
70,,SING,C63,H632,no,N,70,,51535,16604,TOY
71,,SING,O63,H63O,no,N,71,,51535,16604,TOY
1,,SING,O1,C1,no,N,1,,51637,16609,RIO
2,,SING,C1,C2,no,N,2,,51637,16609,RIO
3,,SING,C2,O2,no,N,3,,51637,16609,RIO
4,,SING,C2,C17,no,N,4,,51637,16609,RIO
5,,SING,O2,C3,no,N,5,,51637,16609,RIO
6,,SING,C3,O3,no,N,6,,51637,16609,RIO
7,,SING,C3,C16,no,N,7,,51637,16609,RIO
8,,SING,O3,C4,no,N,8,,51637,16609,RIO
9,,SING,C4,C5,no,N,9,,51637,16609,RIO
10,,SING,C4,C9,no,N,10,,51637,16609,RIO
11,,SING,C5,O4,no,N,11,,51637,16609,RIO
12,,SING,C5,C6,no,N,12,,51637,16609,RIO
13,,SING,C6,N1,no,N,13,,51637,16609,RIO
14,,SING,C6,C7,no,N,14,,51637,16609,RIO
15,,SING,C7,C8,no,N,15,,51637,16609,RIO
16,,SING,C8,N2,no,N,16,,51637,16609,RIO
17,,SING,C8,C9,no,N,17,,51637,16609,RIO
18,,SING,C9,O5,no,N,18,,51637,16609,RIO
19,,SING,O5,C10,no,N,19,,51637,16609,RIO
20,,SING,C10,O6,no,N,20,,51637,16609,RIO
21,,SING,C10,C15,no,N,21,,51637,16609,RIO
22,,SING,O6,C11,no,N,22,,51637,16609,RIO
23,,SING,C11,C12,no,N,23,,51637,16609,RIO
24,,SING,C11,C13,no,N,24,,51637,16609,RIO
25,,SING,C12,N3,no,N,25,,51637,16609,RIO
26,,SING,C13,O7,no,N,26,,51637,16609,RIO
27,,SING,C13,C14,no,N,27,,51637,16609,RIO
28,,SING,C14,O8,no,N,28,,51637,16609,RIO
29,,SING,C14,C15,no,N,29,,51637,16609,RIO
30,,SING,C15,N4,no,N,30,,51637,16609,RIO
31,,SING,C16,O9,no,N,31,,51637,16609,RIO
32,,SING,C16,C17,no,N,32,,51637,16609,RIO
33,,SING,C17,O10,no,N,33,,51637,16609,RIO
34,,SING,O1,HO1,no,N,34,,51637,16609,RIO
35,,SING,C1,H1,no,N,35,,51637,16609,RIO
36,,SING,C1,H1A,no,N,36,,51637,16609,RIO
37,,SING,C2,H2,no,N,37,,51637,16609,RIO
38,,SING,C3,H3,no,N,38,,51637,16609,RIO
39,,SING,C4,H4,no,N,39,,51637,16609,RIO
40,,SING,C5,H5,no,N,40,,51637,16609,RIO
41,,SING,O4,HO4,no,N,41,,51637,16609,RIO
42,,SING,C6,H6,no,N,42,,51637,16609,RIO
43,,SING,N1,HN1,no,N,43,,51637,16609,RIO
44,,SING,N1,HN1A,no,N,44,,51637,16609,RIO
45,,SING,C7,H7,no,N,45,,51637,16609,RIO
46,,SING,C7,H7A,no,N,46,,51637,16609,RIO
47,,SING,C8,H8,no,N,47,,51637,16609,RIO
48,,SING,N2,HN2,no,N,48,,51637,16609,RIO
49,,SING,N2,HN2A,no,N,49,,51637,16609,RIO
50,,SING,C9,H9,no,N,50,,51637,16609,RIO
51,,SING,C10,H10,no,N,51,,51637,16609,RIO
52,,SING,C11,H11,no,N,52,,51637,16609,RIO
53,,SING,C12,H12,no,N,53,,51637,16609,RIO
54,,SING,C12,H12A,no,N,54,,51637,16609,RIO
55,,SING,N3,HN3,no,N,55,,51637,16609,RIO
56,,SING,N3,HN3A,no,N,56,,51637,16609,RIO
57,,SING,C13,H13,no,N,57,,51637,16609,RIO
58,,SING,O7,HO7,no,N,58,,51637,16609,RIO
59,,SING,C14,H14,no,N,59,,51637,16609,RIO
60,,SING,O8,HO8,no,N,60,,51637,16609,RIO
61,,SING,C15,H15,no,N,61,,51637,16609,RIO
62,,SING,N4,HN4,no,N,62,,51637,16609,RIO
63,,SING,N4,HN4A,no,N,63,,51637,16609,RIO
64,,SING,C16,H16,no,N,64,,51637,16609,RIO
65,,SING,O9,HO9,no,N,65,,51637,16609,RIO
66,,SING,C17,H17,no,N,66,,51637,16609,RIO
67,,SING,O10,HO10,no,N,67,,51637,16609,RIO
1,,SING,N1,C10,no,N,1,,51719,16612,308
2,,SING,C10,C7,no,N,2,,51719,16612,308
3,,SING,C10,C8,no,N,3,,51719,16612,308
4,,SING,C10,C9,no,N,4,,51719,16612,308
5,,SING,C7,C1,no,N,5,,51719,16612,308
6,,SING,C1,C6,no,N,6,,51719,16612,308
7,,SING,C1,C2,no,N,7,,51719,16612,308
8,,SING,C8,C5,no,N,8,,51719,16612,308
9,,SING,C5,C6,no,N,9,,51719,16612,308
10,,SING,C5,C4,no,N,10,,51719,16612,308
11,,SING,C4,C3,no,N,11,,51719,16612,308
12,,SING,C9,C3,no,N,12,,51719,16612,308
13,,SING,C3,C2,no,N,13,,51719,16612,308
14,,SING,N1,HN1,no,N,14,,51719,16612,308
15,,SING,N1,HN1A,no,N,15,,51719,16612,308
16,,SING,C7,H7,no,N,16,,51719,16612,308
17,,SING,C7,H7A,no,N,17,,51719,16612,308
18,,SING,C1,H1,no,N,18,,51719,16612,308
19,,SING,C8,H8,no,N,19,,51719,16612,308
20,,SING,C8,H8A,no,N,20,,51719,16612,308
21,,SING,C5,H5,no,N,21,,51719,16612,308
22,,SING,C6,H6,no,N,22,,51719,16612,308
23,,SING,C6,H6A,no,N,23,,51719,16612,308
24,,SING,C4,H4,no,N,24,,51719,16612,308
25,,SING,C4,H4A,no,N,25,,51719,16612,308
26,,SING,C9,H9,no,N,26,,51719,16612,308
27,,SING,C9,H9A,no,N,27,,51719,16612,308
28,,SING,C3,H3,no,N,28,,51719,16612,308
29,,SING,C2,H2,no,N,29,,51719,16612,308
30,,SING,C2,H2A,no,N,30,,51719,16612,308
1,,SING,O23,P24,no,N,1,,51952,16624,PNS
2,,SING,O23,HOP1,no,N,2,,51952,16624,PNS
3,,SING,P24,O25,no,N,3,,51952,16624,PNS
4,,DOUB,P24,O26,no,N,4,,51952,16624,PNS
5,,SING,P24,O27,no,N,5,,51952,16624,PNS
6,,SING,O25,HOP2,no,N,6,,51952,16624,PNS
7,,SING,O27,C28,no,N,7,,51952,16624,PNS
8,,SING,C28,C29,no,N,8,,51952,16624,PNS
9,,SING,C28,H282,no,N,9,,51952,16624,PNS
10,,SING,C28,H281,no,N,10,,51952,16624,PNS
11,,SING,C29,C30,no,N,11,,51952,16624,PNS
12,,SING,C29,C31,no,N,12,,51952,16624,PNS
13,,SING,C29,C32,no,N,13,,51952,16624,PNS
14,,SING,C30,H303,no,N,14,,51952,16624,PNS
15,,SING,C30,H302,no,N,15,,51952,16624,PNS
16,,SING,C30,H301,no,N,16,,51952,16624,PNS
17,,SING,C31,H313,no,N,17,,51952,16624,PNS
18,,SING,C31,H312,no,N,18,,51952,16624,PNS
19,,SING,C31,H311,no,N,19,,51952,16624,PNS
20,,SING,C32,O33,no,N,20,,51952,16624,PNS
21,,SING,C32,C34,no,N,21,,51952,16624,PNS
22,,SING,C32,H32,no,N,22,,51952,16624,PNS
23,,SING,O33,H33,no,N,23,,51952,16624,PNS
24,,DOUB,C34,O35,no,N,24,,51952,16624,PNS
25,,SING,C34,N36,no,N,25,,51952,16624,PNS
26,,SING,N36,C37,no,N,26,,51952,16624,PNS
27,,SING,N36,H36,no,N,27,,51952,16624,PNS
28,,SING,C37,C38,no,N,28,,51952,16624,PNS
29,,SING,C37,H372,no,N,29,,51952,16624,PNS
30,,SING,C37,H371,no,N,30,,51952,16624,PNS
31,,SING,C38,C39,no,N,31,,51952,16624,PNS
32,,SING,C38,H382,no,N,32,,51952,16624,PNS
33,,SING,C38,H381,no,N,33,,51952,16624,PNS
34,,DOUB,C39,O40,no,N,34,,51952,16624,PNS
35,,SING,C39,N41,no,N,35,,51952,16624,PNS
36,,SING,N41,C42,no,N,36,,51952,16624,PNS
37,,SING,N41,H41,no,N,37,,51952,16624,PNS
38,,SING,C42,C43,no,N,38,,51952,16624,PNS
39,,SING,C42,H422,no,N,39,,51952,16624,PNS
40,,SING,C42,H421,no,N,40,,51952,16624,PNS
41,,SING,C43,S44,no,N,41,,51952,16624,PNS
42,,SING,C43,H431,no,N,42,,51952,16624,PNS
43,,SING,C43,H432,no,N,43,,51952,16624,PNS
44,,SING,S44,H44,no,N,44,,51952,16624,PNS
1,,SING,N1,C2,no,N,1,,52530,16654,PSU
2,,SING,N1,C6,no,N,2,,52530,16654,PSU
3,,SING,N1,HN1,no,N,3,,52530,16654,PSU
4,,SING,C2,N3,no,N,4,,52530,16654,PSU
5,,DOUB,C2,O2,no,N,5,,52530,16654,PSU
6,,SING,N3,C4,no,N,6,,52530,16654,PSU
7,,SING,N3,HN3,no,N,7,,52530,16654,PSU
8,,SING,C4,C5,no,N,8,,52530,16654,PSU
9,,DOUB,C4,O4,no,N,9,,52530,16654,PSU
10,,DOUB,C5,C6,no,N,10,,52530,16654,PSU
11,,SING,C5,C1',no,N,11,,52530,16654,PSU
12,,SING,C6,H6,no,N,12,,52530,16654,PSU
13,,SING,C1',C2',no,N,13,,52530,16654,PSU
14,,SING,C1',O4',no,N,14,,52530,16654,PSU
15,,SING,C1',H1',no,N,15,,52530,16654,PSU
16,,SING,C2',O2',no,N,16,,52530,16654,PSU
17,,SING,C2',C3',no,N,17,,52530,16654,PSU
18,,SING,C2',H2',no,N,18,,52530,16654,PSU
19,,SING,O2',HO2',no,N,19,,52530,16654,PSU
20,,SING,C3',C4',no,N,20,,52530,16654,PSU
21,,SING,C3',O3',no,N,21,,52530,16654,PSU
22,,SING,C3',H3',no,N,22,,52530,16654,PSU
23,,SING,C4',O4',no,N,23,,52530,16654,PSU
24,,SING,C4',C5',no,N,24,,52530,16654,PSU
25,,SING,C4',H4',no,N,25,,52530,16654,PSU
26,,SING,O3',HO3',no,N,26,,52530,16654,PSU
27,,SING,C5',O5',no,N,27,,52530,16654,PSU
28,,SING,C5',H5',no,N,28,,52530,16654,PSU
29,,SING,C5',H5'',no,N,29,,52530,16654,PSU
30,,SING,O5',P,no,N,30,,52530,16654,PSU
31,,DOUB,P,OP1,no,N,31,,52530,16654,PSU
32,,SING,P,OP2,no,N,32,,52530,16654,PSU
33,,SING,P,OP3,no,N,33,,52530,16654,PSU
34,,SING,OP2,HOP2,no,N,34,,52530,16654,PSU
35,,SING,OP3,HOP3,no,N,35,,52530,16654,PSU
1,,SING,OP3,P,no,N,1,,52531,16654,N
2,,SING,OP3,HOP3,no,N,2,,52531,16654,N
3,,DOUB,P,OP1,no,N,3,,52531,16654,N
4,,SING,P,OP2,no,N,4,,52531,16654,N
5,,SING,P,O5',no,N,5,,52531,16654,N
6,,SING,OP2,HOP2,no,N,6,,52531,16654,N
7,,SING,O5',C5',no,N,7,,52531,16654,N
8,,SING,C5',C4',no,N,8,,52531,16654,N
9,,SING,C5',H5',no,N,9,,52531,16654,N
10,,SING,C5',H5'',no,N,10,,52531,16654,N
11,,SING,C4',O4',no,N,11,,52531,16654,N
12,,SING,C4',C3',no,N,12,,52531,16654,N
13,,SING,C4',H4',no,N,13,,52531,16654,N
14,,SING,O4',C1',no,N,14,,52531,16654,N
15,,SING,C3',O3',no,N,15,,52531,16654,N
16,,SING,C3',C2',no,N,16,,52531,16654,N
17,,SING,C3',H3',no,N,17,,52531,16654,N
18,,SING,O3',HO3',no,N,18,,52531,16654,N
19,,SING,C2',O2',no,N,19,,52531,16654,N
20,,SING,C2',C1',no,N,20,,52531,16654,N
21,,SING,C2',H2',no,N,21,,52531,16654,N
22,,SING,O2',HO2',no,N,22,,52531,16654,N
23,,SING,C1',H1',no,N,23,,52531,16654,N
24,,SING,C1',H1'2,no,N,24,,52531,16654,N
1,,SING,N1,C2,no,N,1,,52554,16655,PSU
2,,SING,N1,C6,no,N,2,,52554,16655,PSU
3,,SING,N1,HN1,no,N,3,,52554,16655,PSU
4,,SING,C2,N3,no,N,4,,52554,16655,PSU
5,,DOUB,C2,O2,no,N,5,,52554,16655,PSU
6,,SING,N3,C4,no,N,6,,52554,16655,PSU
7,,SING,N3,HN3,no,N,7,,52554,16655,PSU
8,,SING,C4,C5,no,N,8,,52554,16655,PSU
9,,DOUB,C4,O4,no,N,9,,52554,16655,PSU
10,,DOUB,C5,C6,no,N,10,,52554,16655,PSU
11,,SING,C5,C1',no,N,11,,52554,16655,PSU
12,,SING,C6,H6,no,N,12,,52554,16655,PSU
13,,SING,C1',C2',no,N,13,,52554,16655,PSU
14,,SING,C1',O4',no,N,14,,52554,16655,PSU
15,,SING,C1',H1',no,N,15,,52554,16655,PSU
16,,SING,C2',O2',no,N,16,,52554,16655,PSU
17,,SING,C2',C3',no,N,17,,52554,16655,PSU
18,,SING,C2',H2',no,N,18,,52554,16655,PSU
19,,SING,O2',HO2',no,N,19,,52554,16655,PSU
20,,SING,C3',C4',no,N,20,,52554,16655,PSU
21,,SING,C3',O3',no,N,21,,52554,16655,PSU
22,,SING,C3',H3',no,N,22,,52554,16655,PSU
23,,SING,C4',O4',no,N,23,,52554,16655,PSU
24,,SING,C4',C5',no,N,24,,52554,16655,PSU
25,,SING,C4',H4',no,N,25,,52554,16655,PSU
26,,SING,O3',HO3',no,N,26,,52554,16655,PSU
27,,SING,C5',O5',no,N,27,,52554,16655,PSU
28,,SING,C5',H5',no,N,28,,52554,16655,PSU
29,,SING,C5',H5'',no,N,29,,52554,16655,PSU
30,,SING,O5',P,no,N,30,,52554,16655,PSU
31,,DOUB,P,OP1,no,N,31,,52554,16655,PSU
32,,SING,P,OP2,no,N,32,,52554,16655,PSU
33,,SING,P,OP3,no,N,33,,52554,16655,PSU
34,,SING,OP2,HOP2,no,N,34,,52554,16655,PSU
35,,SING,OP3,HOP3,no,N,35,,52554,16655,PSU
1,,SING,N,CA,no,N,1,,52686,16659,TPO
2,,SING,N,H,no,N,2,,52686,16659,TPO
3,,SING,N,H2,no,N,3,,52686,16659,TPO
4,,SING,CA,CB,no,N,4,,52686,16659,TPO
5,,SING,CA,C,no,N,5,,52686,16659,TPO
6,,SING,CA,HA,no,N,6,,52686,16659,TPO
7,,SING,CB,CG2,no,N,7,,52686,16659,TPO
8,,SING,CB,OG1,no,N,8,,52686,16659,TPO
9,,SING,CB,HB,no,N,9,,52686,16659,TPO
10,,SING,CG2,HG21,no,N,10,,52686,16659,TPO
11,,SING,CG2,HG22,no,N,11,,52686,16659,TPO
12,,SING,CG2,HG23,no,N,12,,52686,16659,TPO
13,,SING,OG1,P,no,N,13,,52686,16659,TPO
14,,DOUB,P,O1P,no,N,14,,52686,16659,TPO
15,,SING,P,O2P,no,N,15,,52686,16659,TPO
16,,SING,P,O3P,no,N,16,,52686,16659,TPO
17,,SING,O2P,HOP2,no,N,17,,52686,16659,TPO
18,,SING,O3P,HOP3,no,N,18,,52686,16659,TPO
19,,DOUB,C,O,no,N,19,,52686,16659,TPO
20,,SING,C,OXT,no,N,20,,52686,16659,TPO
21,,SING,OXT,HXT,no,N,21,,52686,16659,TPO
1,,SING,N,CA,no,N,1,,52687,16659,SEP
2,,SING,N,H,no,N,2,,52687,16659,SEP
3,,SING,N,H2,no,N,3,,52687,16659,SEP
4,,SING,CA,CB,no,N,4,,52687,16659,SEP
5,,SING,CA,C,no,N,5,,52687,16659,SEP
6,,SING,CA,HA,no,N,6,,52687,16659,SEP
7,,SING,CB,OG,no,N,7,,52687,16659,SEP
8,,SING,CB,HB2,no,N,8,,52687,16659,SEP
9,,SING,CB,HB3,no,N,9,,52687,16659,SEP
10,,SING,OG,P,no,N,10,,52687,16659,SEP
11,,DOUB,C,O,no,N,11,,52687,16659,SEP
12,,SING,C,OXT,no,N,12,,52687,16659,SEP
13,,SING,OXT,HXT,no,N,13,,52687,16659,SEP
14,,DOUB,P,O1P,no,N,14,,52687,16659,SEP
15,,SING,P,O2P,no,N,15,,52687,16659,SEP
16,,SING,P,O3P,no,N,16,,52687,16659,SEP
17,,SING,O2P,HOP2,no,N,17,,52687,16659,SEP
18,,SING,O3P,HOP3,no,N,18,,52687,16659,SEP
1,,SING,N,CA,no,N,1,,52791,16663,DAL
2,,SING,N,H,no,N,2,,52791,16663,DAL
3,,SING,N,H2,no,N,3,,52791,16663,DAL
4,,SING,CA,CB,no,N,4,,52791,16663,DAL
5,,SING,CA,C,no,N,5,,52791,16663,DAL
6,,SING,CA,HA,no,N,6,,52791,16663,DAL
7,,SING,CB,HB1,no,N,7,,52791,16663,DAL
8,,SING,CB,HB2,no,N,8,,52791,16663,DAL
9,,SING,CB,HB3,no,N,9,,52791,16663,DAL
10,,DOUB,C,O,no,N,10,,52791,16663,DAL
11,,SING,C,OXT,no,N,11,,52791,16663,DAL
12,,SING,OXT,HXT,no,N,12,,52791,16663,DAL
1,,SING,C1,O1,no,N,1,,52823,16665,PLM
2,,DOUB,C1,O2,no,N,2,,52823,16665,PLM
3,,SING,C1,C2,no,N,3,,52823,16665,PLM
4,,SING,O1,H,no,N,4,,52823,16665,PLM
5,,SING,C2,C3,no,N,5,,52823,16665,PLM
6,,SING,C2,H21,no,N,6,,52823,16665,PLM
7,,SING,C2,H22,no,N,7,,52823,16665,PLM
8,,SING,C3,C4,no,N,8,,52823,16665,PLM
9,,SING,C3,H31,no,N,9,,52823,16665,PLM
10,,SING,C3,H32,no,N,10,,52823,16665,PLM
11,,SING,C4,C5,no,N,11,,52823,16665,PLM
12,,SING,C4,H41,no,N,12,,52823,16665,PLM
13,,SING,C4,H42,no,N,13,,52823,16665,PLM
14,,SING,C5,C6,no,N,14,,52823,16665,PLM
15,,SING,C5,H51,no,N,15,,52823,16665,PLM
16,,SING,C5,H52,no,N,16,,52823,16665,PLM
17,,SING,C6,C7,no,N,17,,52823,16665,PLM
18,,SING,C6,H61,no,N,18,,52823,16665,PLM
19,,SING,C6,H62,no,N,19,,52823,16665,PLM
20,,SING,C7,C8,no,N,20,,52823,16665,PLM
21,,SING,C7,H71,no,N,21,,52823,16665,PLM
22,,SING,C7,H72,no,N,22,,52823,16665,PLM
23,,SING,C8,C9,no,N,23,,52823,16665,PLM
24,,SING,C8,H81,no,N,24,,52823,16665,PLM
25,,SING,C8,H82,no,N,25,,52823,16665,PLM
26,,SING,C9,CA,no,N,26,,52823,16665,PLM
27,,SING,C9,H91,no,N,27,,52823,16665,PLM
28,,SING,C9,H92,no,N,28,,52823,16665,PLM
29,,SING,CA,CB,no,N,29,,52823,16665,PLM
30,,SING,CA,HA1,no,N,30,,52823,16665,PLM
31,,SING,CA,HA2,no,N,31,,52823,16665,PLM
32,,SING,CB,CC,no,N,32,,52823,16665,PLM
33,,SING,CB,HB1,no,N,33,,52823,16665,PLM
34,,SING,CB,HB2,no,N,34,,52823,16665,PLM
35,,SING,CC,CD,no,N,35,,52823,16665,PLM
36,,SING,CC,HC1,no,N,36,,52823,16665,PLM
37,,SING,CC,HC2,no,N,37,,52823,16665,PLM
38,,SING,CD,CE,no,N,38,,52823,16665,PLM
39,,SING,CD,HD1,no,N,39,,52823,16665,PLM
40,,SING,CD,HD2,no,N,40,,52823,16665,PLM
41,,SING,CE,CF,no,N,41,,52823,16665,PLM
42,,SING,CE,HE1,no,N,42,,52823,16665,PLM
43,,SING,CE,HE2,no,N,43,,52823,16665,PLM
44,,SING,CF,CG,no,N,44,,52823,16665,PLM
45,,SING,CF,HF1,no,N,45,,52823,16665,PLM
46,,SING,CF,HF2,no,N,46,,52823,16665,PLM
47,,SING,CG,HG1,no,N,47,,52823,16665,PLM
48,,SING,CG,HG2,no,N,48,,52823,16665,PLM
49,,SING,CG,HG3,no,N,49,,52823,16665,PLM
1,,DOUB,PB,O1B,no,N,1,,52881,16668,GDP
2,,SING,PB,O2B,no,N,2,,52881,16668,GDP
3,,SING,PB,O3B,no,N,3,,52881,16668,GDP
4,,SING,PB,O3A,no,N,4,,52881,16668,GDP
5,,SING,O2B,HOB2,no,N,5,,52881,16668,GDP
6,,SING,O3B,HOB3,no,N,6,,52881,16668,GDP
7,,SING,O3A,PA,no,N,7,,52881,16668,GDP
8,,DOUB,PA,O1A,no,N,8,,52881,16668,GDP
9,,SING,PA,O2A,no,N,9,,52881,16668,GDP
10,,SING,PA,O5',no,N,10,,52881,16668,GDP
11,,SING,O2A,HOA2,no,N,11,,52881,16668,GDP
12,,SING,O5',C5',no,N,12,,52881,16668,GDP
13,,SING,C5',C4',no,N,13,,52881,16668,GDP
14,,SING,C5',H5',no,N,14,,52881,16668,GDP
15,,SING,C5',H5'',no,N,15,,52881,16668,GDP
16,,SING,C4',O4',no,N,16,,52881,16668,GDP
17,,SING,C4',C3',no,N,17,,52881,16668,GDP
18,,SING,C4',H4',no,N,18,,52881,16668,GDP
19,,SING,O4',C1',no,N,19,,52881,16668,GDP
20,,SING,C3',O3',no,N,20,,52881,16668,GDP
21,,SING,C3',C2',no,N,21,,52881,16668,GDP
22,,SING,C3',H3',no,N,22,,52881,16668,GDP
23,,SING,O3',HO3',no,N,23,,52881,16668,GDP
24,,SING,C2',O2',no,N,24,,52881,16668,GDP
25,,SING,C2',C1',no,N,25,,52881,16668,GDP
26,,SING,C2',H2',no,N,26,,52881,16668,GDP
27,,SING,O2',HO2',no,N,27,,52881,16668,GDP
28,,SING,C1',N9,no,N,28,,52881,16668,GDP
29,,SING,C1',H1',no,N,29,,52881,16668,GDP
30,,SING,N9,C8,yes,N,30,,52881,16668,GDP
31,,SING,N9,C4,yes,N,31,,52881,16668,GDP
32,,DOUB,C8,N7,yes,N,32,,52881,16668,GDP
33,,SING,C8,H8,no,N,33,,52881,16668,GDP
34,,SING,N7,C5,yes,N,34,,52881,16668,GDP
35,,SING,C5,C6,no,N,35,,52881,16668,GDP
36,,DOUB,C5,C4,yes,N,36,,52881,16668,GDP
37,,DOUB,C6,O6,no,N,37,,52881,16668,GDP
38,,SING,C6,N1,no,N,38,,52881,16668,GDP
39,,SING,N1,C2,no,N,39,,52881,16668,GDP
40,,SING,N1,HN1,no,N,40,,52881,16668,GDP
41,,SING,C2,N2,no,N,41,,52881,16668,GDP
42,,DOUB,C2,N3,no,N,42,,52881,16668,GDP
43,,SING,N2,HN21,no,N,43,,52881,16668,GDP
44,,SING,N2,HN22,no,N,44,,52881,16668,GDP
45,,SING,N3,C4,no,N,45,,52881,16668,GDP
1,,SING,FE,NA,,,,,52988,16674,HEM
2,,SING,FE,NB,,,,,52988,16674,HEM
3,,SING,FE,NC,,,,,52988,16674,HEM
4,,SING,FE,ND,,,,,52988,16674,HEM
5,,DOUB,CHA,C1A,,,,,52988,16674,HEM
6,,SING,CHA,C4D,,,,,52988,16674,HEM
7,,SING,CHA,HHA,,,,,52988,16674,HEM
8,,DOUB,CHB,C4A,,,,,52988,16674,HEM
9,,SING,CHB,C1B,,,,,52988,16674,HEM
10,,SING,CHB,HHB,,,,,52988,16674,HEM
11,,DOUB,CHC,C4B,,,,,52988,16674,HEM
12,,SING,CHC,C1C,,,,,52988,16674,HEM
13,,SING,CHC,HHC,,,,,52988,16674,HEM
14,,SING,CHD,C4C,,,,,52988,16674,HEM
15,,DOUB,CHD,C1D,,,,,52988,16674,HEM
16,,SING,CHD,HHD,,,,,52988,16674,HEM
17,,SING,NA,C1A,,,,,52988,16674,HEM
19,,SING,C1A,C2A,,,,,52988,16674,HEM
20,,DOUB,C2A,C3A,,,,,52988,16674,HEM
21,,SING,C2A,CAA,,,,,52988,16674,HEM
22,,SING,C3A,C4A,,,,,52988,16674,HEM
23,,SING,C3A,CMA,,,,,52988,16674,HEM
24,,SING,CMA,HMA1,,,,,52988,16674,HEM
25,,SING,CMA,HMA2,,,,,52988,16674,HEM
26,,SING,CMA,HMA3,,,,,52988,16674,HEM
27,,SING,CAA,CBA,,,,,52988,16674,HEM
28,,SING,CAA,HAA1,,,,,52988,16674,HEM
29,,SING,CAA,HAA2,,,,,52988,16674,HEM
30,,SING,CBA,CGA,,,,,52988,16674,HEM
31,,SING,CBA,HBA1,,,,,52988,16674,HEM
32,,SING,CBA,HBA2,,,,,52988,16674,HEM
33,,DOUB,CGA,O1A,,,,,52988,16674,HEM
34,,SING,CGA,O2A,,,,,52988,16674,HEM
35,,SING,O2A,H2A,,,,,52988,16674,HEM
36,,DOUB,NB,C1B,,,,,52988,16674,HEM
37,,SING,NB,C4B,,,,,52988,16674,HEM
38,,SING,C1B,C2B,,,,,52988,16674,HEM
39,,DOUB,C2B,C3B,,,,,52988,16674,HEM
40,,SING,C2B,CMB,,,,,52988,16674,HEM
41,,SING,C3B,C4B,,,,,52988,16674,HEM
42,,SING,C3B,CAB,,,,,52988,16674,HEM
43,,SING,CMB,HMB1,,,,,52988,16674,HEM
44,,SING,CMB,HMB2,,,,,52988,16674,HEM
45,,SING,CMB,HMB3,,,,,52988,16674,HEM
46,,DOUB,CAB,CBB,,,,,52988,16674,HEM
47,,SING,CAB,HAB,,,,,52988,16674,HEM
48,,SING,CBB,HBB1,,,,,52988,16674,HEM
49,,SING,CBB,HBB2,,,,,52988,16674,HEM
50,,SING,NC,C1C,,,,,52988,16674,HEM
51,,SING,NC,C4C,,,,,52988,16674,HEM
52,,DOUB,C1C,C2C,,,,,52988,16674,HEM
53,,SING,C2C,C3C,,,,,52988,16674,HEM
54,,SING,C2C,CMC,,,,,52988,16674,HEM
55,,DOUB,C3C,C4C,,,,,52988,16674,HEM
56,,SING,C3C,CAC,,,,,52988,16674,HEM
57,,SING,CMC,HMC1,,,,,52988,16674,HEM
58,,SING,CMC,HMC2,,,,,52988,16674,HEM
59,,SING,CMC,HMC3,,,,,52988,16674,HEM
60,,DOUB,CAC,CBC,,,,,52988,16674,HEM
61,,SING,CAC,HAC,,,,,52988,16674,HEM
62,,SING,CBC,HBC1,,,,,52988,16674,HEM
63,,SING,CBC,HBC2,,,,,52988,16674,HEM
64,,SING,ND,C1D,,,,,52988,16674,HEM
65,,DOUB,ND,C4D,,,,,52988,16674,HEM
66,,SING,C1D,C2D,,,,,52988,16674,HEM
67,,DOUB,C2D,C3D,,,,,52988,16674,HEM
68,,SING,C2D,CMD,,,,,52988,16674,HEM
69,,SING,C3D,C4D,,,,,52988,16674,HEM
70,,SING,C3D,CAD,,,,,52988,16674,HEM
71,,SING,CMD,HMD1,,,,,52988,16674,HEM
72,,SING,CMD,HMD2,,,,,52988,16674,HEM
73,,SING,CMD,HMD3,,,,,52988,16674,HEM
74,,SING,CAD,CBD,,,,,52988,16674,HEM
75,,SING,CAD,HAD1,,,,,52988,16674,HEM
76,,SING,CAD,HAD2,,,,,52988,16674,HEM
77,,SING,CBD,CGD,,,,,52988,16674,HEM
78,,SING,CBD,HBD1,,,,,52988,16674,HEM
79,,SING,CBD,HBD2,,,,,52988,16674,HEM
80,,DOUB,CGD,O1D,,,,,52988,16674,HEM
81,,SING,CGD,O2D,,,,,52988,16674,HEM
82,,SING,O2D,H2D,,,,,52988,16674,HEM
1,,SING,N,CA,,,,,53063,16678,LYR
2,,SING,N,H,,,,,53063,16678,LYR
3,,SING,N,H2,,,,,53063,16678,LYR
4,,SING,CA,C,,,,,53063,16678,LYR
5,,SING,CA,CB,,,,,53063,16678,LYR
6,,SING,CA,HA,,,,,53063,16678,LYR
7,,DOUB,C,O,,,,,53063,16678,LYR
8,,SING,C,OXT,,,,,53063,16678,LYR
9,,SING,OXT,HXT,,,,,53063,16678,LYR
10,,SING,CB,CG,,,,,53063,16678,LYR
11,,SING,CB,HB2,,,,,53063,16678,LYR
12,,SING,CB,HB3,,,,,53063,16678,LYR
13,,SING,CG,CD,,,,,53063,16678,LYR
14,,SING,CG,HG2,,,,,53063,16678,LYR
15,,SING,CG,HG3,,,,,53063,16678,LYR
16,,SING,CD,CE,,,,,53063,16678,LYR
17,,SING,CD,HD2,,,,,53063,16678,LYR
18,,SING,CD,HD3,,,,,53063,16678,LYR
19,,SING,CE,NZ,,,,,53063,16678,LYR
20,,SING,CE,HE2,,,,,53063,16678,LYR
21,,SING,CE,HE3,,,,,53063,16678,LYR
22,,SING,NZ,C1,,,,,53063,16678,LYR
23,,SING,NZ,HZ,,,,,53063,16678,LYR
24,,SING,C1,C2,,,,,53063,16678,LYR
25,,SING,C1,H1,,,,,53063,16678,LYR
26,,SING,C1,H11,,,,,53063,16678,LYR
27,,DOUB,C2,C3,,,,,53063,16678,LYR
28,,SING,C2,HC2,,,,,53063,16678,LYR
29,,SING,C3,C4,,,,,53063,16678,LYR
30,,SING,C3,C5,,,,,53063,16678,LYR
31,,SING,C4,H41,,,,,53063,16678,LYR
32,,SING,C4,H42,,,,,53063,16678,LYR
33,,SING,C4,H43,,,,,53063,16678,LYR
34,,DOUB,C5,C6,,,,,53063,16678,LYR
35,,SING,C5,H5,,,,,53063,16678,LYR
36,,SING,C6,C7,,,,,53063,16678,LYR
37,,SING,C6,H6,,,,,53063,16678,LYR
38,,DOUB,C7,C80,,,,,53063,16678,LYR
39,,SING,C7,H7,,,,,53063,16678,LYR
40,,SING,C80,C8,,,,,53063,16678,LYR
41,,SING,C80,C9,,,,,53063,16678,LYR
42,,SING,C8,H81,,,,,53063,16678,LYR
43,,SING,C8,H82,,,,,53063,16678,LYR
44,,SING,C8,H83,,,,,53063,16678,LYR
45,,DOUB,C9,C10,,,,,53063,16678,LYR
46,,SING,C9,H9,,,,,53063,16678,LYR
47,,SING,C10,C11,,,,,53063,16678,LYR
48,,SING,C10,H10,,,,,53063,16678,LYR
49,,DOUB,C11,C12,,,,,53063,16678,LYR
50,,SING,C11,C17,,,,,53063,16678,LYR
51,,SING,C12,C13,,,,,53063,16678,LYR
52,,SING,C12,C14,,,,,53063,16678,LYR
53,,SING,C13,H131,,,,,53063,16678,LYR
54,,SING,C13,H132,,,,,53063,16678,LYR
55,,SING,C13,H133,,,,,53063,16678,LYR
56,,SING,C14,C15,,,,,53063,16678,LYR
57,,SING,C14,H141,,,,,53063,16678,LYR
58,,SING,C14,H142,,,,,53063,16678,LYR
59,,SING,C15,C16,,,,,53063,16678,LYR
60,,SING,C15,H151,,,,,53063,16678,LYR
61,,SING,C15,H152,,,,,53063,16678,LYR
62,,SING,C16,C17,,,,,53063,16678,LYR
63,,SING,C16,H161,,,,,53063,16678,LYR
64,,SING,C16,H162,,,,,53063,16678,LYR
65,,SING,C17,C18,,,,,53063,16678,LYR
66,,SING,C17,C19,,,,,53063,16678,LYR
67,,SING,C18,H181,,,,,53063,16678,LYR
68,,SING,C18,H182,,,,,53063,16678,LYR
69,,SING,C18,H183,,,,,53063,16678,LYR
70,,SING,C19,H191,,,,,53063,16678,LYR
71,,SING,C19,H192,,,,,53063,16678,LYR
72,,SING,C19,H193,,,,,53063,16678,LYR
1,,SING,O6,C6,no,N,1,,53143,16682,EB4
2,,SING,O6,HO6,no,N,2,,53143,16682,EB4
3,,SING,O4,HO4,no,N,3,,53143,16682,EB4
4,,SING,O5,C5,no,N,4,,53143,16682,EB4
5,,SING,O5,HO5,no,N,5,,53143,16682,EB4
6,,SING,N1,C22,no,N,6,,53143,16682,EB4
7,,SING,N1,HN1,no,N,7,,53143,16682,EB4
8,,DOUB,C5,C2,yes,N,8,,53143,16682,EB4
9,,SING,C5,C8,yes,N,9,,53143,16682,EB4
10,,SING,C4,O4,no,N,10,,53143,16682,EB4
11,,SING,C4,C1,yes,N,11,,53143,16682,EB4
12,,SING,C1,O1,no,N,12,,53143,16682,EB4
13,,SING,C2,C17,yes,N,13,,53143,16682,EB4
14,,SING,C6,C3,yes,N,14,,53143,16682,EB4
15,,DOUB,C8,C11,yes,N,15,,53143,16682,EB4
16,,SING,C8,H8,no,N,16,,53143,16682,EB4
17,,SING,N2,C23,no,N,17,,53143,16682,EB4
18,,SING,N2,HN2,no,N,18,,53143,16682,EB4
19,,DOUB,C9,C6,yes,N,19,,53143,16682,EB4
20,,SING,C9,C12,yes,N,20,,53143,16682,EB4
21,,SING,C9,H9,no,N,21,,53143,16682,EB4
22,,SING,C10,C7,yes,N,22,,53143,16682,EB4
23,,DOUB,C10,C13,yes,N,23,,53143,16682,EB4
24,,SING,C10,H10,no,N,24,,53143,16682,EB4
25,,SING,O3,HO3,no,N,25,,53143,16682,EB4
26,,SING,N3,C21,no,N,26,,53143,16682,EB4
27,,SING,N3,C24,no,N,27,,53143,16682,EB4
28,,SING,N3,HN3,no,N,28,,53143,16682,EB4
29,,DOUB,C16,C1,yes,N,29,,53143,16682,EB4
30,,SING,C16,C19,no,N,30,,53143,16682,EB4
31,,DOUB,C7,C4,yes,N,31,,53143,16682,EB4
32,,SING,C7,H7,no,N,32,,53143,16682,EB4
33,,SING,C3,O3,no,N,33,,53143,16682,EB4
34,,DOUB,C3,C18,yes,N,34,,53143,16682,EB4
35,,SING,C11,C14,yes,N,35,,53143,16682,EB4
36,,SING,C11,H11,no,N,36,,53143,16682,EB4
37,,SING,O1,HO1,no,N,37,,53143,16682,EB4
38,,SING,O2,C2,no,N,38,,53143,16682,EB4
39,,SING,O2,HO2,no,N,39,,53143,16682,EB4
40,,DOUB,C12,C15,yes,N,40,,53143,16682,EB4
41,,SING,C12,H12,no,N,41,,53143,16682,EB4
42,,SING,C15,C18,yes,N,42,,53143,16682,EB4
43,,SING,C15,H15,no,N,43,,53143,16682,EB4
44,,SING,C14,H14,no,N,44,,53143,16682,EB4
45,,SING,C13,C16,yes,N,45,,53143,16682,EB4
46,,SING,C13,H13,no,N,46,,53143,16682,EB4
47,,DOUB,O7,C19,no,N,47,,53143,16682,EB4
48,,SING,C19,N1,no,N,48,,53143,16682,EB4
49,,SING,C22,C25,no,N,49,,53143,16682,EB4
50,,SING,C22,C28,no,N,50,,53143,16682,EB4
51,,SING,C22,H22,no,N,51,,53143,16682,EB4
52,,SING,C25,O15,no,N,52,,53143,16682,EB4
53,,DOUB,O10,C25,no,N,53,,53143,16682,EB4
54,,SING,O15,C30,no,N,54,,53143,16682,EB4
55,,SING,C30,C24,no,N,55,,53143,16682,EB4
56,,SING,C30,H30,no,N,56,,53143,16682,EB4
57,,SING,C30,H30A,no,N,57,,53143,16682,EB4
58,,SING,C24,H24,no,N,58,,53143,16682,EB4
59,,DOUB,C21,O9,no,N,59,,53143,16682,EB4
60,,SING,C18,C21,no,N,60,,53143,16682,EB4
61,,SING,C27,C24,no,N,61,,53143,16682,EB4
62,,SING,C27,O14,no,N,62,,53143,16682,EB4
63,,DOUB,O12,C27,no,N,63,,53143,16682,EB4
64,,SING,C28,H28,no,N,64,,53143,16682,EB4
65,,SING,C28,H28A,no,N,65,,53143,16682,EB4
66,,SING,O13,C28,no,N,66,,53143,16682,EB4
67,,SING,O13,C26,no,N,67,,53143,16682,EB4
68,,SING,C26,C23,no,N,68,,53143,16682,EB4
69,,DOUB,O11,C26,no,N,69,,53143,16682,EB4
70,,SING,C23,C29,no,N,70,,53143,16682,EB4
71,,SING,C23,H23,no,N,71,,53143,16682,EB4
72,,SING,C29,O14,no,N,72,,53143,16682,EB4
73,,SING,C29,H29,no,N,73,,53143,16682,EB4
74,,SING,C29,H29A,no,N,74,,53143,16682,EB4
75,,SING,C20,N2,no,N,75,,53143,16682,EB4
76,,DOUB,O8,C20,no,N,76,,53143,16682,EB4
77,,DOUB,C17,C14,yes,N,77,,53143,16682,EB4
78,,SING,C17,C20,no,N,78,,53143,16682,EB4
1,,SING,N,CA,no,N,1,,53261,16687,VAL
2,,SING,N,H,no,N,2,,53261,16687,VAL
3,,SING,N,H2,no,N,3,,53261,16687,VAL
4,,SING,CA,C,no,N,4,,53261,16687,VAL
5,,SING,CA,CB,no,N,5,,53261,16687,VAL
6,,SING,CA,HA,no,N,6,,53261,16687,VAL
7,,DOUB,C,O,no,N,7,,53261,16687,VAL
8,,SING,C,OXT,no,N,8,,53261,16687,VAL
9,,SING,CB,CG1,no,N,9,,53261,16687,VAL
10,,SING,CB,CG2,no,N,10,,53261,16687,VAL
11,,SING,CB,HB,no,N,11,,53261,16687,VAL
12,,SING,CG1,HG11,no,N,12,,53261,16687,VAL
13,,SING,CG1,HG12,no,N,13,,53261,16687,VAL
14,,SING,CG1,HG13,no,N,14,,53261,16687,VAL
15,,SING,CG2,HG21,no,N,15,,53261,16687,VAL
16,,SING,CG2,HG22,no,N,16,,53261,16687,VAL
17,,SING,CG2,HG23,no,N,17,,53261,16687,VAL
18,,SING,OXT,HXT,no,N,18,,53261,16687,VAL
1,,SING,N,CA,no,N,1,,53696,16707,ABA
2,,SING,N,H,no,N,2,,53696,16707,ABA
3,,SING,N,HN2,no,N,3,,53696,16707,ABA
4,,SING,CA,C,no,N,4,,53696,16707,ABA
5,,SING,CA,CB,no,N,5,,53696,16707,ABA
6,,SING,CA,HA,no,N,6,,53696,16707,ABA
7,,DOUB,C,O,no,N,7,,53696,16707,ABA
8,,SING,C,OXT,no,N,8,,53696,16707,ABA
9,,SING,CB,CG,no,N,9,,53696,16707,ABA
10,,SING,CB,HB3,no,N,10,,53696,16707,ABA
11,,SING,CB,HB2,no,N,11,,53696,16707,ABA
12,,SING,CG,HG1,no,N,12,,53696,16707,ABA
13,,SING,CG,HG3,no,N,13,,53696,16707,ABA
14,,SING,CG,HG2,no,N,14,,53696,16707,ABA
15,,SING,OXT,HXT,no,N,15,,53696,16707,ABA
1,,SING,C4,C3,no,N,1,,53697,16707,2KT
2,,SING,C4,H41,no,N,2,,53697,16707,2KT
3,,SING,C4,H42,no,N,3,,53697,16707,2KT
4,,SING,C4,H43,no,N,4,,53697,16707,2KT
5,,SING,C3,C2,no,N,5,,53697,16707,2KT
6,,SING,C3,H31,no,N,6,,53697,16707,2KT
7,,SING,C3,H32,no,N,7,,53697,16707,2KT
8,,DOUB,C2,O3,no,N,8,,53697,16707,2KT
9,,SING,C2,C1,no,N,9,,53697,16707,2KT
10,,SING,C1,O1,no,N,10,,53697,16707,2KT
11,,DOUB,C1,O2,no,N,11,,53697,16707,2KT
12,,SING,O1,HO1,no,N,12,,53697,16707,2KT
1,,SING,N,CA,,,1,,53698,16707,DHA
2,,SING,N,H,,,2,,53698,16707,DHA
3,,SING,N,H2,,,3,,53698,16707,DHA
4,,DOUB,CA,CB,,,4,,53698,16707,DHA
5,,SING,CA,C,,,5,,53698,16707,DHA
6,,SING,CB,HB1,,,6,,53698,16707,DHA
7,,SING,CB,HB2,,,7,,53698,16707,DHA
8,,DOUB,C,O,,,8,,53698,16707,DHA
9,,SING,C,OXT,,,9,,53698,16707,DHA
10,,SING,OXT,HXT,,,10,,53698,16707,DHA
1,,SING,N,CA,,,1,,53699,16707,DBU
2,,SING,N,H1,,,2,,53699,16707,DBU
3,,SING,N,H2,,,3,,53699,16707,DBU
4,,DOUB,CA,CB,,,4,,53699,16707,DBU
5,,SING,CA,C,,,5,,53699,16707,DBU
6,,SING,CB,CG,,,6,,53699,16707,DBU
7,,SING,CB,HB1,,,7,,53699,16707,DBU
8,,SING,CG,HG1,,,8,,53699,16707,DBU
9,,SING,CG,HG2,,,9,,53699,16707,DBU
10,,SING,CG,HG3,,,10,,53699,16707,DBU
11,,DOUB,C,O,,,11,,53699,16707,DBU
12,,SING,C,OXT,,,12,,53699,16707,DBU
13,,SING,OXT,HXT,,,13,,53699,16707,DBU
1,,SING,N,CA,no,N,1,,53700,16707,DAL
2,,SING,N,H,no,N,2,,53700,16707,DAL
3,,SING,N,H2,no,N,3,,53700,16707,DAL
4,,SING,CA,CB,no,N,4,,53700,16707,DAL
5,,SING,CA,C,no,N,5,,53700,16707,DAL
6,,SING,CA,HA,no,N,6,,53700,16707,DAL
7,,SING,CB,HB1,no,N,7,,53700,16707,DAL
8,,SING,CB,HB2,no,N,8,,53700,16707,DAL
9,,SING,CB,HB3,no,N,9,,53700,16707,DAL
10,,DOUB,C,O,no,N,10,,53700,16707,DAL
11,,SING,C,OXT,no,N,11,,53700,16707,DAL
12,,SING,OXT,HXT,no,N,12,,53700,16707,DAL
1,,SING,N,CA,no,N,1,,53733,16709,ABA
2,,SING,N,H,no,N,2,,53733,16709,ABA
3,,SING,N,HN2,no,N,3,,53733,16709,ABA
4,,SING,CA,C,no,N,4,,53733,16709,ABA
5,,SING,CA,CB,no,N,5,,53733,16709,ABA
6,,SING,CA,HA,no,N,6,,53733,16709,ABA
7,,DOUB,C,O,no,N,7,,53733,16709,ABA
8,,SING,C,OXT,no,N,8,,53733,16709,ABA
9,,SING,CB,CG,no,N,9,,53733,16709,ABA
10,,SING,CB,HB3,no,N,10,,53733,16709,ABA
11,,SING,CB,HB2,no,N,11,,53733,16709,ABA
12,,SING,CG,HG1,no,N,12,,53733,16709,ABA
13,,SING,CG,HG3,no,N,13,,53733,16709,ABA
14,,SING,CG,HG2,no,N,14,,53733,16709,ABA
15,,SING,OXT,HXT,no,N,15,,53733,16709,ABA
1,,SING,C4,C3,no,N,1,,53734,16709,2KT
2,,SING,C4,H41,no,N,2,,53734,16709,2KT
3,,SING,C4,H42,no,N,3,,53734,16709,2KT
4,,SING,C4,H43,no,N,4,,53734,16709,2KT
5,,SING,C3,C2,no,N,5,,53734,16709,2KT
6,,SING,C3,H31,no,N,6,,53734,16709,2KT
7,,SING,C3,H32,no,N,7,,53734,16709,2KT
8,,DOUB,C2,O3,no,N,8,,53734,16709,2KT
9,,SING,C2,C1,no,N,9,,53734,16709,2KT
10,,SING,C1,O1,no,N,10,,53734,16709,2KT
11,,DOUB,C1,O2,no,N,11,,53734,16709,2KT
12,,SING,O1,HO1,no,N,12,,53734,16709,2KT
1,,SING,N,CA,no,N,1,,53735,16709,DHA
2,,SING,N,H,no,N,2,,53735,16709,DHA
3,,SING,N,H2,no,N,3,,53735,16709,DHA
4,,DOUB,CA,CB,no,N,4,,53735,16709,DHA
5,,SING,CA,C,no,N,5,,53735,16709,DHA
6,,SING,CB,HB1,no,N,6,,53735,16709,DHA
7,,SING,CB,HB2,no,N,7,,53735,16709,DHA
8,,DOUB,C,O,no,N,8,,53735,16709,DHA
9,,SING,C,OXT,no,N,9,,53735,16709,DHA
10,,SING,OXT,HXT,no,N,10,,53735,16709,DHA
1,,SING,N,CA,no,N,1,,53736,16709,DBU
2,,SING,N,H,no,N,2,,53736,16709,DBU
3,,SING,N,H2,no,N,3,,53736,16709,DBU
4,,DOUB,CA,CB,no,Z,4,,53736,16709,DBU
5,,SING,CA,C,no,N,5,,53736,16709,DBU
6,,SING,CB,CG,no,N,6,,53736,16709,DBU
7,,SING,CB,HB,no,N,7,,53736,16709,DBU
8,,SING,CG,HG1,no,N,8,,53736,16709,DBU
9,,SING,CG,HG2,no,N,9,,53736,16709,DBU
10,,SING,CG,HG3,no,N,10,,53736,16709,DBU
11,,DOUB,C,O,no,N,11,,53736,16709,DBU
12,,SING,C,OXT,no,N,12,,53736,16709,DBU
13,,SING,OXT,HXT,no,N,13,,53736,16709,DBU
1,,SING,N,CA,no,N,1,,53737,16709,DAL
2,,SING,N,H,no,N,2,,53737,16709,DAL
3,,SING,N,H2,no,N,3,,53737,16709,DAL
4,,SING,CA,CB,no,N,4,,53737,16709,DAL
5,,SING,CA,C,no,N,5,,53737,16709,DAL
6,,SING,CA,HA,no,N,6,,53737,16709,DAL
7,,SING,CB,HB1,no,N,7,,53737,16709,DAL
8,,SING,CB,HB2,no,N,8,,53737,16709,DAL
9,,SING,CB,HB3,no,N,9,,53737,16709,DAL
10,,DOUB,C,O,no,N,10,,53737,16709,DAL
11,,SING,C,OXT,no,N,11,,53737,16709,DAL
12,,SING,OXT,HXT,no,N,12,,53737,16709,DAL
1,,SING,C1,C2,no,N,1,,54390,16747,NAG
2,,SING,C1,O1,no,N,2,,54390,16747,NAG
3,,SING,C1,O5,no,N,3,,54390,16747,NAG
4,,SING,C1,H1,no,N,4,,54390,16747,NAG
5,,SING,C2,C3,no,N,5,,54390,16747,NAG
6,,SING,C2,N2,no,N,6,,54390,16747,NAG
7,,SING,C2,H2,no,N,7,,54390,16747,NAG
8,,SING,C3,C4,no,N,8,,54390,16747,NAG
9,,SING,C3,O3,no,N,9,,54390,16747,NAG
10,,SING,C3,H3,no,N,10,,54390,16747,NAG
11,,SING,C4,C5,no,N,11,,54390,16747,NAG
12,,SING,C4,O4,no,N,12,,54390,16747,NAG
13,,SING,C4,H4,no,N,13,,54390,16747,NAG
14,,SING,C5,C6,no,N,14,,54390,16747,NAG
15,,SING,C5,O5,no,N,15,,54390,16747,NAG
16,,SING,C5,H5,no,N,16,,54390,16747,NAG
17,,SING,C6,O6,no,N,17,,54390,16747,NAG
18,,SING,C6,H61,no,N,18,,54390,16747,NAG
19,,SING,C6,H62,no,N,19,,54390,16747,NAG
20,,SING,C7,C8,no,N,20,,54390,16747,NAG
21,,SING,C7,N2,no,N,21,,54390,16747,NAG
22,,DOUB,C7,O7,no,N,22,,54390,16747,NAG
23,,SING,C8,H81,no,N,23,,54390,16747,NAG
24,,SING,C8,H82,no,N,24,,54390,16747,NAG
25,,SING,C8,H83,no,N,25,,54390,16747,NAG
26,,SING,N2,HN2,no,N,26,,54390,16747,NAG
27,,SING,O1,HO1,no,N,27,,54390,16747,NAG
28,,SING,O3,HO3,no,N,28,,54390,16747,NAG
29,,SING,O4,HO4,no,N,29,,54390,16747,NAG
30,,SING,O6,HO6,no,N,30,,54390,16747,NAG
1,,DOUB,C1',O1',no,N,1,,54472,16751,SAL
2,,SING,C1',O2',no,N,2,,54472,16751,SAL
3,,SING,C1',C1,no,N,3,,54472,16751,SAL
4,,SING,O2',HO2',no,N,4,,54472,16751,SAL
5,,SING,C1,C2,yes,N,5,,54472,16751,SAL
6,,DOUB,C1,C6,yes,N,6,,54472,16751,SAL
7,,DOUB,C2,C3,yes,N,7,,54472,16751,SAL
8,,SING,C2,O2,no,N,8,,54472,16751,SAL
9,,SING,C3,C4,yes,N,9,,54472,16751,SAL
10,,SING,C3,H3,no,N,10,,54472,16751,SAL
11,,DOUB,C4,C5,yes,N,11,,54472,16751,SAL
12,,SING,C4,H4,no,N,12,,54472,16751,SAL
13,,SING,C5,C6,yes,N,13,,54472,16751,SAL
14,,SING,C5,H5,no,N,14,,54472,16751,SAL
15,,SING,C6,H6,no,N,15,,54472,16751,SAL
16,,SING,O2,HO2,no,N,16,,54472,16751,SAL
1,,DOUB,P,O1,no,N,1,,54612,16759,PO4
2,,SING,P,O2,no,N,2,,54612,16759,PO4
3,,SING,P,O3,no,N,3,,54612,16759,PO4
4,,SING,P,O4,no,N,4,,54612,16759,PO4
1,,DOUB,PG,O1G,no,N,1,,54655,16761,ATP
2,,SING,PG,O2G,no,N,2,,54655,16761,ATP
3,,SING,PG,O3G,no,N,3,,54655,16761,ATP
4,,SING,PG,O3B,no,N,4,,54655,16761,ATP
5,,SING,O2G,HOG2,no,N,5,,54655,16761,ATP
6,,SING,O3G,HOG3,no,N,6,,54655,16761,ATP
7,,DOUB,PB,O1B,no,N,7,,54655,16761,ATP
8,,SING,PB,O2B,no,N,8,,54655,16761,ATP
9,,SING,PB,O3B,no,N,9,,54655,16761,ATP
10,,SING,PB,O3A,no,N,10,,54655,16761,ATP
11,,SING,O2B,HOB2,no,N,11,,54655,16761,ATP
12,,DOUB,PA,O1A,no,N,12,,54655,16761,ATP
13,,SING,PA,O2A,no,N,13,,54655,16761,ATP
14,,SING,PA,O3A,no,N,14,,54655,16761,ATP
15,,SING,PA,O5',no,N,15,,54655,16761,ATP
16,,SING,O2A,HOA2,no,N,16,,54655,16761,ATP
17,,SING,O5',C5',no,N,17,,54655,16761,ATP
18,,SING,C5',C4',no,N,18,,54655,16761,ATP
19,,SING,C5',H5'1,no,N,19,,54655,16761,ATP
20,,SING,C5',H5'2,no,N,20,,54655,16761,ATP
21,,SING,C4',O4',no,N,21,,54655,16761,ATP
22,,SING,C4',C3',no,N,22,,54655,16761,ATP
23,,SING,C4',H4',no,N,23,,54655,16761,ATP
24,,SING,O4',C1',no,N,24,,54655,16761,ATP
25,,SING,C3',O3',no,N,25,,54655,16761,ATP
26,,SING,C3',C2',no,N,26,,54655,16761,ATP
27,,SING,C3',H3',no,N,27,,54655,16761,ATP
28,,SING,O3',HO3',no,N,28,,54655,16761,ATP
29,,SING,C2',O2',no,N,29,,54655,16761,ATP
30,,SING,C2',C1',no,N,30,,54655,16761,ATP
31,,SING,C2',H2',no,N,31,,54655,16761,ATP
32,,SING,O2',HO2',no,N,32,,54655,16761,ATP
33,,SING,C1',N9,no,N,33,,54655,16761,ATP
34,,SING,C1',H1',no,N,34,,54655,16761,ATP
35,,SING,N9,C8,yes,N,35,,54655,16761,ATP
36,,SING,N9,C4,yes,N,36,,54655,16761,ATP
37,,DOUB,C8,N7,yes,N,37,,54655,16761,ATP
38,,SING,C8,H8,no,N,38,,54655,16761,ATP
39,,SING,N7,C5,yes,N,39,,54655,16761,ATP
40,,SING,C5,C6,yes,N,40,,54655,16761,ATP
41,,DOUB,C5,C4,yes,N,41,,54655,16761,ATP
42,,SING,C6,N6,no,N,42,,54655,16761,ATP
43,,DOUB,C6,N1,yes,N,43,,54655,16761,ATP
44,,SING,N6,HN61,no,N,44,,54655,16761,ATP
45,,SING,N6,HN62,no,N,45,,54655,16761,ATP
46,,SING,N1,C2,yes,N,46,,54655,16761,ATP
47,,DOUB,C2,N3,yes,N,47,,54655,16761,ATP
48,,SING,C2,H2,no,N,48,,54655,16761,ATP
49,,SING,N3,C4,yes,N,49,,54655,16761,ATP
1,,DOUB,CP1,CP2,yes,N,1,,54711,16764,HAL
2,,SING,CP1,CP6,yes,N,2,,54711,16764,HAL
3,,SING,CP1,C1,no,N,3,,54711,16764,HAL
4,,SING,CP2,CP3,yes,N,4,,54711,16764,HAL
5,,SING,CP2,HP2,no,N,5,,54711,16764,HAL
6,,DOUB,CP3,CP4,yes,N,6,,54711,16764,HAL
7,,SING,CP3,HP3,no,N,7,,54711,16764,HAL
8,,SING,CP4,CP5,yes,N,8,,54711,16764,HAL
9,,SING,CP4,HP4,no,N,9,,54711,16764,HAL
10,,DOUB,CP5,CP6,yes,N,10,,54711,16764,HAL
11,,SING,CP5,HP5,no,N,11,,54711,16764,HAL
12,,SING,CP6,HP6,no,N,12,,54711,16764,HAL
13,,SING,C1,C2,no,N,13,,54711,16764,HAL
14,,SING,C1,HC11,no,N,14,,54711,16764,HAL
15,,SING,C1,HC12,no,N,15,,54711,16764,HAL
16,,SING,C2,N1,no,N,16,,54711,16764,HAL
17,,SING,C2,HC21,no,N,17,,54711,16764,HAL
18,,SING,C2,HC22,no,N,18,,54711,16764,HAL
19,,SING,N1,C3,no,N,19,,54711,16764,HAL
20,,SING,N1,HN1,no,N,20,,54711,16764,HAL
21,,DOUB,C3,O1,no,N,21,,54711,16764,HAL
22,,SING,C3,C4,no,N,22,,54711,16764,HAL
23,,SING,C4,O2,no,N,23,,54711,16764,HAL
24,,SING,C4,HC41,no,N,24,,54711,16764,HAL
25,,SING,C4,HC42,no,N,25,,54711,16764,HAL
26,,SING,O2,P,no,N,26,,54711,16764,HAL
27,,DOUB,P,O3,no,N,27,,54711,16764,HAL
28,,SING,P,O4,no,N,28,,54711,16764,HAL
29,,SING,P,C5,no,N,29,,54711,16764,HAL
30,,SING,O4,HO4,no,N,30,,54711,16764,HAL
31,,SING,C5,C6,no,N,31,,54711,16764,HAL
32,,SING,C5,N2,no,N,32,,54711,16764,HAL
33,,SING,C5,HC5,no,N,33,,54711,16764,HAL
34,,SING,C6,CR1,no,N,34,,54711,16764,HAL
35,,SING,C6,HC61,no,N,35,,54711,16764,HAL
36,,SING,C6,HC62,no,N,36,,54711,16764,HAL
37,,DOUB,CR1,CR2,yes,N,37,,54711,16764,HAL
38,,SING,CR1,CR6,yes,N,38,,54711,16764,HAL
39,,SING,CR2,CR3,yes,N,39,,54711,16764,HAL
40,,SING,CR2,HR2,no,N,40,,54711,16764,HAL
41,,DOUB,CR3,CR4,yes,N,41,,54711,16764,HAL
42,,SING,CR3,HR3,no,N,42,,54711,16764,HAL
43,,SING,CR4,CR5,yes,N,43,,54711,16764,HAL
44,,SING,CR4,HR4,no,N,44,,54711,16764,HAL
45,,DOUB,CR5,CR6,yes,N,45,,54711,16764,HAL
46,,SING,CR5,HR5,no,N,46,,54711,16764,HAL
47,,SING,CR6,HR6,no,N,47,,54711,16764,HAL
48,,SING,N2,C7,no,N,48,,54711,16764,HAL
49,,SING,N2,HN2,no,N,49,,54711,16764,HAL
50,,DOUB,C7,O5,no,N,50,,54711,16764,HAL
51,,SING,C7,C8,no,N,51,,54711,16764,HAL
52,,SING,C8,C9,no,N,52,,54711,16764,HAL
53,,SING,C8,HC81,no,N,53,,54711,16764,HAL
54,,SING,C8,HC82,no,N,54,,54711,16764,HAL
55,,SING,C9,C10,no,N,55,,54711,16764,HAL
56,,SING,C9,HC91,no,N,56,,54711,16764,HAL
57,,SING,C9,HC92,no,N,57,,54711,16764,HAL
58,,SING,C10,C11,no,N,58,,54711,16764,HAL
59,,SING,C10,H101,no,N,59,,54711,16764,HAL
60,,SING,C10,H102,no,N,60,,54711,16764,HAL
61,,SING,C11,O6,no,N,61,,54711,16764,HAL
62,,DOUB,C11,O7,no,N,62,,54711,16764,HAL
63,,SING,O6,HO6,no,N,63,,54711,16764,HAL
1,,SING,N,CA,,,,,54926,16778,MLY
2,,SING,N,H,,,,,54926,16778,MLY
3,,SING,N,H2,,,,,54926,16778,MLY
4,,SING,CA,CB,,,,,54926,16778,MLY
5,,SING,CA,C,,,,,54926,16778,MLY
6,,SING,CA,HA,,,,,54926,16778,MLY
7,,SING,CB,CG,,,,,54926,16778,MLY
8,,SING,CB,HB2,,,,,54926,16778,MLY
9,,SING,CB,HB3,,,,,54926,16778,MLY
10,,SING,CG,CD,,,,,54926,16778,MLY
11,,SING,CG,HG2,,,,,54926,16778,MLY
12,,SING,CG,HG3,,,,,54926,16778,MLY
13,,SING,CD,CE,,,,,54926,16778,MLY
14,,SING,CD,HD2,,,,,54926,16778,MLY
15,,SING,CD,HD3,,,,,54926,16778,MLY
16,,SING,CE,NZ,,,,,54926,16778,MLY
17,,SING,CE,HE2,,,,,54926,16778,MLY
18,,SING,CE,HE3,,,,,54926,16778,MLY
19,,SING,NZ,CH1,,,,,54926,16778,MLY
20,,SING,NZ,CH2,,,,,54926,16778,MLY
21,,SING,CH1,HH11,,,,,54926,16778,MLY
22,,SING,CH1,HH12,,,,,54926,16778,MLY
23,,SING,CH1,HH13,,,,,54926,16778,MLY
24,,SING,CH2,HH21,,,,,54926,16778,MLY
25,,SING,CH2,HH22,,,,,54926,16778,MLY
26,,SING,CH2,HH23,,,,,54926,16778,MLY
27,,DOUB,C,O,,,,,54926,16778,MLY
28,,SING,C,OXT,,,,,54926,16778,MLY
29,,SING,OXT,HXT,,,,,54926,16778,MLY
1,,DOUB,PA,O1A,no,N,1,,54969,16780,FAD
2,,SING,PA,O2A,no,N,2,,54969,16780,FAD
3,,SING,PA,O5B,no,N,3,,54969,16780,FAD
4,,SING,PA,O3P,no,N,4,,54969,16780,FAD
5,,SING,O2A,HOA2,no,N,5,,54969,16780,FAD
6,,SING,O5B,C5B,no,N,6,,54969,16780,FAD
7,,SING,C5B,C4B,no,N,7,,54969,16780,FAD
8,,SING,C5B,H51A,no,N,8,,54969,16780,FAD
9,,SING,C5B,H52A,no,N,9,,54969,16780,FAD
10,,SING,C4B,O4B,no,N,10,,54969,16780,FAD
11,,SING,C4B,C3B,no,N,11,,54969,16780,FAD
12,,SING,C4B,H4B,no,N,12,,54969,16780,FAD
13,,SING,O4B,C1B,no,N,13,,54969,16780,FAD
14,,SING,C3B,O3B,no,N,14,,54969,16780,FAD
15,,SING,C3B,C2B,no,N,15,,54969,16780,FAD
16,,SING,C3B,H3B,no,N,16,,54969,16780,FAD
17,,SING,O3B,HO3A,no,N,17,,54969,16780,FAD
18,,SING,C2B,O2B,no,N,18,,54969,16780,FAD
19,,SING,C2B,C1B,no,N,19,,54969,16780,FAD
20,,SING,C2B,H2B,no,N,20,,54969,16780,FAD
21,,SING,O2B,HO2A,no,N,21,,54969,16780,FAD
22,,SING,C1B,N9A,no,N,22,,54969,16780,FAD
23,,SING,C1B,H1B,no,N,23,,54969,16780,FAD
24,,SING,N9A,C8A,yes,N,24,,54969,16780,FAD
25,,SING,N9A,C4A,yes,N,25,,54969,16780,FAD
26,,DOUB,C8A,N7A,yes,N,26,,54969,16780,FAD
27,,SING,C8A,H8A,no,N,27,,54969,16780,FAD
28,,SING,N7A,C5A,yes,N,28,,54969,16780,FAD
29,,SING,C5A,C6A,yes,N,29,,54969,16780,FAD
30,,DOUB,C5A,C4A,yes,N,30,,54969,16780,FAD
31,,SING,C6A,N6A,no,N,31,,54969,16780,FAD
32,,DOUB,C6A,N1A,yes,N,32,,54969,16780,FAD
33,,SING,N6A,H61A,no,N,33,,54969,16780,FAD
34,,SING,N6A,H62A,no,N,34,,54969,16780,FAD
35,,SING,N1A,C2A,yes,N,35,,54969,16780,FAD
36,,DOUB,C2A,N3A,yes,N,36,,54969,16780,FAD
37,,SING,C2A,H2A,no,N,37,,54969,16780,FAD
38,,SING,N3A,C4A,yes,N,38,,54969,16780,FAD
39,,SING,N1,C2,no,N,39,,54969,16780,FAD
40,,DOUB,N1,C10,no,N,40,,54969,16780,FAD
41,,DOUB,C2,O2,no,N,41,,54969,16780,FAD
42,,SING,C2,N3,no,N,42,,54969,16780,FAD
43,,SING,N3,C4,no,N,43,,54969,16780,FAD
44,,SING,N3,HN3,no,N,44,,54969,16780,FAD
45,,DOUB,C4,O4,no,N,45,,54969,16780,FAD
46,,SING,C4,C4X,no,N,46,,54969,16780,FAD
47,,DOUB,C4X,N5,no,N,47,,54969,16780,FAD
48,,SING,C4X,C10,no,N,48,,54969,16780,FAD
49,,SING,N5,C5X,no,N,49,,54969,16780,FAD
50,,DOUB,C5X,C6,yes,N,50,,54969,16780,FAD
51,,SING,C5X,C9A,yes,N,51,,54969,16780,FAD
52,,SING,C6,C7,yes,N,52,,54969,16780,FAD
53,,SING,C6,H6,no,N,53,,54969,16780,FAD
54,,SING,C7,C7M,no,N,54,,54969,16780,FAD
55,,DOUB,C7,C8,yes,N,55,,54969,16780,FAD
56,,SING,C7M,HM71,no,N,56,,54969,16780,FAD
57,,SING,C7M,HM72,no,N,57,,54969,16780,FAD
58,,SING,C7M,HM73,no,N,58,,54969,16780,FAD
59,,SING,C8,C8M,no,N,59,,54969,16780,FAD
60,,SING,C8,C9,yes,N,60,,54969,16780,FAD
61,,SING,C8M,HM81,no,N,61,,54969,16780,FAD
62,,SING,C8M,HM82,no,N,62,,54969,16780,FAD
63,,SING,C8M,HM83,no,N,63,,54969,16780,FAD
64,,DOUB,C9,C9A,yes,N,64,,54969,16780,FAD
65,,SING,C9,H9,no,N,65,,54969,16780,FAD
66,,SING,C9A,N10,no,N,66,,54969,16780,FAD
67,,SING,N10,C10,no,N,67,,54969,16780,FAD
68,,SING,N10,C1',no,N,68,,54969,16780,FAD
69,,SING,C1',C2',no,N,69,,54969,16780,FAD
70,,SING,C1',H1'1,no,N,70,,54969,16780,FAD
71,,SING,C1',H1'2,no,N,71,,54969,16780,FAD
72,,SING,C2',O2',no,N,72,,54969,16780,FAD
73,,SING,C2',C3',no,N,73,,54969,16780,FAD
74,,SING,C2',H2',no,N,74,,54969,16780,FAD
75,,SING,O2',HO2',no,N,75,,54969,16780,FAD
76,,SING,C3',O3',no,N,76,,54969,16780,FAD
77,,SING,C3',C4',no,N,77,,54969,16780,FAD
78,,SING,C3',H3',no,N,78,,54969,16780,FAD
79,,SING,O3',HO3',no,N,79,,54969,16780,FAD
80,,SING,C4',O4',no,N,80,,54969,16780,FAD
81,,SING,C4',C5',no,N,81,,54969,16780,FAD
82,,SING,C4',H4',no,N,82,,54969,16780,FAD
83,,SING,O4',HO4',no,N,83,,54969,16780,FAD
84,,SING,C5',O5',no,N,84,,54969,16780,FAD
85,,SING,C5',H5'1,no,N,85,,54969,16780,FAD
86,,SING,C5',H5'2,no,N,86,,54969,16780,FAD
87,,SING,O5',P,no,N,87,,54969,16780,FAD
88,,DOUB,P,O1P,no,N,88,,54969,16780,FAD
89,,SING,P,O2P,no,N,89,,54969,16780,FAD
90,,SING,P,O3P,no,N,90,,54969,16780,FAD
91,,SING,O2P,HOP2,no,N,91,,54969,16780,FAD
1,,SING,N,CA,,,,,55068,16784,HYP
2,,SING,N,CD,,,,,55068,16784,HYP
3,,SING,N,H,,,,,55068,16784,HYP
4,,SING,CA,C,,,,,55068,16784,HYP
5,,SING,CA,CB,,,,,55068,16784,HYP
6,,SING,CA,HA,,,,,55068,16784,HYP
7,,DOUB,C,O,,,,,55068,16784,HYP
8,,SING,C,OXT,,,,,55068,16784,HYP
9,,SING,CB,CG,,,,,55068,16784,HYP
10,,SING,CB,HB2,,,,,55068,16784,HYP
11,,SING,CB,HB3,,,,,55068,16784,HYP
12,,SING,CG,CD,,,,,55068,16784,HYP
13,,SING,CG,OD1,,,,,55068,16784,HYP
14,,SING,CG,HG,,,,,55068,16784,HYP
15,,SING,CD,HD22,,,,,55068,16784,HYP
16,,SING,CD,HD23,,,,,55068,16784,HYP
17,,SING,OD1,HD1,,,,,55068,16784,HYP
18,,SING,OXT,HXT,,,,,55068,16784,HYP
1,,SING,N1,CA1,,,,,55087,16785,GPR
2,,SING,N1,HN11,,,,,55087,16785,GPR
3,,SING,N1,HN12,,,,,55087,16785,GPR
4,,SING,CA1,C1,,,,,55087,16785,GPR
5,,SING,CA1,CB1,,,,,55087,16785,GPR
6,,SING,CA1,HA1,,,,,55087,16785,GPR
7,,DOUB,C1,O11,,,,,55087,16785,GPR
8,,SING,C1,O12,,,,,55087,16785,GPR
9,,SING,O12,HO2,,,,,55087,16785,GPR
10,,SING,CB1,CG1,,,,,55087,16785,GPR
11,,SING,CB1,HB11,,,,,55087,16785,GPR
12,,SING,CB1,HB12,,,,,55087,16785,GPR
13,,SING,CG1,CD1,,,,,55087,16785,GPR
14,,SING,CG1,HG11,,,,,55087,16785,GPR
15,,SING,CG1,HG12,,,,,55087,16785,GPR
16,,DOUB,CD1,OE1,,,,,55087,16785,GPR
17,,SING,CD1,N2,,,,,55087,16785,GPR
18,,SING,N2,CA2,,,,,55087,16785,GPR
19,,SING,N2,HN2,,,,,55087,16785,GPR
20,,SING,CA2,C2,,,,,55087,16785,GPR
21,,SING,CA2,CB2,,,,,55087,16785,GPR
22,,SING,CA2,HA2,,,,,55087,16785,GPR
23,,DOUB,C2,O2,,,,,55087,16785,GPR
24,,SING,C2,N3,,,,,55087,16785,GPR
25,,SING,CB2,SG2,,,,,55087,16785,GPR
26,,SING,CB2,HB21,,,,,55087,16785,GPR
27,,SING,CB2,HB22,,,,,55087,16785,GPR
28,,SING,SG2,CA4,,,,,55087,16785,GPR
29,,SING,N3,CA3,,,,,55087,16785,GPR
30,,SING,N3,HN3,,,,,55087,16785,GPR
31,,SING,CA3,C3,,,,,55087,16785,GPR
32,,SING,CA3,HA31,,,,,55087,16785,GPR
33,,SING,CA3,HA32,,,,,55087,16785,GPR
34,,DOUB,C3,O31,,,,,55087,16785,GPR
35,,SING,C3,O32,,,,,55087,16785,GPR
36,,SING,O32,HO3,,,,,55087,16785,GPR
37,,SING,CA4,CB4,,,,,55087,16785,GPR
38,,SING,CA4,CA5,,,,,55087,16785,GPR
39,,SING,CA4,HA4,,,,,55087,16785,GPR
40,,DOUB,CB4,CG4,,,,,55087,16785,GPR
41,,SING,CB4,CH4,,,,,55087,16785,GPR
42,,SING,CG4,CD4,,,,,55087,16785,GPR
43,,SING,CG4,HG4,,,,,55087,16785,GPR
44,,DOUB,CD4,CE4,,,,,55087,16785,GPR
45,,SING,CD4,HD4,,,,,55087,16785,GPR
46,,SING,CE4,CZ4,,,,,55087,16785,GPR
47,,SING,CE4,HE4,,,,,55087,16785,GPR
48,,DOUB,CZ4,CH4,,,,,55087,16785,GPR
49,,SING,CZ4,HZ4,,,,,55087,16785,GPR
50,,SING,CH4,CH5,,,,,55087,16785,GPR
51,,SING,CH5,CZ5,,,,,55087,16785,GPR
52,,DOUB,CH5,CB5,,,,,55087,16785,GPR
53,,DOUB,CZ5,CE5,,,,,55087,16785,GPR
54,,SING,CZ5,HZ5,,,,,55087,16785,GPR
55,,SING,CE5,CD5,,,,,55087,16785,GPR
56,,SING,CE5,HE5,,,,,55087,16785,GPR
57,,DOUB,CD5,CG5,,,,,55087,16785,GPR
58,,SING,CD5,HD5,,,,,55087,16785,GPR
59,,SING,CG5,CB5,,,,,55087,16785,GPR
60,,SING,CG5,HG5,,,,,55087,16785,GPR
61,,SING,CB5,CA5,,,,,55087,16785,GPR
62,,SING,CA5,O5,,,,,55087,16785,GPR
63,,SING,CA5,HA5,,,,,55087,16785,GPR
64,,SING,O5,HO5,,,,,55087,16785,GPR
1,,SING,N,CA,no,N,1,,55106,16786,DPN
2,,SING,N,H,no,N,2,,55106,16786,DPN
3,,SING,N,H2,no,N,3,,55106,16786,DPN
4,,SING,CA,C,no,N,4,,55106,16786,DPN
5,,SING,CA,CB,no,N,5,,55106,16786,DPN
6,,SING,CA,HA,no,N,6,,55106,16786,DPN
7,,DOUB,C,O,no,N,7,,55106,16786,DPN
8,,SING,C,OXT,no,N,8,,55106,16786,DPN
9,,SING,OXT,HXT,no,N,9,,55106,16786,DPN
10,,SING,CB,CG,no,N,10,,55106,16786,DPN
11,,SING,CB,HB2,no,N,11,,55106,16786,DPN
12,,SING,CB,HB3,no,N,12,,55106,16786,DPN
13,,DOUB,CG,CD1,yes,N,13,,55106,16786,DPN
14,,SING,CG,CD2,yes,N,14,,55106,16786,DPN
15,,SING,CD1,CE1,yes,N,15,,55106,16786,DPN
16,,SING,CD1,HD1,no,N,16,,55106,16786,DPN
17,,DOUB,CD2,CE2,yes,N,17,,55106,16786,DPN
18,,SING,CD2,HD2,no,N,18,,55106,16786,DPN
19,,DOUB,CE1,CZ,yes,N,19,,55106,16786,DPN
20,,SING,CE1,HE1,no,N,20,,55106,16786,DPN
21,,SING,CE2,CZ,yes,N,21,,55106,16786,DPN
22,,SING,CE2,HE2,no,N,22,,55106,16786,DPN
23,,SING,CZ,HZ,no,N,23,,55106,16786,DPN
1,,SING,N1,CA1,no,N,1,,55107,16786,GPR
2,,SING,N1,HN11,no,N,2,,55107,16786,GPR
3,,SING,N1,HN12,no,N,3,,55107,16786,GPR
4,,SING,CA1,C1,no,N,4,,55107,16786,GPR
5,,SING,CA1,CB1,no,N,5,,55107,16786,GPR
6,,SING,CA1,HA1,no,N,6,,55107,16786,GPR
7,,DOUB,C1,O11,no,N,7,,55107,16786,GPR
8,,SING,C1,O12,no,N,8,,55107,16786,GPR
9,,SING,O12,HO2,no,N,9,,55107,16786,GPR
10,,SING,CB1,CG1,no,N,10,,55107,16786,GPR
11,,SING,CB1,HB11,no,N,11,,55107,16786,GPR
12,,SING,CB1,HB12,no,N,12,,55107,16786,GPR
13,,SING,CG1,CD1,no,N,13,,55107,16786,GPR
14,,SING,CG1,HG11,no,N,14,,55107,16786,GPR
15,,SING,CG1,HG12,no,N,15,,55107,16786,GPR
16,,DOUB,CD1,OE1,no,N,16,,55107,16786,GPR
17,,SING,CD1,N2,no,N,17,,55107,16786,GPR
18,,SING,N2,CA2,no,N,18,,55107,16786,GPR
19,,SING,N2,HN2,no,N,19,,55107,16786,GPR
20,,SING,CA2,C2,no,N,20,,55107,16786,GPR
21,,SING,CA2,CB2,no,N,21,,55107,16786,GPR
22,,SING,CA2,HA2,no,N,22,,55107,16786,GPR
23,,DOUB,C2,O2,no,N,23,,55107,16786,GPR
24,,SING,C2,N3,no,N,24,,55107,16786,GPR
25,,SING,CB2,SG2,no,N,25,,55107,16786,GPR
26,,SING,CB2,HB21,no,N,26,,55107,16786,GPR
27,,SING,CB2,HB22,no,N,27,,55107,16786,GPR
28,,SING,SG2,CA4,no,N,28,,55107,16786,GPR
29,,SING,N3,CA3,no,N,29,,55107,16786,GPR
30,,SING,N3,HN3,no,N,30,,55107,16786,GPR
31,,SING,CA3,C3,no,N,31,,55107,16786,GPR
32,,SING,CA3,HA31,no,N,32,,55107,16786,GPR
33,,SING,CA3,HA32,no,N,33,,55107,16786,GPR
34,,DOUB,C3,O31,no,N,34,,55107,16786,GPR
35,,SING,C3,O32,no,N,35,,55107,16786,GPR
36,,SING,O32,HO3,no,N,36,,55107,16786,GPR
37,,SING,CA4,CB4,no,N,37,,55107,16786,GPR
38,,SING,CA4,CA5,no,N,38,,55107,16786,GPR
39,,SING,CA4,HA4,no,N,39,,55107,16786,GPR
40,,DOUB,CB4,CG4,yes,N,40,,55107,16786,GPR
41,,SING,CB4,CH4,yes,N,41,,55107,16786,GPR
42,,SING,CG4,CD4,yes,N,42,,55107,16786,GPR
43,,SING,CG4,HG4,no,N,43,,55107,16786,GPR
44,,DOUB,CD4,CE4,yes,N,44,,55107,16786,GPR
45,,SING,CD4,HD4,no,N,45,,55107,16786,GPR
46,,SING,CE4,CZ4,yes,N,46,,55107,16786,GPR
47,,SING,CE4,HE4,no,N,47,,55107,16786,GPR
48,,DOUB,CZ4,CH4,yes,N,48,,55107,16786,GPR
49,,SING,CZ4,HZ4,no,N,49,,55107,16786,GPR
50,,SING,CH4,CH5,yes,N,50,,55107,16786,GPR
51,,SING,CH5,CZ5,yes,N,51,,55107,16786,GPR
52,,DOUB,CH5,CB5,yes,N,52,,55107,16786,GPR
53,,DOUB,CZ5,CE5,yes,N,53,,55107,16786,GPR
54,,SING,CZ5,HZ5,no,N,54,,55107,16786,GPR
55,,SING,CE5,CD5,yes,N,55,,55107,16786,GPR
56,,SING,CE5,HE5,no,N,56,,55107,16786,GPR
57,,DOUB,CD5,CG5,yes,N,57,,55107,16786,GPR
58,,SING,CD5,HD5,no,N,58,,55107,16786,GPR
59,,SING,CG5,CB5,yes,N,59,,55107,16786,GPR
60,,SING,CG5,HG5,no,N,60,,55107,16786,GPR
61,,SING,CB5,CA5,no,N,61,,55107,16786,GPR
62,,SING,CA5,O5,no,N,62,,55107,16786,GPR
63,,SING,CA5,HA5,no,N,63,,55107,16786,GPR
64,,SING,O5,HO5,no,N,64,,55107,16786,GPR
1,,SING,FE1,S1,no,N,1,,55467,16804,FES
2,,SING,FE1,S2,no,N,2,,55467,16804,FES
3,,SING,FE2,S1,no,N,3,,55467,16804,FES
4,,SING,FE2,S2,no,N,4,,55467,16804,FES
1,,DOUB,PA,O1A,no,N,1,,55894,16822,NAP
2,,SING,PA,O2A,no,N,2,,55894,16822,NAP
3,,SING,PA,O5B,no,N,3,,55894,16822,NAP
4,,SING,PA,O3,no,N,4,,55894,16822,NAP
5,,SING,O2A,HOA2,no,N,5,,55894,16822,NAP
6,,SING,O5B,C5B,no,N,6,,55894,16822,NAP
7,,SING,C5B,C4B,no,N,7,,55894,16822,NAP
8,,SING,C5B,H51A,no,N,8,,55894,16822,NAP
9,,SING,C5B,H52A,no,N,9,,55894,16822,NAP
10,,SING,C4B,O4B,no,N,10,,55894,16822,NAP
11,,SING,C4B,C3B,no,N,11,,55894,16822,NAP
12,,SING,C4B,H4B,no,N,12,,55894,16822,NAP
13,,SING,O4B,C1B,no,N,13,,55894,16822,NAP
14,,SING,C3B,O3B,no,N,14,,55894,16822,NAP
15,,SING,C3B,C2B,no,N,15,,55894,16822,NAP
16,,SING,C3B,H3B,no,N,16,,55894,16822,NAP
17,,SING,O3B,HO3A,no,N,17,,55894,16822,NAP
18,,SING,C2B,O2B,no,N,18,,55894,16822,NAP
19,,SING,C2B,C1B,no,N,19,,55894,16822,NAP
20,,SING,C2B,H2B,no,N,20,,55894,16822,NAP
21,,SING,O2B,P2B,no,N,21,,55894,16822,NAP
22,,SING,C1B,N9A,no,N,22,,55894,16822,NAP
23,,SING,C1B,H1B,no,N,23,,55894,16822,NAP
24,,SING,N9A,C8A,yes,N,24,,55894,16822,NAP
25,,SING,N9A,C4A,yes,N,25,,55894,16822,NAP
26,,DOUB,C8A,N7A,yes,N,26,,55894,16822,NAP
27,,SING,C8A,H8A,no,N,27,,55894,16822,NAP
28,,SING,N7A,C5A,yes,N,28,,55894,16822,NAP
29,,SING,C5A,C6A,yes,N,29,,55894,16822,NAP
30,,DOUB,C5A,C4A,yes,N,30,,55894,16822,NAP
31,,SING,C6A,N6A,no,N,31,,55894,16822,NAP
32,,DOUB,C6A,N1A,yes,N,32,,55894,16822,NAP
33,,SING,N6A,H61A,no,N,33,,55894,16822,NAP
34,,SING,N6A,H62A,no,N,34,,55894,16822,NAP
35,,SING,N1A,C2A,yes,N,35,,55894,16822,NAP
36,,DOUB,C2A,N3A,yes,N,36,,55894,16822,NAP
37,,SING,C2A,H2A,no,N,37,,55894,16822,NAP
38,,SING,N3A,C4A,yes,N,38,,55894,16822,NAP
39,,SING,O3,PN,no,N,39,,55894,16822,NAP
40,,DOUB,PN,O1N,no,N,40,,55894,16822,NAP
41,,SING,PN,O2N,no,N,41,,55894,16822,NAP
42,,SING,PN,O5D,no,N,42,,55894,16822,NAP
43,,SING,O5D,C5D,no,N,43,,55894,16822,NAP
44,,SING,C5D,C4D,no,N,44,,55894,16822,NAP
45,,SING,C5D,H51N,no,N,45,,55894,16822,NAP
46,,SING,C5D,H52N,no,N,46,,55894,16822,NAP
47,,SING,C4D,O4D,no,N,47,,55894,16822,NAP
48,,SING,C4D,C3D,no,N,48,,55894,16822,NAP
49,,SING,C4D,H4D,no,N,49,,55894,16822,NAP
50,,SING,O4D,C1D,no,N,50,,55894,16822,NAP
51,,SING,C3D,O3D,no,N,51,,55894,16822,NAP
52,,SING,C3D,C2D,no,N,52,,55894,16822,NAP
53,,SING,C3D,H3D,no,N,53,,55894,16822,NAP
54,,SING,O3D,HO3N,no,N,54,,55894,16822,NAP
55,,SING,C2D,O2D,no,N,55,,55894,16822,NAP
56,,SING,C2D,C1D,no,N,56,,55894,16822,NAP
57,,SING,C2D,H2D,no,N,57,,55894,16822,NAP
11,,DOUB,CHC,C4B,,,,,56145,16842,HEM
58,,SING,O2D,HO2N,no,N,58,,55894,16822,NAP
59,,SING,C1D,N1N,no,N,59,,55894,16822,NAP
60,,SING,C1D,H1D,no,N,60,,55894,16822,NAP
61,,SING,N1N,C2N,yes,N,61,,55894,16822,NAP
62,,DOUB,N1N,C6N,yes,N,62,,55894,16822,NAP
63,,DOUB,C2N,C3N,yes,N,63,,55894,16822,NAP
64,,SING,C2N,H2N,no,N,64,,55894,16822,NAP
65,,SING,C3N,C7N,no,N,65,,55894,16822,NAP
66,,SING,C3N,C4N,yes,N,66,,55894,16822,NAP
67,,DOUB,C7N,O7N,no,N,67,,55894,16822,NAP
68,,SING,C7N,N7N,no,N,68,,55894,16822,NAP
69,,SING,N7N,H71N,no,N,69,,55894,16822,NAP
70,,SING,N7N,H72N,no,N,70,,55894,16822,NAP
71,,DOUB,C4N,C5N,yes,N,71,,55894,16822,NAP
72,,SING,C4N,H4N,no,N,72,,55894,16822,NAP
73,,SING,C5N,C6N,yes,N,73,,55894,16822,NAP
74,,SING,C5N,H5N,no,N,74,,55894,16822,NAP
75,,SING,C6N,H6N,no,N,75,,55894,16822,NAP
76,,DOUB,P2B,O1X,no,N,76,,55894,16822,NAP
77,,SING,P2B,O2X,no,N,77,,55894,16822,NAP
78,,SING,P2B,O3X,no,N,78,,55894,16822,NAP
79,,SING,O2X,HOP2,no,N,79,,55894,16822,NAP
80,,SING,O3X,HOP3,no,N,80,,55894,16822,NAP
1,,SING,C8,C7,no,N,1,,55895,16822,N22
2,,SING,C7,C5,no,N,2,,55895,16822,N22
3,,DOUB,C5,N4,yes,N,3,,55895,16822,N22
4,,SING,C5,C6,yes,N,4,,55895,16822,N22
5,,SING,N4,C3,yes,N,5,,55895,16822,N22
6,,SING,C3,N8,no,N,6,,55895,16822,N22
7,,DOUB,C3,N2,yes,N,7,,55895,16822,N22
8,,SING,N2,C1,yes,N,8,,55895,16822,N22
9,,SING,C1,N7,no,N,9,,55895,16822,N22
10,,DOUB,C1,C6,yes,N,10,,55895,16822,N22
11,,SING,C6,C9,no,N,11,,55895,16822,N22
12,,TRIP,C9,C10,no,N,12,,55895,16822,N22
13,,SING,C10,C11,no,N,13,,55895,16822,N22
14,,SING,C11,C13,no,N,14,,55895,16822,N22
15,,DOUB,C13,C18,yes,N,15,,55895,16822,N22
16,,SING,C13,C14,yes,N,16,,55895,16822,N22
17,,SING,C18,C17,yes,N,17,,55895,16822,N22
18,,SING,C17,O2,no,N,18,,55895,16822,N22
19,,DOUB,C17,C16,yes,N,19,,55895,16822,N22
20,,SING,O2,C4,no,N,20,,55895,16822,N22
21,,SING,C16,C15,yes,N,21,,55895,16822,N22
22,,DOUB,C15,C14,yes,N,22,,55895,16822,N22
23,,SING,C14,O10,no,N,23,,55895,16822,N22
24,,SING,O10,C2,no,N,24,,55895,16822,N22
25,,SING,C8,H8,no,N,25,,55895,16822,N22
26,,SING,C8,H8A,no,N,26,,55895,16822,N22
27,,SING,C8,H8B,no,N,27,,55895,16822,N22
28,,SING,C7,H7,no,N,28,,55895,16822,N22
29,,SING,C7,H7A,no,N,29,,55895,16822,N22
30,,SING,N8,HN8,no,N,30,,55895,16822,N22
31,,SING,N8,HN8A,no,N,31,,55895,16822,N22
32,,SING,N7,HN7,no,N,32,,55895,16822,N22
33,,SING,N7,HN7A,no,N,33,,55895,16822,N22
34,,SING,C11,H11,no,N,34,,55895,16822,N22
35,,SING,C11,H11A,no,N,35,,55895,16822,N22
36,,SING,C18,H18,no,N,36,,55895,16822,N22
37,,SING,C4,H4,no,N,37,,55895,16822,N22
38,,SING,C4,H4A,no,N,38,,55895,16822,N22
39,,SING,C4,H4B,no,N,39,,55895,16822,N22
40,,SING,C16,H16,no,N,40,,55895,16822,N22
41,,SING,C15,H15,no,N,41,,55895,16822,N22
42,,SING,C2,H2,no,N,42,,55895,16822,N22
43,,SING,C2,H2A,no,N,43,,55895,16822,N22
44,,SING,C2,H2B,no,N,44,,55895,16822,N22
1,,SING,C1,C2,,,1,,56123,16841,NAG
2,,SING,C1,O1,,,2,,56123,16841,NAG
3,,SING,C1,O5,,,3,,56123,16841,NAG
4,,SING,C1,H1,,,4,,56123,16841,NAG
5,,SING,C2,C3,,,5,,56123,16841,NAG
6,,SING,C2,N2,,,6,,56123,16841,NAG
7,,SING,C2,H2,,,7,,56123,16841,NAG
8,,SING,C3,C4,,,8,,56123,16841,NAG
9,,SING,C3,O3,,,9,,56123,16841,NAG
10,,SING,C3,H3,,,10,,56123,16841,NAG
11,,SING,C4,C5,,,11,,56123,16841,NAG
12,,SING,C4,O4,,,12,,56123,16841,NAG
13,,SING,C4,H4,,,13,,56123,16841,NAG
14,,SING,C5,C6,,,14,,56123,16841,NAG
15,,SING,C5,O5,,,15,,56123,16841,NAG
16,,SING,C5,H5,,,16,,56123,16841,NAG
17,,SING,C6,O6,,,17,,56123,16841,NAG
18,,SING,C6,H61,,,18,,56123,16841,NAG
19,,SING,C6,H62,,,19,,56123,16841,NAG
20,,SING,C7,C8,,,20,,56123,16841,NAG
21,,SING,C7,N2,,,21,,56123,16841,NAG
22,,DOUB,C7,O7,,,22,,56123,16841,NAG
23,,SING,C8,H81,,,23,,56123,16841,NAG
24,,SING,C8,H82,,,24,,56123,16841,NAG
25,,SING,C8,H83,,,25,,56123,16841,NAG
26,,SING,N2,HN2,,,26,,56123,16841,NAG
27,,SING,O1,HO1,,,27,,56123,16841,NAG
28,,SING,O3,HO3,,,28,,56123,16841,NAG
29,,SING,O4,HO4,,,29,,56123,16841,NAG
30,,SING,O6,HO6,,,30,,56123,16841,NAG
1,,SING,FE,NA,,,,,56145,16842,HEM
2,,SING,FE,NB,,,,,56145,16842,HEM
3,,SING,FE,NC,,,,,56145,16842,HEM
4,,SING,FE,ND,,,,,56145,16842,HEM
5,,DOUB,CHA,C1A,,,,,56145,16842,HEM
6,,SING,CHA,C4D,,,,,56145,16842,HEM
7,,SING,CHA,HHA,,,,,56145,16842,HEM
8,,DOUB,CHB,C4A,,,,,56145,16842,HEM
9,,SING,CHB,C1B,,,,,56145,16842,HEM
10,,SING,CHB,HHB,,,,,56145,16842,HEM
12,,SING,CHC,C1C,,,,,56145,16842,HEM
13,,SING,CHC,HHC,,,,,56145,16842,HEM
14,,SING,CHD,C4C,,,,,56145,16842,HEM
15,,DOUB,CHD,C1D,,,,,56145,16842,HEM
16,,SING,CHD,HHD,,,,,56145,16842,HEM
17,,SING,NA,C1A,,,,,56145,16842,HEM
18,,SING,NA,C4A,,,,,56145,16842,HEM
19,,SING,C1A,C2A,,,,,56145,16842,HEM
20,,DOUB,C2A,C3A,,,,,56145,16842,HEM
21,,SING,C2A,CAA,,,,,56145,16842,HEM
22,,SING,C3A,C4A,,,,,56145,16842,HEM
23,,SING,C3A,CMA,,,,,56145,16842,HEM
24,,SING,CMA,HMA1,,,,,56145,16842,HEM
25,,SING,CMA,HMA2,,,,,56145,16842,HEM
26,,SING,CMA,HMA3,,,,,56145,16842,HEM
27,,SING,CAA,CBA,,,,,56145,16842,HEM
28,,SING,CAA,HAA1,,,,,56145,16842,HEM
29,,SING,CAA,HAA2,,,,,56145,16842,HEM
30,,SING,CBA,CGA,,,,,56145,16842,HEM
31,,SING,CBA,HBA1,,,,,56145,16842,HEM
32,,SING,CBA,HBA2,,,,,56145,16842,HEM
33,,DOUB,CGA,O1A,,,,,56145,16842,HEM
34,,SING,CGA,O2A,,,,,56145,16842,HEM
35,,SING,O2A,H2A,,,,,56145,16842,HEM
36,,DOUB,NB,C1B,,,,,56145,16842,HEM
37,,SING,NB,C4B,,,,,56145,16842,HEM
38,,SING,C1B,C2B,,,,,56145,16842,HEM
39,,DOUB,C2B,C3B,,,,,56145,16842,HEM
40,,SING,C2B,CMB,,,,,56145,16842,HEM
41,,SING,C3B,C4B,,,,,56145,16842,HEM
42,,SING,C3B,CAB,,,,,56145,16842,HEM
43,,SING,CMB,HMB1,,,,,56145,16842,HEM
44,,SING,CMB,HMB2,,,,,56145,16842,HEM
45,,SING,CMB,HMB3,,,,,56145,16842,HEM
46,,DOUB,CAB,CBB,,,,,56145,16842,HEM
47,,SING,CAB,HAB,,,,,56145,16842,HEM
48,,SING,CBB,HBB1,,,,,56145,16842,HEM
49,,SING,CBB,HBB2,,,,,56145,16842,HEM
50,,SING,NC,C1C,,,,,56145,16842,HEM
51,,SING,NC,C4C,,,,,56145,16842,HEM
52,,DOUB,C1C,C2C,,,,,56145,16842,HEM
53,,SING,C2C,C3C,,,,,56145,16842,HEM
54,,SING,C2C,CMC,,,,,56145,16842,HEM
55,,DOUB,C3C,C4C,,,,,56145,16842,HEM
56,,SING,C3C,CAC,,,,,56145,16842,HEM
57,,SING,CMC,HMC1,,,,,56145,16842,HEM
58,,SING,CMC,HMC2,,,,,56145,16842,HEM
59,,SING,CMC,HMC3,,,,,56145,16842,HEM
60,,DOUB,CAC,CBC,,,,,56145,16842,HEM
61,,SING,CAC,HAC,,,,,56145,16842,HEM
62,,SING,CBC,HBC1,,,,,56145,16842,HEM
63,,SING,CBC,HBC2,,,,,56145,16842,HEM
64,,SING,ND,C1D,,,,,56145,16842,HEM
65,,DOUB,ND,C4D,,,,,56145,16842,HEM
66,,SING,C1D,C2D,,,,,56145,16842,HEM
67,,DOUB,C2D,C3D,,,,,56145,16842,HEM
68,,SING,C2D,CMD,,,,,56145,16842,HEM
69,,SING,C3D,C4D,,,,,56145,16842,HEM
70,,SING,C3D,CAD,,,,,56145,16842,HEM
71,,SING,CMD,HMD1,,,,,56145,16842,HEM
72,,SING,CMD,HMD2,,,,,56145,16842,HEM
73,,SING,CMD,HMD3,,,,,56145,16842,HEM
74,,SING,CAD,CBD,,,,,56145,16842,HEM
75,,SING,CAD,HAD1,,,,,56145,16842,HEM
76,,SING,CAD,HAD2,,,,,56145,16842,HEM
77,,SING,CBD,CGD,,,,,56145,16842,HEM
78,,SING,CBD,HBD1,,,,,56145,16842,HEM
79,,SING,CBD,HBD2,,,,,56145,16842,HEM
80,,DOUB,CGD,O1D,,,,,56145,16842,HEM
81,,SING,CGD,O2D,,,,,56145,16842,HEM
82,,SING,O2D,H2D,,,,,56145,16842,HEM
1,,SING,N1,C2,yes,N,1,,56325,16852,FOL
2,,SING,N1,C8A,yes,N,2,,56325,16852,FOL
3,,SING,N1,HN1,no,N,3,,56325,16852,FOL
4,,SING,C2,NA2,no,N,4,,56325,16852,FOL
5,,DOUB,C2,N3,yes,N,5,,56325,16852,FOL
6,,SING,NA2,HN21,no,N,6,,56325,16852,FOL
7,,SING,NA2,HN22,no,N,7,,56325,16852,FOL
8,,SING,N3,C4,yes,N,8,,56325,16852,FOL
9,,DOUB,C4,O4,no,N,9,,56325,16852,FOL
10,,SING,C4,C4A,yes,N,10,,56325,16852,FOL
11,,SING,C4A,N5,yes,N,11,,56325,16852,FOL
12,,DOUB,C4A,C8A,yes,N,12,,56325,16852,FOL
13,,DOUB,N5,C6,yes,N,13,,56325,16852,FOL
14,,SING,C6,C7,yes,N,14,,56325,16852,FOL
15,,SING,C6,C9,no,N,15,,56325,16852,FOL
16,,DOUB,C7,N8,yes,N,16,,56325,16852,FOL
17,,SING,C7,H7,no,N,17,,56325,16852,FOL
18,,SING,N8,C8A,yes,N,18,,56325,16852,FOL
19,,SING,C9,N10,no,N,19,,56325,16852,FOL
20,,SING,C9,H91,no,N,20,,56325,16852,FOL
21,,SING,C9,H92,no,N,21,,56325,16852,FOL
22,,SING,N10,C14,no,N,22,,56325,16852,FOL
23,,SING,N10,HN0,no,N,23,,56325,16852,FOL
24,,DOUB,C11,C12,yes,N,24,,56325,16852,FOL
25,,SING,C11,C16,yes,N,25,,56325,16852,FOL
26,,SING,C11,C,no,N,26,,56325,16852,FOL
27,,SING,C12,C13,yes,N,27,,56325,16852,FOL
28,,SING,C12,H12,no,N,28,,56325,16852,FOL
29,,DOUB,C13,C14,yes,N,29,,56325,16852,FOL
30,,SING,C13,H13,no,N,30,,56325,16852,FOL
31,,SING,C14,C15,yes,N,31,,56325,16852,FOL
32,,DOUB,C15,C16,yes,N,32,,56325,16852,FOL
33,,SING,C15,H15,no,N,33,,56325,16852,FOL
34,,SING,C16,H16,no,N,34,,56325,16852,FOL
35,,DOUB,C,O,no,N,35,,56325,16852,FOL
36,,SING,C,N,no,N,36,,56325,16852,FOL
37,,SING,N,CA,no,N,37,,56325,16852,FOL
38,,SING,N,HN,no,N,38,,56325,16852,FOL
39,,SING,CA,CB,no,N,39,,56325,16852,FOL
40,,SING,CA,CT,no,N,40,,56325,16852,FOL
41,,SING,CA,HA,no,N,41,,56325,16852,FOL
42,,SING,CB,CG,no,N,42,,56325,16852,FOL
43,,SING,CB,HB1,no,N,43,,56325,16852,FOL
44,,SING,CB,HB2,no,N,44,,56325,16852,FOL
45,,SING,CG,CD,no,N,45,,56325,16852,FOL
46,,SING,CG,HG1,no,N,46,,56325,16852,FOL
47,,SING,CG,HG2,no,N,47,,56325,16852,FOL
48,,DOUB,CD,OE1,no,N,48,,56325,16852,FOL
49,,SING,CD,OE2,no,N,49,,56325,16852,FOL
50,,SING,OE2,HOE2,no,N,50,,56325,16852,FOL
51,,DOUB,CT,O1,no,N,51,,56325,16852,FOL
52,,SING,CT,O2,no,N,52,,56325,16852,FOL
53,,SING,O2,HO2,no,N,53,,56325,16852,FOL
1,,DOUB,C1,O1A,no,N,1,,56349,16853,DPC
2,,SING,C1,O1B,no,N,2,,56349,16853,DPC
3,,SING,C1,C2,no,N,3,,56349,16853,DPC
4,,SING,O1B,HO1,no,N,4,,56349,16853,DPC
5,,DOUB,C2,C3,no,N,5,,56349,16853,DPC
6,,SING,C2,O6,no,N,6,,56349,16853,DPC
7,,SING,C3,C4,no,N,7,,56349,16853,DPC
8,,SING,C3,H3,no,N,8,,56349,16853,DPC
9,,SING,C4,C5,no,N,9,,56349,16853,DPC
10,,SING,C4,NE,no,N,10,,56349,16853,DPC
11,,SING,C4,H4,no,N,11,,56349,16853,DPC
12,,SING,C5,N5,no,N,12,,56349,16853,DPC
13,,SING,C5,C6,no,N,13,,56349,16853,DPC
14,,SING,C5,H5,no,N,14,,56349,16853,DPC
15,,SING,N5,C10,no,N,15,,56349,16853,DPC
16,,SING,N5,HN5,no,N,16,,56349,16853,DPC
17,,DOUB,C10,O10,no,N,17,,56349,16853,DPC
18,,SING,C10,C11,no,N,18,,56349,16853,DPC
19,,SING,C11,H111,no,N,19,,56349,16853,DPC
20,,SING,C11,H112,no,N,20,,56349,16853,DPC
21,,SING,C11,H113,no,N,21,,56349,16853,DPC
22,,SING,C6,O6,no,N,22,,56349,16853,DPC
23,,SING,C6,C7,no,N,23,,56349,16853,DPC
24,,SING,C6,H6,no,N,24,,56349,16853,DPC
25,,DOUB,C7,O7,no,N,25,,56349,16853,DPC
26,,SING,C7,N8,no,N,26,,56349,16853,DPC
27,,SING,N8,C81,no,N,27,,56349,16853,DPC
28,,SING,N8,C9,no,N,28,,56349,16853,DPC
29,,SING,C81,C82,no,N,29,,56349,16853,DPC
30,,SING,C81,H811,no,N,30,,56349,16853,DPC
31,,SING,C81,H812,no,N,31,,56349,16853,DPC
32,,SING,C82,CG,no,N,32,,56349,16853,DPC
33,,SING,C82,H821,no,N,33,,56349,16853,DPC
34,,SING,C82,H822,no,N,34,,56349,16853,DPC
35,,DOUB,CG,CD1,yes,N,35,,56349,16853,DPC
36,,SING,CG,CD2,yes,N,36,,56349,16853,DPC
37,,SING,CD1,CE1,yes,N,37,,56349,16853,DPC
38,,SING,CD1,HD1,no,N,38,,56349,16853,DPC
39,,DOUB,CD2,CE2,yes,N,39,,56349,16853,DPC
40,,SING,CD2,HD2,no,N,40,,56349,16853,DPC
41,,DOUB,CE1,CZ,yes,N,41,,56349,16853,DPC
42,,SING,CE1,HE1,no,N,42,,56349,16853,DPC
43,,SING,CE2,CZ,yes,N,43,,56349,16853,DPC
44,,SING,CE2,HE2,no,N,44,,56349,16853,DPC
45,,SING,CZ,HZ,no,N,45,,56349,16853,DPC
46,,SING,C9,C91,no,N,46,,56349,16853,DPC
47,,SING,C9,H91,no,N,47,,56349,16853,DPC
48,,SING,C9,H92,no,N,48,,56349,16853,DPC
49,,SING,C91,C92,no,N,49,,56349,16853,DPC
50,,SING,C91,H911,no,N,50,,56349,16853,DPC
51,,SING,C91,H912,no,N,51,,56349,16853,DPC
52,,SING,C92,H921,no,N,52,,56349,16853,DPC
53,,SING,C92,H922,no,N,53,,56349,16853,DPC
54,,SING,C92,H923,no,N,54,,56349,16853,DPC
55,,SING,NE,HNE1,no,N,55,,56349,16853,DPC
56,,SING,NE,HNE2,no,N,56,,56349,16853,DPC
1,,DOUB,OH,CH,,,1,,56418,16858,ALY
2,,SING,CH,CH3,,,2,,56418,16858,ALY
3,,SING,CH,NZ,,,3,,56418,16858,ALY
4,,SING,CH3,HH31,,,4,,56418,16858,ALY
5,,SING,CH3,HH32,,,5,,56418,16858,ALY
6,,SING,CH3,HH33,,,6,,56418,16858,ALY
7,,SING,NZ,CE,,,7,,56418,16858,ALY
8,,SING,NZ,HZ,,,8,,56418,16858,ALY
9,,SING,CE,CD,,,9,,56418,16858,ALY
10,,SING,CE,HE3,,,10,,56418,16858,ALY
11,,SING,CE,HE2,,,11,,56418,16858,ALY
12,,SING,CD,CG,,,12,,56418,16858,ALY
13,,SING,CD,HD3,,,13,,56418,16858,ALY
14,,SING,CD,HD2,,,14,,56418,16858,ALY
15,,SING,CG,CB,,,15,,56418,16858,ALY
16,,SING,CG,HG3,,,16,,56418,16858,ALY
17,,SING,CG,HG2,,,17,,56418,16858,ALY
18,,SING,CB,CA,,,18,,56418,16858,ALY
19,,SING,CB,HB3,,,19,,56418,16858,ALY
20,,SING,CB,HB2,,,20,,56418,16858,ALY
21,,SING,CA,N,,,21,,56418,16858,ALY
22,,SING,CA,C,,,22,,56418,16858,ALY
23,,SING,CA,HCA,,,23,,56418,16858,ALY
24,,SING,N,H,,,24,,56418,16858,ALY
25,,SING,N,H2,,,25,,56418,16858,ALY
26,,DOUB,C,O,,,26,,56418,16858,ALY
27,,SING,C,OXT,,,27,,56418,16858,ALY
28,,SING,OXT,HXT,,,28,,56418,16858,ALY
1,,DOUB,OH,CH,,,1,,56448,16859,ALY
2,,SING,CH,CH3,,,2,,56448,16859,ALY
3,,SING,CH,NZ,,,3,,56448,16859,ALY
4,,SING,CH3,HH31,,,4,,56448,16859,ALY
5,,SING,CH3,HH32,,,5,,56448,16859,ALY
6,,SING,CH3,HH33,,,6,,56448,16859,ALY
7,,SING,NZ,CE,,,7,,56448,16859,ALY
8,,SING,NZ,HZ,,,8,,56448,16859,ALY
9,,SING,CE,CD,,,9,,56448,16859,ALY
10,,SING,CE,HE3,,,10,,56448,16859,ALY
11,,SING,CE,HE2,,,11,,56448,16859,ALY
12,,SING,CD,CG,,,12,,56448,16859,ALY
13,,SING,CD,HD3,,,13,,56448,16859,ALY
14,,SING,CD,HD2,,,14,,56448,16859,ALY
15,,SING,CG,CB,,,15,,56448,16859,ALY
16,,SING,CG,HG3,,,16,,56448,16859,ALY
17,,SING,CG,HG2,,,17,,56448,16859,ALY
18,,SING,CB,CA,,,18,,56448,16859,ALY
19,,SING,CB,HB3,,,19,,56448,16859,ALY
20,,SING,CB,HB2,,,20,,56448,16859,ALY
21,,SING,CA,N,,,21,,56448,16859,ALY
22,,SING,CA,C,,,22,,56448,16859,ALY
23,,SING,CA,HCA,,,23,,56448,16859,ALY
24,,SING,N,H,,,24,,56448,16859,ALY
25,,SING,N,H2,,,25,,56448,16859,ALY
26,,DOUB,C,O,,,26,,56448,16859,ALY
27,,SING,C,OXT,,,27,,56448,16859,ALY
28,,SING,OXT,HXT,,,28,,56448,16859,ALY
1,,SING,O23,P24,,,1,,56476,16860,PNS
2,,SING,O23,HOP1,,,2,,56476,16860,PNS
3,,SING,P24,O25,,,3,,56476,16860,PNS
4,,DOUB,P24,O26,,,4,,56476,16860,PNS
5,,SING,P24,O27,,,5,,56476,16860,PNS
6,,SING,O25,HOP2,,,6,,56476,16860,PNS
7,,SING,O27,C28,,,7,,56476,16860,PNS
8,,SING,C28,C29,,,8,,56476,16860,PNS
9,,SING,C28,H282,,,9,,56476,16860,PNS
10,,SING,C28,H281,,,10,,56476,16860,PNS
11,,SING,C29,C30,,,11,,56476,16860,PNS
12,,SING,C29,C31,,,12,,56476,16860,PNS
13,,SING,C29,C32,,,13,,56476,16860,PNS
14,,SING,C30,H303,,,14,,56476,16860,PNS
15,,SING,C30,H302,,,15,,56476,16860,PNS
16,,SING,C30,H301,,,16,,56476,16860,PNS
17,,SING,C31,H313,,,17,,56476,16860,PNS
18,,SING,C31,H312,,,18,,56476,16860,PNS
19,,SING,C31,H311,,,19,,56476,16860,PNS
20,,SING,C32,O33,,,20,,56476,16860,PNS
21,,SING,C32,C34,,,21,,56476,16860,PNS
22,,SING,C32,H32,,,22,,56476,16860,PNS
23,,SING,O33,H33,,,23,,56476,16860,PNS
24,,DOUB,C34,O35,,,24,,56476,16860,PNS
25,,SING,C34,N36,,,25,,56476,16860,PNS
26,,SING,N36,C37,,,26,,56476,16860,PNS
27,,SING,N36,H36,,,27,,56476,16860,PNS
28,,SING,C37,C38,,,28,,56476,16860,PNS
29,,SING,C37,H372,,,29,,56476,16860,PNS
30,,SING,C37,H371,,,30,,56476,16860,PNS
31,,SING,C38,C39,,,31,,56476,16860,PNS
32,,SING,C38,H382,,,32,,56476,16860,PNS
33,,SING,C38,H381,,,33,,56476,16860,PNS
34,,DOUB,C39,O40,,,34,,56476,16860,PNS
35,,SING,C39,N41,,,35,,56476,16860,PNS
36,,SING,N41,C42,,,36,,56476,16860,PNS
37,,SING,N41,H41,,,37,,56476,16860,PNS
38,,SING,C42,C43,,,38,,56476,16860,PNS
39,,SING,C42,H422,,,39,,56476,16860,PNS
40,,SING,C42,H421,,,40,,56476,16860,PNS
41,,SING,C43,S44,,,41,,56476,16860,PNS
42,,SING,C43,H431,,,42,,56476,16860,PNS
43,,SING,C43,H432,,,43,,56476,16860,PNS
44,,SING,S44,H44,,,44,,56476,16860,PNS
1,,DOUB,OH,CH,,,1,,56532,16861,ALY
2,,SING,CH,CH3,,,2,,56532,16861,ALY
3,,SING,CH,NZ,,,3,,56532,16861,ALY
4,,SING,CH3,HH31,,,4,,56532,16861,ALY
5,,SING,CH3,HH32,,,5,,56532,16861,ALY
6,,SING,CH3,HH33,,,6,,56532,16861,ALY
7,,SING,NZ,CE,,,7,,56532,16861,ALY
8,,SING,NZ,HZ,,,8,,56532,16861,ALY
9,,SING,CE,CD,,,9,,56532,16861,ALY
10,,SING,CE,HE3,,,10,,56532,16861,ALY
11,,SING,CE,HE2,,,11,,56532,16861,ALY
12,,SING,CD,CG,,,12,,56532,16861,ALY
13,,SING,CD,HD3,,,13,,56532,16861,ALY
14,,SING,CD,HD2,,,14,,56532,16861,ALY
15,,SING,CG,CB,,,15,,56532,16861,ALY
16,,SING,CG,HG3,,,16,,56532,16861,ALY
17,,SING,CG,HG2,,,17,,56532,16861,ALY
18,,SING,CB,CA,,,18,,56532,16861,ALY
19,,SING,CB,HB3,,,19,,56532,16861,ALY
20,,SING,CB,HB2,,,20,,56532,16861,ALY
21,,SING,CA,N,,,21,,56532,16861,ALY
22,,SING,CA,C,,,22,,56532,16861,ALY
23,,SING,CA,HCA,,,23,,56532,16861,ALY
24,,SING,N,H,,,24,,56532,16861,ALY
25,,SING,N,H2,,,25,,56532,16861,ALY
26,,DOUB,C,O,,,26,,56532,16861,ALY
27,,SING,C,OXT,,,27,,56532,16861,ALY
28,,SING,OXT,HXT,,,28,,56532,16861,ALY
1,,SING,C1A,C2A,,,1,,56616,16865,SAC
2,,DOUB,C1A,OAC,,,2,,56616,16865,SAC
3,,SING,C1A,N,,,3,,56616,16865,SAC
4,,SING,C2A,H2A1,,,4,,56616,16865,SAC
5,,SING,C2A,H2A2,,,5,,56616,16865,SAC
6,,SING,C2A,H2A3,,,6,,56616,16865,SAC
7,,SING,N,CA,,,7,,56616,16865,SAC
8,,SING,N,H,,,8,,56616,16865,SAC
9,,SING,CA,C,,,9,,56616,16865,SAC
10,,SING,CA,CB,,,10,,56616,16865,SAC
11,,SING,CA,HA,,,11,,56616,16865,SAC
12,,DOUB,C,O,,,12,,56616,16865,SAC
13,,SING,C,OXT,,,13,,56616,16865,SAC
14,,SING,OXT,HXT,,,14,,56616,16865,SAC
15,,SING,CB,OG,,,15,,56616,16865,SAC
16,,SING,CB,HB2,,,16,,56616,16865,SAC
17,,SING,CB,HB3,,,17,,56616,16865,SAC
18,,SING,OG,HG,,,18,,56616,16865,SAC
1,,SING,N1,C2,,,1,,56618,16865,ACS
2,,SING,N1,H12,,,2,,56618,16865,ACS
3,,SING,N1,H11,,,3,,56618,16865,ACS
4,,SING,C2,C3,,,4,,56618,16865,ACS
5,,SING,C2,C6,,,5,,56618,16865,ACS
6,,SING,C2,H2,,,6,,56618,16865,ACS
7,,SING,C3,O4,,,7,,56618,16865,ACS
8,,DOUB,C3,O5,,,8,,56618,16865,ACS
9,,SING,O4,H4O,,,9,,56618,16865,ACS
10,,SING,C6,C7,,,10,,56618,16865,ACS
11,,SING,C6,H62,,,11,,56618,16865,ACS
12,,SING,C6,H61,,,12,,56618,16865,ACS
13,,SING,C7,C10,,,13,,56618,16865,ACS
14,,SING,C7,H72,,,14,,56618,16865,ACS
15,,SING,C7,H71,,,15,,56618,16865,ACS
16,,SING,C10,C13,,,16,,56618,16865,ACS
17,,SING,C10,H102,,,17,,56618,16865,ACS
18,,SING,C10,H101,,,18,,56618,16865,ACS
19,,SING,C13,N16,,,19,,56618,16865,ACS
20,,DOUB,C13,O17,,,20,,56618,16865,ACS
21,,SING,N16,C18,,,21,,56618,16865,ACS
22,,SING,N16,H16,,,22,,56618,16865,ACS
23,,SING,C18,C19,,,23,,56618,16865,ACS
24,,SING,C18,C42,,,24,,56618,16865,ACS
25,,SING,C18,H18,,,25,,56618,16865,ACS
26,,DOUB,C19,O20,,,26,,56618,16865,ACS
27,,SING,C19,N21,,,27,,56618,16865,ACS
28,,SING,N21,C22,,,28,,56618,16865,ACS
29,,SING,N21,C42,,,29,,56618,16865,ACS
30,,SING,C22,C23,,,30,,56618,16865,ACS
31,,SING,C22,C24,,,31,,56618,16865,ACS
32,,SING,C22,H22,,,32,,56618,16865,ACS
33,,SING,C23,O35,,,33,,56618,16865,ACS
34,,DOUB,C23,O36,,,34,,56618,16865,ACS
35,,SING,C24,S25,,,35,,56618,16865,ACS
36,,SING,C24,H242,,,36,,56618,16865,ACS
37,,SING,C24,H241,,,37,,56618,16865,ACS
38,,DOUB,S25,O28,,,38,,56618,16865,ACS
39,,SING,S25,C29,,,39,,56618,16865,ACS
40,,SING,C29,H293,,,40,,56618,16865,ACS
41,,SING,C29,H292,,,41,,56618,16865,ACS
42,,SING,C29,H291,,,42,,56618,16865,ACS
43,,SING,O35,H35,,,43,,56618,16865,ACS
44,,SING,C42,S44,,,44,,56618,16865,ACS
45,,SING,C42,H42,,,45,,56618,16865,ACS
46,,SING,S44,H44,,,46,,56618,16865,ACS
1,,DOUB,C1,O1,no,N,1,,57053,16888,MYR
2,,SING,C1,O2,no,N,2,,57053,16888,MYR
3,,SING,C1,C2,no,N,3,,57053,16888,MYR
4,,SING,O2,HO2,no,N,4,,57053,16888,MYR
5,,SING,C2,C3,no,N,5,,57053,16888,MYR
6,,SING,C2,H21,no,N,6,,57053,16888,MYR
7,,SING,C2,H22,no,N,7,,57053,16888,MYR
8,,SING,C3,C4,no,N,8,,57053,16888,MYR
9,,SING,C3,H31,no,N,9,,57053,16888,MYR
10,,SING,C3,H32,no,N,10,,57053,16888,MYR
11,,SING,C4,C5,no,N,11,,57053,16888,MYR
12,,SING,C4,H41,no,N,12,,57053,16888,MYR
13,,SING,C4,H42,no,N,13,,57053,16888,MYR
14,,SING,C5,C6,no,N,14,,57053,16888,MYR
15,,SING,C5,H51,no,N,15,,57053,16888,MYR
16,,SING,C5,H52,no,N,16,,57053,16888,MYR
17,,SING,C6,C7,no,N,17,,57053,16888,MYR
18,,SING,C6,H61,no,N,18,,57053,16888,MYR
19,,SING,C6,H62,no,N,19,,57053,16888,MYR
20,,SING,C7,C8,no,N,20,,57053,16888,MYR
21,,SING,C7,H71,no,N,21,,57053,16888,MYR
22,,SING,C7,H72,no,N,22,,57053,16888,MYR
23,,SING,C8,C9,no,N,23,,57053,16888,MYR
24,,SING,C8,H81,no,N,24,,57053,16888,MYR
25,,SING,C8,H82,no,N,25,,57053,16888,MYR
26,,SING,C9,C10,no,N,26,,57053,16888,MYR
27,,SING,C9,H91,no,N,27,,57053,16888,MYR
28,,SING,C9,H92,no,N,28,,57053,16888,MYR
29,,SING,C10,C11,no,N,29,,57053,16888,MYR
30,,SING,C10,H101,no,N,30,,57053,16888,MYR
31,,SING,C10,H102,no,N,31,,57053,16888,MYR
32,,SING,C11,C12,no,N,32,,57053,16888,MYR
33,,SING,C11,H111,no,N,33,,57053,16888,MYR
34,,SING,C11,H112,no,N,34,,57053,16888,MYR
35,,SING,C12,C13,no,N,35,,57053,16888,MYR
36,,SING,C12,H121,no,N,36,,57053,16888,MYR
37,,SING,C12,H122,no,N,37,,57053,16888,MYR
38,,SING,C13,C14,no,N,38,,57053,16888,MYR
39,,SING,C13,H131,no,N,39,,57053,16888,MYR
40,,SING,C13,H132,no,N,40,,57053,16888,MYR
41,,SING,C14,H141,no,N,41,,57053,16888,MYR
42,,SING,C14,H142,no,N,42,,57053,16888,MYR
43,,SING,C14,H143,no,N,43,,57053,16888,MYR
1,,DOUB,C1,O1,no,N,1,,57072,16889,MYR
2,,SING,C1,O2,no,N,2,,57072,16889,MYR
3,,SING,C1,C2,no,N,3,,57072,16889,MYR
4,,SING,O2,HO2,no,N,4,,57072,16889,MYR
5,,SING,C2,C3,no,N,5,,57072,16889,MYR
6,,SING,C2,H21,no,N,6,,57072,16889,MYR
7,,SING,C2,H22,no,N,7,,57072,16889,MYR
8,,SING,C3,C4,no,N,8,,57072,16889,MYR
9,,SING,C3,H31,no,N,9,,57072,16889,MYR
10,,SING,C3,H32,no,N,10,,57072,16889,MYR
11,,SING,C4,C5,no,N,11,,57072,16889,MYR
12,,SING,C4,H41,no,N,12,,57072,16889,MYR
13,,SING,C4,H42,no,N,13,,57072,16889,MYR
14,,SING,C5,C6,no,N,14,,57072,16889,MYR
15,,SING,C5,H51,no,N,15,,57072,16889,MYR
16,,SING,C5,H52,no,N,16,,57072,16889,MYR
17,,SING,C6,C7,no,N,17,,57072,16889,MYR
18,,SING,C6,H61,no,N,18,,57072,16889,MYR
19,,SING,C6,H62,no,N,19,,57072,16889,MYR
20,,SING,C7,C8,no,N,20,,57072,16889,MYR
21,,SING,C7,H71,no,N,21,,57072,16889,MYR
22,,SING,C7,H72,no,N,22,,57072,16889,MYR
23,,SING,C8,C9,no,N,23,,57072,16889,MYR
24,,SING,C8,H81,no,N,24,,57072,16889,MYR
25,,SING,C8,H82,no,N,25,,57072,16889,MYR
26,,SING,C9,C10,no,N,26,,57072,16889,MYR
27,,SING,C9,H91,no,N,27,,57072,16889,MYR
28,,SING,C9,H92,no,N,28,,57072,16889,MYR
29,,SING,C10,C11,no,N,29,,57072,16889,MYR
30,,SING,C10,H101,no,N,30,,57072,16889,MYR
31,,SING,C10,H102,no,N,31,,57072,16889,MYR
32,,SING,C11,C12,no,N,32,,57072,16889,MYR
33,,SING,C11,H111,no,N,33,,57072,16889,MYR
34,,SING,C11,H112,no,N,34,,57072,16889,MYR
35,,SING,C12,C13,no,N,35,,57072,16889,MYR
36,,SING,C12,H121,no,N,36,,57072,16889,MYR
37,,SING,C12,H122,no,N,37,,57072,16889,MYR
38,,SING,C13,C14,no,N,38,,57072,16889,MYR
39,,SING,C13,H131,no,N,39,,57072,16889,MYR
40,,SING,C13,H132,no,N,40,,57072,16889,MYR
41,,SING,C14,H141,no,N,41,,57072,16889,MYR
42,,SING,C14,H142,no,N,42,,57072,16889,MYR
43,,SING,C14,H143,no,N,43,,57072,16889,MYR
1,,SING,P1,O1,no,N,1,,57073,16889,PBU
2,,SING,P1,OP1,no,N,2,,57073,16889,PBU
3,,DOUB,P1,OP2,no,N,3,,57073,16889,PBU
4,,SING,P1,OP3,no,N,4,,57073,16889,PBU
5,,SING,P4,O4,no,N,5,,57073,16889,PBU
6,,DOUB,P4,O41,no,N,6,,57073,16889,PBU
7,,SING,P4,O42,no,N,7,,57073,16889,PBU
8,,SING,P4,O43,no,N,8,,57073,16889,PBU
9,,SING,P5,O5,no,N,9,,57073,16889,PBU
10,,DOUB,P5,O51,no,N,10,,57073,16889,PBU
11,,SING,P5,O52,no,N,11,,57073,16889,PBU
12,,SING,P5,O53,no,N,12,,57073,16889,PBU
13,,SING,C3',C2',no,N,13,,57073,16889,PBU
14,,SING,C3',OP1,no,N,14,,57073,16889,PBU
15,,SING,C3',H3'1,no,N,15,,57073,16889,PBU
16,,SING,C3',H3'2,no,N,16,,57073,16889,PBU
17,,SING,C2',O2',no,N,17,,57073,16889,PBU
18,,SING,C2',C1',no,N,18,,57073,16889,PBU
19,,SING,C2',H2',no,N,19,,57073,16889,PBU
20,,SING,O2',C7,no,N,20,,57073,16889,PBU
21,,SING,C1',O1',no,N,21,,57073,16889,PBU
22,,SING,C1',H1'1,no,N,22,,57073,16889,PBU
23,,SING,C1',H1'2,no,N,23,,57073,16889,PBU
24,,SING,O1',C11,no,N,24,,57073,16889,PBU
25,,SING,C1,O1,no,N,25,,57073,16889,PBU
26,,SING,C1,C2,no,N,26,,57073,16889,PBU
27,,SING,C1,C6,no,N,27,,57073,16889,PBU
28,,SING,C1,H1,no,N,28,,57073,16889,PBU
29,,SING,C2,O2,no,N,29,,57073,16889,PBU
30,,SING,C2,C3,no,N,30,,57073,16889,PBU
31,,SING,C2,H2,no,N,31,,57073,16889,PBU
32,,SING,O2,H02,no,N,32,,57073,16889,PBU
33,,SING,C3,O3,no,N,33,,57073,16889,PBU
34,,SING,C3,C4,no,N,34,,57073,16889,PBU
35,,SING,C3,H3,no,N,35,,57073,16889,PBU
36,,SING,O3,H03,no,N,36,,57073,16889,PBU
37,,SING,C4,O4,no,N,37,,57073,16889,PBU
38,,SING,C4,C5,no,N,38,,57073,16889,PBU
39,,SING,C4,H4,no,N,39,,57073,16889,PBU
40,,SING,C5,O5,no,N,40,,57073,16889,PBU
41,,SING,C5,C6,no,N,41,,57073,16889,PBU
42,,SING,C5,H5,no,N,42,,57073,16889,PBU
43,,SING,C6,O6,no,N,43,,57073,16889,PBU
44,,SING,C6,H6,no,N,44,,57073,16889,PBU
45,,SING,O6,H06,no,N,45,,57073,16889,PBU
46,,DOUB,C7,O7,no,N,46,,57073,16889,PBU
47,,SING,C7,C8,no,N,47,,57073,16889,PBU
48,,SING,C8,C9,no,N,48,,57073,16889,PBU
49,,SING,C8,H81,no,N,49,,57073,16889,PBU
50,,SING,C8,H82,no,N,50,,57073,16889,PBU
51,,SING,C9,C10,no,N,51,,57073,16889,PBU
52,,SING,C9,H91,no,N,52,,57073,16889,PBU
53,,SING,C9,H92,no,N,53,,57073,16889,PBU
54,,SING,C10,H11,no,N,54,,57073,16889,PBU
55,,SING,C10,H12,no,N,55,,57073,16889,PBU
56,,SING,C10,H13,no,N,56,,57073,16889,PBU
57,,DOUB,C11,O11,no,N,57,,57073,16889,PBU
58,,SING,C11,C12,no,N,58,,57073,16889,PBU
59,,SING,C12,C13,no,N,59,,57073,16889,PBU
60,,SING,C12,H121,no,N,60,,57073,16889,PBU
61,,SING,C12,H122,no,N,61,,57073,16889,PBU
62,,SING,C13,C14,no,N,62,,57073,16889,PBU
63,,SING,C13,H131,no,N,63,,57073,16889,PBU
64,,SING,C13,H132,no,N,64,,57073,16889,PBU
65,,SING,C14,H141,no,N,65,,57073,16889,PBU
66,,SING,C14,H142,no,N,66,,57073,16889,PBU
67,,SING,C14,H143,no,N,67,,57073,16889,PBU
68,,SING,O42,H42,no,N,68,,57073,16889,PBU
69,,SING,O43,H43,no,N,69,,57073,16889,PBU
70,,SING,O52,H52,no,N,70,,57073,16889,PBU
71,,SING,O53,H53,no,N,71,,57073,16889,PBU
72,,SING,OP3,HP3,no,N,72,,57073,16889,PBU
1,,SING,FE,NA,,,,,57110,16891,HEM
2,,SING,FE,NB,,,,,57110,16891,HEM
3,,SING,FE,NC,,,,,57110,16891,HEM
4,,SING,FE,ND,,,,,57110,16891,HEM
5,,DOUB,CHA,C1A,,,,,57110,16891,HEM
6,,SING,CHA,C4D,,,,,57110,16891,HEM
7,,SING,CHA,HHA,,,,,57110,16891,HEM
8,,DOUB,CHB,C4A,,,,,57110,16891,HEM
9,,SING,CHB,C1B,,,,,57110,16891,HEM
10,,SING,CHB,HHB,,,,,57110,16891,HEM
11,,DOUB,CHC,C4B,,,,,57110,16891,HEM
12,,SING,CHC,C1C,,,,,57110,16891,HEM
13,,SING,CHC,HHC,,,,,57110,16891,HEM
14,,SING,CHD,C4C,,,,,57110,16891,HEM
15,,DOUB,CHD,C1D,,,,,57110,16891,HEM
16,,SING,CHD,HHD,,,,,57110,16891,HEM
17,,SING,NA,C1A,,,,,57110,16891,HEM
18,,SING,NA,C4A,,,,,57110,16891,HEM
19,,SING,C1A,C2A,,,,,57110,16891,HEM
20,,DOUB,C2A,C3A,,,,,57110,16891,HEM
21,,SING,C2A,CAA,,,,,57110,16891,HEM
22,,SING,C3A,C4A,,,,,57110,16891,HEM
23,,SING,C3A,CMA,,,,,57110,16891,HEM
24,,SING,CMA,HMA1,,,,,57110,16891,HEM
25,,SING,CMA,HMA2,,,,,57110,16891,HEM
26,,SING,CMA,HMA3,,,,,57110,16891,HEM
27,,SING,CAA,CBA,,,,,57110,16891,HEM
28,,SING,CAA,HAA1,,,,,57110,16891,HEM
29,,SING,CAA,HAA2,,,,,57110,16891,HEM
30,,SING,CBA,CGA,,,,,57110,16891,HEM
31,,SING,CBA,HBA1,,,,,57110,16891,HEM
32,,SING,CBA,HBA2,,,,,57110,16891,HEM
33,,DOUB,CGA,O1A,,,,,57110,16891,HEM
34,,SING,CGA,O2A,,,,,57110,16891,HEM
35,,SING,O2A,H2A,,,,,57110,16891,HEM
36,,DOUB,NB,C1B,,,,,57110,16891,HEM
37,,SING,NB,C4B,,,,,57110,16891,HEM
38,,SING,C1B,C2B,,,,,57110,16891,HEM
39,,DOUB,C2B,C3B,,,,,57110,16891,HEM
40,,SING,C2B,CMB,,,,,57110,16891,HEM
41,,SING,C3B,C4B,,,,,57110,16891,HEM
42,,SING,C3B,CAB,,,,,57110,16891,HEM
43,,SING,CMB,HMB1,,,,,57110,16891,HEM
44,,SING,CMB,HMB2,,,,,57110,16891,HEM
45,,SING,CMB,HMB3,,,,,57110,16891,HEM
46,,DOUB,CAB,CBB,,,,,57110,16891,HEM
47,,SING,CAB,HAB,,,,,57110,16891,HEM
48,,SING,CBB,HBB1,,,,,57110,16891,HEM
49,,SING,CBB,HBB2,,,,,57110,16891,HEM
50,,SING,NC,C1C,,,,,57110,16891,HEM
51,,SING,NC,C4C,,,,,57110,16891,HEM
52,,DOUB,C1C,C2C,,,,,57110,16891,HEM
53,,SING,C2C,C3C,,,,,57110,16891,HEM
54,,SING,C2C,CMC,,,,,57110,16891,HEM
55,,DOUB,C3C,C4C,,,,,57110,16891,HEM
56,,SING,C3C,CAC,,,,,57110,16891,HEM
57,,SING,CMC,HMC1,,,,,57110,16891,HEM
58,,SING,CMC,HMC2,,,,,57110,16891,HEM
59,,SING,CMC,HMC3,,,,,57110,16891,HEM
60,,DOUB,CAC,CBC,,,,,57110,16891,HEM
61,,SING,CAC,HAC,,,,,57110,16891,HEM
62,,SING,CBC,HBC1,,,,,57110,16891,HEM
63,,SING,CBC,HBC2,,,,,57110,16891,HEM
64,,SING,ND,C1D,,,,,57110,16891,HEM
65,,DOUB,ND,C4D,,,,,57110,16891,HEM
66,,SING,C1D,C2D,,,,,57110,16891,HEM
67,,DOUB,C2D,C3D,,,,,57110,16891,HEM
68,,SING,C2D,CMD,,,,,57110,16891,HEM
69,,SING,C3D,C4D,,,,,57110,16891,HEM
70,,SING,C3D,CAD,,,,,57110,16891,HEM
71,,SING,CMD,HMD1,,,,,57110,16891,HEM
72,,SING,CMD,HMD2,,,,,57110,16891,HEM
73,,SING,CMD,HMD3,,,,,57110,16891,HEM
74,,SING,CAD,CBD,,,,,57110,16891,HEM
75,,SING,CAD,HAD1,,,,,57110,16891,HEM
76,,SING,CAD,HAD2,,,,,57110,16891,HEM
77,,SING,CBD,CGD,,,,,57110,16891,HEM
78,,SING,CBD,HBD1,,,,,57110,16891,HEM
79,,SING,CBD,HBD2,,,,,57110,16891,HEM
80,,DOUB,CGD,O1D,,,,,57110,16891,HEM
81,,SING,CGD,O2D,,,,,57110,16891,HEM
82,,SING,O2D,H2D,,,,,57110,16891,HEM
1,,SING,C1,N2,,,,,57157,16894,IMY
2,,DOUB,C1,N5,,,,,57157,16894,IMY
3,,SING,C1,C34,,,,,57157,16894,IMY
4,,SING,N2,C3,,,,,57157,16894,IMY
5,,SING,N2,C2,,,,,57157,16894,IMY
6,,SING,C3,C4,,,,,57157,16894,IMY
7,,SING,C3,C13,,,,,57157,16894,IMY
8,,SING,C3,H3,,,,,57157,16894,IMY
9,,SING,C4,N5,,,,,57157,16894,IMY
10,,SING,C4,C19,,,,,57157,16894,IMY
11,,SING,C4,H4,,,,,57157,16894,IMY
12,,SING,C13,C14,,,,,57157,16894,IMY
13,,DOUB,C13,C18,,,,,57157,16894,IMY
14,,DOUB,C14,C15,,,,,57157,16894,IMY
15,,SING,C14,H14,,,,,57157,16894,IMY
16,,SING,C15,C16,,,,,57157,16894,IMY
17,,SING,C15,H15,,,,,57157,16894,IMY
18,,DOUB,C16,C17,,,,,57157,16894,IMY
19,,SING,C16,CL16,,,,,57157,16894,IMY
20,,SING,C17,C18,,,,,57157,16894,IMY
21,,SING,C17,H17,,,,,57157,16894,IMY
22,,SING,C18,H18,,,,,57157,16894,IMY
23,,SING,C20,C21,,,,,57157,16894,IMY
24,,DOUB,C20,C19,,,,,57157,16894,IMY
25,,SING,C20,H20,,,,,57157,16894,IMY
26,,DOUB,C21,C22,,,,,57157,16894,IMY
27,,SING,C21,H21,,,,,57157,16894,IMY
28,,SING,C22,C23,,,,,57157,16894,IMY
29,,SING,C22,CL22,,,,,57157,16894,IMY
30,,DOUB,C23,C24,,,,,57157,16894,IMY
31,,SING,C23,H23,,,,,57157,16894,IMY
32,,SING,C24,C19,,,,,57157,16894,IMY
33,,SING,C24,H24,,,,,57157,16894,IMY
34,,DOUB,C28,C29,,,,,57157,16894,IMY
35,,SING,C28,C27,,,,,57157,16894,IMY
36,,SING,C28,H28,,,,,57157,16894,IMY
37,,SING,C29,C34,,,,,57157,16894,IMY
38,,SING,C29,O3,,,,,57157,16894,IMY
39,,DOUB,C34,C25,,,,,57157,16894,IMY
40,,SING,C25,C26,,,,,57157,16894,IMY
41,,SING,C25,H25,,,,,57157,16894,IMY
42,,DOUB,C26,C27,,,,,57157,16894,IMY
43,,SING,C26,H26,,,,,57157,16894,IMY
44,,SING,C27,O2,,,,,57157,16894,IMY
45,,SING,O3,C31,,,,,57157,16894,IMY
46,,SING,C31,C32,,,,,57157,16894,IMY
47,,SING,C31,C33,,,,,57157,16894,IMY
48,,SING,C31,H31,,,,,57157,16894,IMY
49,,SING,C32,H321,,,,,57157,16894,IMY
50,,SING,C32,H322,,,,,57157,16894,IMY
51,,SING,C32,H323,,,,,57157,16894,IMY
52,,SING,C33,H331,,,,,57157,16894,IMY
53,,SING,C33,H332,,,,,57157,16894,IMY
54,,SING,C33,H333,,,,,57157,16894,IMY
55,,SING,O2,C30,,,,,57157,16894,IMY
56,,SING,C30,H30,,,,,57157,16894,IMY
57,,SING,C30,H301,,,,,57157,16894,IMY
58,,SING,C30,H302,,,,,57157,16894,IMY
59,,DOUB,C2,O1,,,,,57157,16894,IMY
60,,SING,C2,N1,,,,,57157,16894,IMY
61,,SING,N1,C5,,,,,57157,16894,IMY
62,,SING,N1,C8,,,,,57157,16894,IMY
63,,SING,C5,C6,,,,,57157,16894,IMY
64,,SING,C5,H51,,,,,57157,16894,IMY
65,,SING,C5,H52,,,,,57157,16894,IMY
66,,SING,C6,N3,,,,,57157,16894,IMY
67,,SING,C6,H61,,,,,57157,16894,IMY
68,,SING,C6,H62,,,,,57157,16894,IMY
69,,SING,N3,C7,,,,,57157,16894,IMY
70,,SING,N3,HN3,,,,,57157,16894,IMY
71,,SING,C7,C8,,,,,57157,16894,IMY
72,,SING,C7,H71,,,,,57157,16894,IMY
73,,SING,C7,H72,,,,,57157,16894,IMY
74,,SING,C8,H81,,,,,57157,16894,IMY
75,,SING,C8,H82,,,,,57157,16894,IMY
1,,DOUB,PG,O1G,no,N,1,,57561,16916,ACP
2,,SING,PG,O2G,no,N,2,,57561,16916,ACP
3,,SING,PG,O3G,no,N,3,,57561,16916,ACP
4,,SING,PG,C3B,no,N,4,,57561,16916,ACP
5,,SING,O2G,HOG2,no,N,5,,57561,16916,ACP
6,,SING,O3G,HOG3,no,N,6,,57561,16916,ACP
7,,DOUB,PB,O1B,no,N,7,,57561,16916,ACP
8,,SING,PB,O2B,no,N,8,,57561,16916,ACP
9,,SING,PB,C3B,no,N,9,,57561,16916,ACP
10,,SING,PB,O3A,no,N,10,,57561,16916,ACP
11,,SING,O2B,HOB2,no,N,11,,57561,16916,ACP
12,,SING,C3B,H3B1,no,N,12,,57561,16916,ACP
13,,SING,C3B,H3B2,no,N,13,,57561,16916,ACP
14,,DOUB,PA,O1A,no,N,14,,57561,16916,ACP
15,,SING,PA,O2A,no,N,15,,57561,16916,ACP
16,,SING,PA,O3A,no,N,16,,57561,16916,ACP
17,,SING,PA,O5',no,N,17,,57561,16916,ACP
18,,SING,O2A,HOA2,no,N,18,,57561,16916,ACP
19,,SING,O5',C5',no,N,19,,57561,16916,ACP
20,,SING,C5',C4',no,N,20,,57561,16916,ACP
21,,SING,C5',H5'1,no,N,21,,57561,16916,ACP
22,,SING,C5',H5'2,no,N,22,,57561,16916,ACP
23,,SING,C4',O4',no,N,23,,57561,16916,ACP
24,,SING,C4',C3',no,N,24,,57561,16916,ACP
25,,SING,C4',H4',no,N,25,,57561,16916,ACP
26,,SING,O4',C1',no,N,26,,57561,16916,ACP
27,,SING,C3',O3',no,N,27,,57561,16916,ACP
28,,SING,C3',C2',no,N,28,,57561,16916,ACP
29,,SING,C3',H3',no,N,29,,57561,16916,ACP
30,,SING,O3',HO3',no,N,30,,57561,16916,ACP
31,,SING,C2',O2',no,N,31,,57561,16916,ACP
32,,SING,C2',C1',no,N,32,,57561,16916,ACP
33,,SING,C2',H2',no,N,33,,57561,16916,ACP
34,,SING,O2',HO2',no,N,34,,57561,16916,ACP
35,,SING,C1',N9,no,N,35,,57561,16916,ACP
36,,SING,C1',H1',no,N,36,,57561,16916,ACP
37,,SING,N9,C8,yes,N,37,,57561,16916,ACP
38,,SING,N9,C4,yes,N,38,,57561,16916,ACP
39,,DOUB,C8,N7,yes,N,39,,57561,16916,ACP
40,,SING,C8,H8,no,N,40,,57561,16916,ACP
41,,SING,N7,C5,yes,N,41,,57561,16916,ACP
42,,SING,C5,C6,yes,N,42,,57561,16916,ACP
43,,DOUB,C5,C4,yes,N,43,,57561,16916,ACP
44,,SING,C6,N6,no,N,44,,57561,16916,ACP
45,,DOUB,C6,N1,yes,N,45,,57561,16916,ACP
46,,SING,N6,HN61,no,N,46,,57561,16916,ACP
47,,SING,N6,HN62,no,N,47,,57561,16916,ACP
48,,SING,N1,C2,yes,N,48,,57561,16916,ACP
49,,DOUB,C2,N3,yes,N,49,,57561,16916,ACP
50,,SING,C2,H2,no,N,50,,57561,16916,ACP
51,,SING,N3,C4,yes,N,51,,57561,16916,ACP
1,,SING,C1,O1,no,N,1,,57850,16931,RAP
2,,DOUB,C1,O2,no,N,2,,57850,16931,RAP
3,,SING,C1,C2,no,N,3,,57850,16931,RAP
4,,SING,O1,C34,no,N,4,,57850,16931,RAP
5,,SING,C2,C3,no,N,5,,57850,16931,RAP
6,,SING,C2,N7,no,N,6,,57850,16931,RAP
7,,SING,C2,H2,no,N,7,,57850,16931,RAP
8,,SING,C3,C4,no,N,8,,57850,16931,RAP
9,,SING,C3,H31A,no,N,9,,57850,16931,RAP
10,,SING,C3,H32,no,N,10,,57850,16931,RAP
11,,SING,C4,C5,no,N,11,,57850,16931,RAP
12,,SING,C4,H41,no,N,12,,57850,16931,RAP
13,,SING,C4,H42,no,N,13,,57850,16931,RAP
14,,SING,C5,C6,no,N,14,,57850,16931,RAP
15,,SING,C5,H51,no,N,15,,57850,16931,RAP
16,,SING,C5,H52,no,N,16,,57850,16931,RAP
17,,SING,C6,N7,no,N,17,,57850,16931,RAP
18,,SING,C6,H61,no,N,18,,57850,16931,RAP
19,,SING,C6,H62,no,N,19,,57850,16931,RAP
20,,SING,N7,C8,no,N,20,,57850,16931,RAP
21,,DOUB,C8,O3,no,N,21,,57850,16931,RAP
22,,SING,C8,C9,no,N,22,,57850,16931,RAP
23,,DOUB,C9,O4,no,N,23,,57850,16931,RAP
24,,SING,C9,C10,no,N,24,,57850,16931,RAP
25,,SING,C10,O5,no,N,25,,57850,16931,RAP
26,,SING,C10,O6,no,N,26,,57850,16931,RAP
27,,SING,C10,C11,no,N,27,,57850,16931,RAP
2,,SING,C1,C6,,,2,,60564,17064,RET
28,,SING,O5,C14,no,N,28,,57850,16931,RAP
29,,SING,O6,HO6,no,N,29,,57850,16931,RAP
30,,SING,C11,C12,no,N,30,,57850,16931,RAP
31,,SING,C11,C43,no,N,31,,57850,16931,RAP
32,,SING,C11,H11,no,N,32,,57850,16931,RAP
33,,SING,C12,C13,no,N,33,,57850,16931,RAP
34,,SING,C12,H121,no,N,34,,57850,16931,RAP
35,,SING,C12,H122,no,N,35,,57850,16931,RAP
36,,SING,C13,C14,no,N,36,,57850,16931,RAP
37,,SING,C13,H131,no,N,37,,57850,16931,RAP
38,,SING,C13,H132,no,N,38,,57850,16931,RAP
39,,SING,C14,C15,no,N,39,,57850,16931,RAP
40,,SING,C14,H14,no,N,40,,57850,16931,RAP
41,,SING,C15,C16,no,N,41,,57850,16931,RAP
42,,SING,C15,H151,no,N,42,,57850,16931,RAP
43,,SING,C15,H152,no,N,43,,57850,16931,RAP
44,,SING,C16,O7,no,N,44,,57850,16931,RAP
45,,SING,C16,C17,no,N,45,,57850,16931,RAP
46,,SING,C16,H16,no,N,46,,57850,16931,RAP
47,,SING,O7,C50,no,N,47,,57850,16931,RAP
48,,DOUB,C17,C18,no,E,48,,57850,16931,RAP
49,,SING,C17,C44,no,N,49,,57850,16931,RAP
50,,SING,C18,C19,no,N,50,,57850,16931,RAP
51,,SING,C18,H18,no,N,51,,57850,16931,RAP
52,,DOUB,C19,C20,no,E,52,,57850,16931,RAP
53,,SING,C19,H19,no,N,53,,57850,16931,RAP
54,,SING,C20,C21,no,N,54,,57850,16931,RAP
55,,SING,C20,H20,no,N,55,,57850,16931,RAP
56,,DOUB,C21,C22,no,E,56,,57850,16931,RAP
57,,SING,C21,H21,no,N,57,,57850,16931,RAP
58,,SING,C22,C23,no,N,58,,57850,16931,RAP
59,,SING,C22,H22,no,N,59,,57850,16931,RAP
60,,SING,C23,C24,no,N,60,,57850,16931,RAP
61,,SING,C23,C45,no,N,61,,57850,16931,RAP
62,,SING,C23,H23,no,N,62,,57850,16931,RAP
63,,SING,C24,C25,no,N,63,,57850,16931,RAP
64,,SING,C24,H241,no,N,64,,57850,16931,RAP
65,,SING,C24,H242,no,N,65,,57850,16931,RAP
66,,SING,C25,C26,no,N,66,,57850,16931,RAP
67,,SING,C25,C46,no,N,67,,57850,16931,RAP
68,,SING,C25,H25,no,N,68,,57850,16931,RAP
69,,DOUB,C26,O8,no,N,69,,57850,16931,RAP
70,,SING,C26,C27,no,N,70,,57850,16931,RAP
71,,SING,C27,O9,no,N,71,,57850,16931,RAP
72,,SING,C27,C28,no,N,72,,57850,16931,RAP
73,,SING,C27,H27,no,N,73,,57850,16931,RAP
74,,SING,O9,C51,no,N,74,,57850,16931,RAP
75,,SING,C28,O10,no,N,75,,57850,16931,RAP
76,,SING,C28,C29,no,N,76,,57850,16931,RAP
77,,SING,C28,H28,no,N,77,,57850,16931,RAP
78,,SING,O10,HO1,no,N,78,,57850,16931,RAP
79,,DOUB,C29,C30,no,E,79,,57850,16931,RAP
80,,SING,C29,C47,no,N,80,,57850,16931,RAP
81,,SING,C30,C31,no,N,81,,57850,16931,RAP
82,,SING,C30,H30,no,N,82,,57850,16931,RAP
83,,SING,C31,C32,no,N,83,,57850,16931,RAP
84,,SING,C31,C48,no,N,84,,57850,16931,RAP
85,,SING,C31,H31,no,N,85,,57850,16931,RAP
86,,DOUB,C32,O11,no,N,86,,57850,16931,RAP
87,,SING,C32,C33,no,N,87,,57850,16931,RAP
88,,SING,C33,C34,no,N,88,,57850,16931,RAP
89,,SING,C33,H331,no,N,89,,57850,16931,RAP
90,,SING,C33,H332,no,N,90,,57850,16931,RAP
91,,SING,C34,C35,no,N,91,,57850,16931,RAP
92,,SING,C34,H34,no,N,92,,57850,16931,RAP
93,,SING,C35,C36,no,N,93,,57850,16931,RAP
94,,SING,C35,C49,no,N,94,,57850,16931,RAP
95,,SING,C35,H35,no,N,95,,57850,16931,RAP
96,,SING,C36,C37,no,N,96,,57850,16931,RAP
97,,SING,C36,H361,no,N,97,,57850,16931,RAP
98,,SING,C36,H362,no,N,98,,57850,16931,RAP
99,,SING,C37,C38,no,N,99,,57850,16931,RAP
100,,SING,C37,C42,no,N,100,,57850,16931,RAP
101,,SING,C37,H37,no,N,101,,57850,16931,RAP
102,,SING,C38,C39,no,N,102,,57850,16931,RAP
103,,SING,C38,H381,no,N,103,,57850,16931,RAP
104,,SING,C38,H382,no,N,104,,57850,16931,RAP
105,,SING,C39,O12,no,N,105,,57850,16931,RAP
106,,SING,C39,C40,no,N,106,,57850,16931,RAP
107,,SING,C39,H39,no,N,107,,57850,16931,RAP
108,,SING,O12,C52,no,N,108,,57850,16931,RAP
109,,SING,C40,O13,no,N,109,,57850,16931,RAP
110,,SING,C40,C41,no,N,110,,57850,16931,RAP
111,,SING,C40,H40,no,N,111,,57850,16931,RAP
112,,SING,O13,HO3,no,N,112,,57850,16931,RAP
113,,SING,C41,C42,no,N,113,,57850,16931,RAP
114,,SING,C41,H411,no,N,114,,57850,16931,RAP
115,,SING,C41,H412,no,N,115,,57850,16931,RAP
116,,SING,C42,H421,no,N,116,,57850,16931,RAP
117,,SING,C42,H422,no,N,117,,57850,16931,RAP
118,,SING,C43,H431,no,N,118,,57850,16931,RAP
119,,SING,C43,H432,no,N,119,,57850,16931,RAP
120,,SING,C43,H433,no,N,120,,57850,16931,RAP
121,,SING,C44,H441,no,N,121,,57850,16931,RAP
122,,SING,C44,H442,no,N,122,,57850,16931,RAP
123,,SING,C44,H443,no,N,123,,57850,16931,RAP
124,,SING,C45,H451,no,N,124,,57850,16931,RAP
125,,SING,C45,H452,no,N,125,,57850,16931,RAP
126,,SING,C45,H453,no,N,126,,57850,16931,RAP
127,,SING,C46,H461,no,N,127,,57850,16931,RAP
128,,SING,C46,H462,no,N,128,,57850,16931,RAP
129,,SING,C46,H463,no,N,129,,57850,16931,RAP
3,,SING,C1,C16,,,3,,60564,17064,RET
130,,SING,C47,H471,no,N,130,,57850,16931,RAP
131,,SING,C47,H472,no,N,131,,57850,16931,RAP
132,,SING,C47,H473,no,N,132,,57850,16931,RAP
133,,SING,C48,H481,no,N,133,,57850,16931,RAP
134,,SING,C48,H482,no,N,134,,57850,16931,RAP
135,,SING,C48,H483,no,N,135,,57850,16931,RAP
136,,SING,C49,H491,no,N,136,,57850,16931,RAP
137,,SING,C49,H492,no,N,137,,57850,16931,RAP
138,,SING,C49,H493,no,N,138,,57850,16931,RAP
139,,SING,C50,H501,no,N,139,,57850,16931,RAP
140,,SING,C50,H502,no,N,140,,57850,16931,RAP
141,,SING,C50,H503,no,N,141,,57850,16931,RAP
142,,SING,C51,H511,no,N,142,,57850,16931,RAP
143,,SING,C51,H512,no,N,143,,57850,16931,RAP
144,,SING,C51,H513,no,N,144,,57850,16931,RAP
145,,SING,C52,H521,no,N,145,,57850,16931,RAP
146,,SING,C52,H522,no,N,146,,57850,16931,RAP
147,,SING,C52,H523,no,N,147,,57850,16931,RAP
1,,SING,C1,O1,,,,,57898,16933,RAP
2,,DOUB,C1,O2,,,,,57898,16933,RAP
3,,SING,C1,C2,,,,,57898,16933,RAP
4,,SING,O1,C34,,,,,57898,16933,RAP
5,,SING,C2,C3,,,,,57898,16933,RAP
6,,SING,C2,N7,,,,,57898,16933,RAP
7,,SING,C2,H2,,,,,57898,16933,RAP
8,,SING,C3,C4,,,,,57898,16933,RAP
9,,SING,C3,H31A,,,,,57898,16933,RAP
10,,SING,C3,H32,,,,,57898,16933,RAP
11,,SING,C4,C5,,,,,57898,16933,RAP
12,,SING,C4,H41,,,,,57898,16933,RAP
13,,SING,C4,H42,,,,,57898,16933,RAP
14,,SING,C5,C6,,,,,57898,16933,RAP
15,,SING,C5,H51,,,,,57898,16933,RAP
16,,SING,C5,H52,,,,,57898,16933,RAP
17,,SING,C6,N7,,,,,57898,16933,RAP
18,,SING,C6,H61,,,,,57898,16933,RAP
19,,SING,C6,H62,,,,,57898,16933,RAP
20,,SING,N7,C8,,,,,57898,16933,RAP
21,,DOUB,C8,O3,,,,,57898,16933,RAP
22,,SING,C8,C9,,,,,57898,16933,RAP
23,,DOUB,C9,O4,,,,,57898,16933,RAP
24,,SING,C9,C10,,,,,57898,16933,RAP
25,,SING,C10,O5,,,,,57898,16933,RAP
26,,SING,C10,O6,,,,,57898,16933,RAP
27,,SING,C10,C11,,,,,57898,16933,RAP
28,,SING,O5,C14,,,,,57898,16933,RAP
29,,SING,O6,HO6,,,,,57898,16933,RAP
30,,SING,C11,C12,,,,,57898,16933,RAP
31,,SING,C11,C43,,,,,57898,16933,RAP
32,,SING,C11,H11,,,,,57898,16933,RAP
33,,SING,C12,C13,,,,,57898,16933,RAP
34,,SING,C12,H121,,,,,57898,16933,RAP
35,,SING,C12,H122,,,,,57898,16933,RAP
36,,SING,C13,C14,,,,,57898,16933,RAP
37,,SING,C13,H131,,,,,57898,16933,RAP
38,,SING,C13,H132,,,,,57898,16933,RAP
39,,SING,C14,C15,,,,,57898,16933,RAP
40,,SING,C14,H14,,,,,57898,16933,RAP
41,,SING,C15,C16,,,,,57898,16933,RAP
42,,SING,C15,H151,,,,,57898,16933,RAP
43,,SING,C15,H152,,,,,57898,16933,RAP
44,,SING,C16,O7,,,,,57898,16933,RAP
45,,SING,C16,C17,,,,,57898,16933,RAP
46,,SING,C16,H16,,,,,57898,16933,RAP
47,,SING,O7,C50,,,,,57898,16933,RAP
48,,DOUB,C17,C18,,,,,57898,16933,RAP
49,,SING,C17,C44,,,,,57898,16933,RAP
50,,SING,C18,C19,,,,,57898,16933,RAP
51,,SING,C18,H18,,,,,57898,16933,RAP
52,,DOUB,C19,C20,,,,,57898,16933,RAP
53,,SING,C19,H19,,,,,57898,16933,RAP
54,,SING,C20,C21,,,,,57898,16933,RAP
55,,SING,C20,H20,,,,,57898,16933,RAP
56,,DOUB,C21,C22,,,,,57898,16933,RAP
57,,SING,C21,H21,,,,,57898,16933,RAP
58,,SING,C22,C23,,,,,57898,16933,RAP
59,,SING,C22,H22,,,,,57898,16933,RAP
60,,SING,C23,C24,,,,,57898,16933,RAP
61,,SING,C23,C45,,,,,57898,16933,RAP
62,,SING,C23,H23,,,,,57898,16933,RAP
63,,SING,C24,C25,,,,,57898,16933,RAP
64,,SING,C24,H241,,,,,57898,16933,RAP
65,,SING,C24,H242,,,,,57898,16933,RAP
66,,SING,C25,C26,,,,,57898,16933,RAP
67,,SING,C25,C46,,,,,57898,16933,RAP
68,,SING,C25,H25,,,,,57898,16933,RAP
69,,DOUB,C26,O8,,,,,57898,16933,RAP
70,,SING,C26,C27,,,,,57898,16933,RAP
71,,SING,C27,O9,,,,,57898,16933,RAP
72,,SING,C27,C28,,,,,57898,16933,RAP
73,,SING,C27,H27,,,,,57898,16933,RAP
74,,SING,O9,C51,,,,,57898,16933,RAP
75,,SING,C28,O10,,,,,57898,16933,RAP
76,,SING,C28,C29,,,,,57898,16933,RAP
77,,SING,C28,H28,,,,,57898,16933,RAP
78,,SING,O10,HO1,,,,,57898,16933,RAP
79,,DOUB,C29,C30,,,,,57898,16933,RAP
80,,SING,C29,C47,,,,,57898,16933,RAP
81,,SING,C30,C31,,,,,57898,16933,RAP
82,,SING,C30,H30,,,,,57898,16933,RAP
83,,SING,C31,C32,,,,,57898,16933,RAP
84,,SING,C31,C48,,,,,57898,16933,RAP
85,,SING,C31,H31,,,,,57898,16933,RAP
86,,DOUB,C32,O11,,,,,57898,16933,RAP
87,,SING,C32,C33,,,,,57898,16933,RAP
88,,SING,C33,C34,,,,,57898,16933,RAP
89,,SING,C33,H331,,,,,57898,16933,RAP
90,,SING,C33,H332,,,,,57898,16933,RAP
91,,SING,C34,C35,,,,,57898,16933,RAP
92,,SING,C34,H34,,,,,57898,16933,RAP
93,,SING,C35,C36,,,,,57898,16933,RAP
94,,SING,C35,C49,,,,,57898,16933,RAP
95,,SING,C35,H35,,,,,57898,16933,RAP
96,,SING,C36,C37,,,,,57898,16933,RAP
97,,SING,C36,H361,,,,,57898,16933,RAP
98,,SING,C36,H362,,,,,57898,16933,RAP
99,,SING,C37,C38,,,,,57898,16933,RAP
100,,SING,C37,C42,,,,,57898,16933,RAP
101,,SING,C37,H37,,,,,57898,16933,RAP
102,,SING,C38,C39,,,,,57898,16933,RAP
103,,SING,C38,H381,,,,,57898,16933,RAP
104,,SING,C38,H382,,,,,57898,16933,RAP
105,,SING,C39,O12,,,,,57898,16933,RAP
106,,SING,C39,C40,,,,,57898,16933,RAP
107,,SING,C39,H39,,,,,57898,16933,RAP
108,,SING,O12,C52,,,,,57898,16933,RAP
109,,SING,C40,O13,,,,,57898,16933,RAP
110,,SING,C40,C41,,,,,57898,16933,RAP
111,,SING,C40,H40,,,,,57898,16933,RAP
112,,SING,O13,HO3,,,,,57898,16933,RAP
113,,SING,C41,C42,,,,,57898,16933,RAP
114,,SING,C41,H411,,,,,57898,16933,RAP
115,,SING,C41,H412,,,,,57898,16933,RAP
116,,SING,C42,H421,,,,,57898,16933,RAP
117,,SING,C42,H422,,,,,57898,16933,RAP
118,,SING,C43,H431,,,,,57898,16933,RAP
119,,SING,C43,H432,,,,,57898,16933,RAP
120,,SING,C43,H433,,,,,57898,16933,RAP
121,,SING,C44,H441,,,,,57898,16933,RAP
122,,SING,C44,H442,,,,,57898,16933,RAP
123,,SING,C44,H443,,,,,57898,16933,RAP
124,,SING,C45,H451,,,,,57898,16933,RAP
125,,SING,C45,H452,,,,,57898,16933,RAP
126,,SING,C45,H453,,,,,57898,16933,RAP
127,,SING,C46,H461,,,,,57898,16933,RAP
128,,SING,C46,H462,,,,,57898,16933,RAP
129,,SING,C46,H463,,,,,57898,16933,RAP
130,,SING,C47,H471,,,,,57898,16933,RAP
131,,SING,C47,H472,,,,,57898,16933,RAP
132,,SING,C47,H473,,,,,57898,16933,RAP
133,,SING,C48,H481,,,,,57898,16933,RAP
134,,SING,C48,H482,,,,,57898,16933,RAP
135,,SING,C48,H483,,,,,57898,16933,RAP
136,,SING,C49,H491,,,,,57898,16933,RAP
137,,SING,C49,H492,,,,,57898,16933,RAP
138,,SING,C49,H493,,,,,57898,16933,RAP
139,,SING,C50,H501,,,,,57898,16933,RAP
140,,SING,C50,H502,,,,,57898,16933,RAP
141,,SING,C50,H503,,,,,57898,16933,RAP
142,,SING,C51,H511,,,,,57898,16933,RAP
143,,SING,C51,H512,,,,,57898,16933,RAP
144,,SING,C51,H513,,,,,57898,16933,RAP
145,,SING,C52,H521,,,,,57898,16933,RAP
146,,SING,C52,H522,,,,,57898,16933,RAP
147,,SING,C52,H523,,,,,57898,16933,RAP
1,,SING,O2B,PB,no,N,1,,57977,16936,THY
2,,SING,O2B,H2B,no,N,2,,57977,16936,THY
3,,SING,PB,O3B,no,N,3,,57977,16936,THY
4,,DOUB,PB,O1B,no,N,4,,57977,16936,THY
5,,SING,PB,O3A,no,N,5,,57977,16936,THY
6,,SING,O3B,H3B,no,N,6,,57977,16936,THY
7,,SING,O3A,PA,no,N,7,,57977,16936,THY
8,,DOUB,PA,O1A,no,N,8,,57977,16936,THY
9,,SING,PA,O2A,no,N,9,,57977,16936,THY
10,,SING,PA,O5G,no,N,10,,57977,16936,THY
11,,SING,O2A,H3A,no,N,11,,57977,16936,THY
12,,SING,O5G,C5B,no,N,12,,57977,16936,THY
13,,SING,C5B,C5A,no,N,13,,57977,16936,THY
14,,SING,C5B,H5B1,no,N,14,,57977,16936,THY
15,,SING,C5B,H5B2,no,N,15,,57977,16936,THY
16,,SING,C5A,C5,no,N,16,,57977,16936,THY
17,,SING,C5A,H5A1,no,N,17,,57977,16936,THY
18,,SING,C5A,H5A2,no,N,18,,57977,16936,THY
19,,DOUB,C5,C4,yes,N,19,,57977,16936,THY
20,,SING,C5,S1,yes,N,20,,57977,16936,THY
21,,SING,C4,C4A,no,N,21,,57977,16936,THY
22,,SING,C4,N3,yes,N,22,,57977,16936,THY
23,,SING,C4A,H4A1,no,N,23,,57977,16936,THY
24,,SING,C4A,H4A2,no,N,24,,57977,16936,THY
25,,SING,C4A,H4A3,no,N,25,,57977,16936,THY
26,,SING,S1,C2,yes,N,26,,57977,16936,THY
27,,SING,C2,C8,no,N,27,,57977,16936,THY
28,,DOUB,C2,N3,yes,N,28,,57977,16936,THY
29,,SING,C8,O9,no,N,29,,57977,16936,THY
30,,SING,C8,C9,no,N,30,,57977,16936,THY
31,,SING,O9,H9,no,N,31,,57977,16936,THY
32,,SING,C9,C11,no,N,32,,57977,16936,THY
33,,SING,C9,C10,no,N,33,,57977,16936,THY
34,,SING,C9,HA,no,N,34,,57977,16936,THY
35,,SING,C11,H111,no,N,35,,57977,16936,THY
36,,SING,C11,H112,no,N,36,,57977,16936,THY
37,,SING,C11,H113,no,N,37,,57977,16936,THY
38,,SING,C10,C12,no,N,38,,57977,16936,THY
39,,SING,C10,H101,no,N,39,,57977,16936,THY
40,,SING,C10,H102,no,N,40,,57977,16936,THY
41,,SING,C12,H121,no,N,41,,57977,16936,THY
42,,SING,C12,H122,no,N,42,,57977,16936,THY
43,,SING,C12,H123,no,N,43,,57977,16936,THY
44,,SING,N3,C35,no,N,44,,57977,16936,THY
45,,SING,C35,C5',no,N,45,,57977,16936,THY
46,,SING,C35,H351,no,N,46,,57977,16936,THY
47,,SING,C35,H352,no,N,47,,57977,16936,THY
48,,DOUB,C5',C6',yes,N,48,,57977,16936,THY
49,,SING,C5',C4',yes,N,49,,57977,16936,THY
50,,SING,C6',N1',yes,N,50,,57977,16936,THY
51,,SING,C6',H6',no,N,51,,57977,16936,THY
52,,DOUB,N1',C2',yes,N,52,,57977,16936,THY
53,,SING,C2',C2A,no,N,53,,57977,16936,THY
54,,SING,C2',N3',yes,N,54,,57977,16936,THY
55,,SING,C2A,H2A1,no,N,55,,57977,16936,THY
56,,SING,C2A,H2A2,no,N,56,,57977,16936,THY
57,,SING,C2A,H2A3,no,N,57,,57977,16936,THY
58,,DOUB,N3',C4',yes,N,58,,57977,16936,THY
59,,SING,C4',N4',no,N,59,,57977,16936,THY
60,,SING,N4',H4'1,no,N,60,,57977,16936,THY
61,,SING,N4',H4'2,no,N,61,,57977,16936,THY
1,,SING,N1,C2,no,N,1,,57978,16936,5CM
2,,SING,N1,C6,no,N,2,,57978,16936,5CM
3,,SING,N1,C1',no,N,3,,57978,16936,5CM
4,,SING,C2,N3,no,N,4,,57978,16936,5CM
5,,DOUB,C2,O2,no,N,5,,57978,16936,5CM
6,,DOUB,N3,C4,no,N,6,,57978,16936,5CM
7,,SING,C4,C5,no,N,7,,57978,16936,5CM
8,,SING,C4,N4,no,N,8,,57978,16936,5CM
9,,SING,C5,C5A,no,N,9,,57978,16936,5CM
10,,DOUB,C5,C6,no,N,10,,57978,16936,5CM
11,,SING,C5A,H5A1,no,N,11,,57978,16936,5CM
12,,SING,C5A,H5A2,no,N,12,,57978,16936,5CM
13,,SING,C5A,H5A3,no,N,13,,57978,16936,5CM
14,,SING,C6,H6,no,N,14,,57978,16936,5CM
15,,SING,N4,HN41,no,N,15,,57978,16936,5CM
16,,SING,N4,HN42,no,N,16,,57978,16936,5CM
17,,SING,C1',C2',no,N,17,,57978,16936,5CM
18,,SING,C1',O4',no,N,18,,57978,16936,5CM
19,,SING,C1',H1',no,N,19,,57978,16936,5CM
20,,SING,C2',C3',no,N,20,,57978,16936,5CM
21,,SING,C2',H2',no,N,21,,57978,16936,5CM
22,,SING,C2',H2'',no,N,22,,57978,16936,5CM
23,,SING,C3',C4',no,N,23,,57978,16936,5CM
24,,SING,C3',O3',no,N,24,,57978,16936,5CM
25,,SING,C3',H3',no,N,25,,57978,16936,5CM
26,,SING,C4',O4',no,N,26,,57978,16936,5CM
27,,SING,C4',C5',no,N,27,,57978,16936,5CM
28,,SING,C4',H4',no,N,28,,57978,16936,5CM
29,,SING,O3',HO3',no,N,29,,57978,16936,5CM
30,,SING,C5',O5',no,N,30,,57978,16936,5CM
31,,SING,C5',H5',no,N,31,,57978,16936,5CM
32,,SING,C5',H5'',no,N,32,,57978,16936,5CM
33,,SING,O5',P,no,N,33,,57978,16936,5CM
34,,DOUB,P,OP1,no,N,34,,57978,16936,5CM
35,,SING,P,OP2,no,N,35,,57978,16936,5CM
36,,SING,P,OP3,no,N,36,,57978,16936,5CM
37,,SING,OP2,HOP2,no,N,37,,57978,16936,5CM
38,,SING,OP3,HOP3,no,N,38,,57978,16936,5CM
1,,SING,C1,C2,,,,,58041,16940,CHM
2,,SING,C1,CL1,,,,,58041,16940,CHM
3,,SING,C1,H11,,,,,58041,16940,CHM
4,,SING,C1,H12,,,,,58041,16940,CHM
5,,SING,C2,C3,,,,,58041,16940,CHM
6,,DOUB,C2,O,,,,,58041,16940,CHM
7,,SING,C3,CL3,,,,,58041,16940,CHM
8,,SING,C3,H31,,,,,58041,16940,CHM
9,,SING,C3,H32,,,,,58041,16940,CHM
1,,SING,N,CA,no,N,1,,58060,16941,DPR
2,,SING,N,CD,no,N,2,,58060,16941,DPR
3,,SING,N,H,no,N,3,,58060,16941,DPR
4,,SING,CA,CB,no,N,4,,58060,16941,DPR
5,,SING,CA,C,no,N,5,,58060,16941,DPR
6,,SING,CA,HA,no,N,6,,58060,16941,DPR
7,,SING,CB,CG,no,N,7,,58060,16941,DPR
8,,SING,CB,HB2,no,N,8,,58060,16941,DPR
9,,SING,CB,HB3,no,N,9,,58060,16941,DPR
10,,SING,CG,CD,no,N,10,,58060,16941,DPR
11,,SING,CG,HG2,no,N,11,,58060,16941,DPR
12,,SING,CG,HG3,no,N,12,,58060,16941,DPR
13,,SING,CD,HD2,no,N,13,,58060,16941,DPR
14,,SING,CD,HD3,no,N,14,,58060,16941,DPR
15,,DOUB,C,O,no,N,15,,58060,16941,DPR
16,,SING,C,OXT,no,N,16,,58060,16941,DPR
17,,SING,OXT,HXT,no,N,17,,58060,16941,DPR
1,,SING,N,CA,no,N,1,,58682,1697,PCA
2,,SING,N,CD,no,N,2,,58682,1697,PCA
3,,SING,N,H,no,N,3,,58682,1697,PCA
4,,SING,CA,CB,no,N,4,,58682,1697,PCA
5,,SING,CA,C,no,N,5,,58682,1697,PCA
6,,SING,CA,HA,no,N,6,,58682,1697,PCA
7,,SING,CB,CG,no,N,7,,58682,1697,PCA
8,,SING,CB,HB2,no,N,8,,58682,1697,PCA
9,,SING,CB,HB3,no,N,9,,58682,1697,PCA
10,,SING,CG,CD,no,N,10,,58682,1697,PCA
11,,SING,CG,HG2,no,N,11,,58682,1697,PCA
12,,SING,CG,HG3,no,N,12,,58682,1697,PCA
13,,DOUB,CD,OE,no,N,13,,58682,1697,PCA
14,,DOUB,C,O,no,N,14,,58682,1697,PCA
15,,SING,C,OXT,no,N,15,,58682,1697,PCA
16,,SING,OXT,HXT,no,N,16,,58682,1697,PCA
1,,SING,N,CA,no,N,1,,58807,1698,PCA
2,,SING,N,CD,no,N,2,,58807,1698,PCA
3,,SING,N,H,no,N,3,,58807,1698,PCA
4,,SING,CA,CB,no,N,4,,58807,1698,PCA
5,,SING,CA,C,no,N,5,,58807,1698,PCA
6,,SING,CA,HA,no,N,6,,58807,1698,PCA
7,,SING,CB,CG,no,N,7,,58807,1698,PCA
8,,SING,CB,HB2,no,N,8,,58807,1698,PCA
9,,SING,CB,HB3,no,N,9,,58807,1698,PCA
10,,SING,CG,CD,no,N,10,,58807,1698,PCA
11,,SING,CG,HG2,no,N,11,,58807,1698,PCA
12,,SING,CG,HG3,no,N,12,,58807,1698,PCA
13,,DOUB,CD,OE,no,N,13,,58807,1698,PCA
14,,DOUB,C,O,no,N,14,,58807,1698,PCA
15,,SING,C,OXT,no,N,15,,58807,1698,PCA
16,,SING,OXT,HXT,no,N,16,,58807,1698,PCA
1,,DOUB,C1,O1,no,N,1,,58889,16984,AOS
2,,SING,C1,C2,no,N,2,,58889,16984,AOS
3,,SING,C1,H1,no,N,3,,58889,16984,AOS
4,,SING,C1,C17,,,4,,60564,17064,RET
4,,SING,C2,O2,no,N,4,,58889,16984,AOS
5,,SING,C2,C3,no,N,5,,58889,16984,AOS
6,,SING,C2,H2,no,N,6,,58889,16984,AOS
7,,SING,O2,HO2,no,N,7,,58889,16984,AOS
8,,SING,C3,O3,no,N,8,,58889,16984,AOS
9,,SING,C3,C4,no,N,9,,58889,16984,AOS
10,,SING,C3,H3,no,N,10,,58889,16984,AOS
11,,SING,O3,HO3,no,N,11,,58889,16984,AOS
12,,SING,C4,O4,no,N,12,,58889,16984,AOS
13,,SING,C4,C5,no,N,13,,58889,16984,AOS
14,,SING,C4,H4,no,N,14,,58889,16984,AOS
15,,SING,O4,HO4,no,N,15,,58889,16984,AOS
16,,SING,C5,O5,no,N,16,,58889,16984,AOS
17,,SING,C5,C6,no,N,17,,58889,16984,AOS
18,,SING,C5,H5,no,N,18,,58889,16984,AOS
19,,SING,O5,HO5,no,N,19,,58889,16984,AOS
20,,SING,C6,O6,no,N,20,,58889,16984,AOS
21,,SING,C6,H61,no,N,21,,58889,16984,AOS
22,,SING,C6,H62,no,N,22,,58889,16984,AOS
23,,SING,O6,HO6,no,N,23,,58889,16984,AOS
1,,SING,N,CA,no,N,1,,58971,1699,PCA
2,,SING,N,CD,no,N,2,,58971,1699,PCA
3,,SING,N,H,no,N,3,,58971,1699,PCA
4,,SING,CA,CB,no,N,4,,58971,1699,PCA
5,,SING,CA,C,no,N,5,,58971,1699,PCA
6,,SING,CA,HA,no,N,6,,58971,1699,PCA
7,,SING,CB,CG,no,N,7,,58971,1699,PCA
8,,SING,CB,HB2,no,N,8,,58971,1699,PCA
9,,SING,CB,HB3,no,N,9,,58971,1699,PCA
10,,SING,CG,CD,no,N,10,,58971,1699,PCA
11,,SING,CG,HG2,no,N,11,,58971,1699,PCA
12,,SING,CG,HG3,no,N,12,,58971,1699,PCA
13,,DOUB,CD,OE,no,N,13,,58971,1699,PCA
14,,DOUB,C,O,no,N,14,,58971,1699,PCA
15,,SING,C,OXT,no,N,15,,58971,1699,PCA
16,,SING,OXT,HXT,no,N,16,,58971,1699,PCA
1,,DOUB,OH,CH,no,N,1,,60138,17040,ALY
2,,SING,CH,CH3,no,N,2,,60138,17040,ALY
3,,SING,CH,NZ,no,N,3,,60138,17040,ALY
4,,SING,CH3,HH31,no,N,4,,60138,17040,ALY
5,,SING,CH3,HH32,no,N,5,,60138,17040,ALY
6,,SING,CH3,HH33,no,N,6,,60138,17040,ALY
7,,SING,NZ,CE,no,N,7,,60138,17040,ALY
8,,SING,NZ,HZ,no,N,8,,60138,17040,ALY
9,,SING,CE,CD,no,N,9,,60138,17040,ALY
10,,SING,CE,HE3,no,N,10,,60138,17040,ALY
11,,SING,CE,HE2,no,N,11,,60138,17040,ALY
12,,SING,CD,CG,no,N,12,,60138,17040,ALY
13,,SING,CD,HD3,no,N,13,,60138,17040,ALY
14,,SING,CD,HD2,no,N,14,,60138,17040,ALY
15,,SING,CG,CB,no,N,15,,60138,17040,ALY
16,,SING,CG,HG3,no,N,16,,60138,17040,ALY
17,,SING,CG,HG2,no,N,17,,60138,17040,ALY
18,,SING,CB,CA,no,N,18,,60138,17040,ALY
19,,SING,CB,HB3,no,N,19,,60138,17040,ALY
20,,SING,CB,HB2,no,N,20,,60138,17040,ALY
21,,SING,CA,N,no,N,21,,60138,17040,ALY
22,,SING,CA,C,no,N,22,,60138,17040,ALY
23,,SING,CA,HCA,no,N,23,,60138,17040,ALY
24,,SING,N,H,no,N,24,,60138,17040,ALY
25,,SING,N,H2,no,N,25,,60138,17040,ALY
26,,DOUB,C,O,no,N,26,,60138,17040,ALY
27,,SING,C,OXT,no,N,27,,60138,17040,ALY
28,,SING,OXT,HXT,no,N,28,,60138,17040,ALY
1,,SING,N,HN1,no,N,1,,60139,17040,NH2
2,,SING,N,HN2,no,N,2,,60139,17040,NH2
1,,SING,N,CA,no,N,1,,60160,17041,TRP
2,,SING,N,H,no,N,2,,60160,17041,TRP
3,,SING,N,H2,no,N,3,,60160,17041,TRP
4,,SING,CA,C,no,N,4,,60160,17041,TRP
5,,SING,CA,CB,no,N,5,,60160,17041,TRP
6,,SING,CA,HA,no,N,6,,60160,17041,TRP
7,,DOUB,C,O,no,N,7,,60160,17041,TRP
8,,SING,C,OXT,no,N,8,,60160,17041,TRP
9,,SING,CB,CG,no,N,9,,60160,17041,TRP
10,,SING,CB,HB2,no,N,10,,60160,17041,TRP
11,,SING,CB,HB3,no,N,11,,60160,17041,TRP
12,,DOUB,CG,CD1,yes,N,12,,60160,17041,TRP
13,,SING,CG,CD2,yes,N,13,,60160,17041,TRP
14,,SING,CD1,NE1,yes,N,14,,60160,17041,TRP
15,,SING,CD1,HD1,no,N,15,,60160,17041,TRP
16,,DOUB,CD2,CE2,yes,N,16,,60160,17041,TRP
17,,SING,CD2,CE3,yes,N,17,,60160,17041,TRP
18,,SING,NE1,CE2,yes,N,18,,60160,17041,TRP
19,,SING,NE1,HE1,no,N,19,,60160,17041,TRP
20,,SING,CE2,CZ2,yes,N,20,,60160,17041,TRP
21,,DOUB,CE3,CZ3,yes,N,21,,60160,17041,TRP
22,,SING,CE3,HE3,no,N,22,,60160,17041,TRP
23,,DOUB,CZ2,CH2,yes,N,23,,60160,17041,TRP
24,,SING,CZ2,HZ2,no,N,24,,60160,17041,TRP
25,,SING,CZ3,CH2,yes,N,25,,60160,17041,TRP
26,,SING,CZ3,HZ3,no,N,26,,60160,17041,TRP
27,,SING,CH2,HH2,no,N,27,,60160,17041,TRP
28,,SING,OXT,HXT,no,N,28,,60160,17041,TRP
1,,SING,N,CA,,,1,,60249,17046,TRP
2,,SING,N,H,,,2,,60249,17046,TRP
3,,SING,N,H2,,,3,,60249,17046,TRP
4,,SING,CA,C,,,4,,60249,17046,TRP
5,,SING,CA,CB,,,5,,60249,17046,TRP
6,,SING,CA,HA,,,6,,60249,17046,TRP
7,,DOUB,C,O,,,7,,60249,17046,TRP
8,,SING,C,OXT,,,8,,60249,17046,TRP
9,,SING,CB,CG,,,9,,60249,17046,TRP
10,,SING,CB,HB2,,,10,,60249,17046,TRP
11,,SING,CB,HB3,,,11,,60249,17046,TRP
12,,DOUB,CG,CD1,,,12,,60249,17046,TRP
13,,SING,CG,CD2,,,13,,60249,17046,TRP
14,,SING,CD1,NE1,,,14,,60249,17046,TRP
15,,SING,CD1,HD1,,,15,,60249,17046,TRP
16,,DOUB,CD2,CE2,,,16,,60249,17046,TRP
17,,SING,CD2,CE3,,,17,,60249,17046,TRP
18,,SING,NE1,CE2,,,18,,60249,17046,TRP
19,,SING,NE1,HE1,,,19,,60249,17046,TRP
20,,SING,CE2,CZ2,,,20,,60249,17046,TRP
21,,DOUB,CE3,CZ3,,,21,,60249,17046,TRP
22,,SING,CE3,HE3,,,22,,60249,17046,TRP
23,,DOUB,CZ2,CH2,,,23,,60249,17046,TRP
24,,SING,CZ2,HZ2,,,24,,60249,17046,TRP
25,,SING,CZ3,CH2,,,25,,60249,17046,TRP
26,,SING,CZ3,HZ3,,,26,,60249,17046,TRP
27,,SING,CH2,HH2,,,27,,60249,17046,TRP
28,,SING,OXT,HXT,,,28,,60249,17046,TRP
1,,SING,N,CA,no,N,1,,60275,17047,TRP
2,,SING,N,H,no,N,2,,60275,17047,TRP
3,,SING,N,H2,no,N,3,,60275,17047,TRP
4,,SING,CA,C,no,N,4,,60275,17047,TRP
5,,SING,CA,CB,no,N,5,,60275,17047,TRP
6,,SING,CA,HA,no,N,6,,60275,17047,TRP
7,,DOUB,C,O,no,N,7,,60275,17047,TRP
8,,SING,C,OXT,no,N,8,,60275,17047,TRP
9,,SING,CB,CG,no,N,9,,60275,17047,TRP
10,,SING,CB,HB2,no,N,10,,60275,17047,TRP
11,,SING,CB,HB3,no,N,11,,60275,17047,TRP
12,,DOUB,CG,CD1,yes,N,12,,60275,17047,TRP
13,,SING,CG,CD2,yes,N,13,,60275,17047,TRP
14,,SING,CD1,NE1,yes,N,14,,60275,17047,TRP
15,,SING,CD1,HD1,no,N,15,,60275,17047,TRP
16,,DOUB,CD2,CE2,yes,N,16,,60275,17047,TRP
17,,SING,CD2,CE3,yes,N,17,,60275,17047,TRP
18,,SING,NE1,CE2,yes,N,18,,60275,17047,TRP
19,,SING,NE1,HE1,no,N,19,,60275,17047,TRP
20,,SING,CE2,CZ2,yes,N,20,,60275,17047,TRP
21,,DOUB,CE3,CZ3,yes,N,21,,60275,17047,TRP
22,,SING,CE3,HE3,no,N,22,,60275,17047,TRP
23,,DOUB,CZ2,CH2,yes,N,23,,60275,17047,TRP
24,,SING,CZ2,HZ2,no,N,24,,60275,17047,TRP
25,,SING,CZ3,CH2,yes,N,25,,60275,17047,TRP
26,,SING,CZ3,HZ3,no,N,26,,60275,17047,TRP
27,,SING,CH2,HH2,no,N,27,,60275,17047,TRP
28,,SING,OXT,HXT,no,N,28,,60275,17047,TRP
1,,SING,C11,C21,,,1,,60345,17052,CTO
2,,SING,C11,O51,,,2,,60345,17052,CTO
3,,SING,C11,O42,,,3,,60345,17052,CTO
4,,SING,C11,H11,,,4,,60345,17052,CTO
5,,SING,C21,N21,,,5,,60345,17052,CTO
6,,SING,C21,C31,,,6,,60345,17052,CTO
7,,SING,C21,H21,,,7,,60345,17052,CTO
8,,SING,N21,C71,,,8,,60345,17052,CTO
9,,SING,N21,HNL,,,9,,60345,17052,CTO
10,,DOUB,C71,O71,,,10,,60345,17052,CTO
11,,SING,C71,C81,,,11,,60345,17052,CTO
12,,SING,C81,H811,,,12,,60345,17052,CTO
13,,SING,C81,H812,,,13,,60345,17052,CTO
14,,SING,C81,H813,,,14,,60345,17052,CTO
15,,SING,C31,O31,,,15,,60345,17052,CTO
16,,SING,C31,C41,,,16,,60345,17052,CTO
17,,SING,C31,H31,,,17,,60345,17052,CTO
18,,SING,O31,HOV,,,18,,60345,17052,CTO
19,,SING,C41,O41,,,19,,60345,17052,CTO
20,,SING,C41,C51,,,20,,60345,17052,CTO
21,,SING,C41,H41,,,21,,60345,17052,CTO
22,,SING,O41,HO4,,,22,,60345,17052,CTO
23,,SING,C51,O51,,,23,,60345,17052,CTO
24,,SING,C51,C61,,,24,,60345,17052,CTO
25,,SING,C51,H51,,,25,,60345,17052,CTO
26,,SING,C61,O61,,,26,,60345,17052,CTO
27,,SING,C61,H611,,,27,,60345,17052,CTO
28,,SING,C61,H612,,,28,,60345,17052,CTO
29,,SING,O61,HO6,,,29,,60345,17052,CTO
30,,SING,C12,C22,,,30,,60345,17052,CTO
31,,SING,C12,O52,,,31,,60345,17052,CTO
32,,SING,C12,O43,,,32,,60345,17052,CTO
33,,SING,C12,H12,,,33,,60345,17052,CTO
34,,SING,C22,N22,,,34,,60345,17052,CTO
35,,SING,C22,C32,,,35,,60345,17052,CTO
36,,SING,C22,H22,,,36,,60345,17052,CTO
37,,SING,N22,C72,,,37,,60345,17052,CTO
38,,SING,N22,HNM,,,38,,60345,17052,CTO
39,,DOUB,C72,O72,,,39,,60345,17052,CTO
40,,SING,C72,C82,,,40,,60345,17052,CTO
41,,SING,C82,H821,,,41,,60345,17052,CTO
42,,SING,C82,H822,,,42,,60345,17052,CTO
43,,SING,C82,H823,,,43,,60345,17052,CTO
44,,SING,C32,O32,,,44,,60345,17052,CTO
45,,SING,C32,C42,,,45,,60345,17052,CTO
46,,SING,C32,H32,,,46,,60345,17052,CTO
47,,SING,O32,HOW,,,47,,60345,17052,CTO
48,,SING,C42,O42,,,48,,60345,17052,CTO
49,,SING,C42,C52,,,49,,60345,17052,CTO
50,,SING,C42,H42,,,50,,60345,17052,CTO
51,,SING,C52,O52,,,51,,60345,17052,CTO
52,,SING,C52,C62,,,52,,60345,17052,CTO
53,,SING,C52,H52,,,53,,60345,17052,CTO
54,,SING,C62,O62,,,54,,60345,17052,CTO
55,,SING,C62,H621,,,55,,60345,17052,CTO
56,,SING,C62,H622,,,56,,60345,17052,CTO
57,,SING,O62,HO2,,,57,,60345,17052,CTO
58,,SING,C13,O13,,,58,,60345,17052,CTO
59,,SING,C13,C23,,,59,,60345,17052,CTO
60,,SING,C13,O53,,,60,,60345,17052,CTO
61,,SING,C13,H13,,,61,,60345,17052,CTO
62,,SING,O13,HOD,,,62,,60345,17052,CTO
63,,SING,C23,N23,,,63,,60345,17052,CTO
64,,SING,C23,C33,,,64,,60345,17052,CTO
65,,SING,C23,H23,,,65,,60345,17052,CTO
66,,SING,N23,C73,,,66,,60345,17052,CTO
67,,SING,N23,HNN,,,67,,60345,17052,CTO
68,,DOUB,C73,O73,,,68,,60345,17052,CTO
69,,SING,C73,C83,,,69,,60345,17052,CTO
70,,SING,C83,H831,,,70,,60345,17052,CTO
71,,SING,C83,H832,,,71,,60345,17052,CTO
72,,SING,C83,H833,,,72,,60345,17052,CTO
73,,SING,C33,O33,,,73,,60345,17052,CTO
74,,SING,C33,C43,,,74,,60345,17052,CTO
75,,SING,C33,H33,,,75,,60345,17052,CTO
76,,SING,O33,HOX,,,76,,60345,17052,CTO
77,,SING,C43,O43,,,77,,60345,17052,CTO
78,,SING,C43,C53,,,78,,60345,17052,CTO
79,,SING,C43,H43,,,79,,60345,17052,CTO
80,,SING,C53,O53,,,80,,60345,17052,CTO
81,,SING,C53,C63,,,81,,60345,17052,CTO
82,,SING,C53,H53,,,82,,60345,17052,CTO
83,,SING,C63,O63,,,83,,60345,17052,CTO
84,,SING,C63,H631,,,84,,60345,17052,CTO
85,,SING,C63,H632,,,85,,60345,17052,CTO
86,,SING,O63,HO3,,,86,,60345,17052,CTO
1,,DOUB,C1,C2,,,1,,60382,17054,SXX
2,,SING,C1,C6,,,2,,60382,17054,SXX
3,,SING,C1,O7,,,3,,60382,17054,SXX
4,,SING,C2,C3,,,4,,60382,17054,SXX
5,,SING,C2,O9,,,5,,60382,17054,SXX
6,,DOUB,C3,C4,,,6,,60382,17054,SXX
7,,SING,C3,H3,,,7,,60382,17054,SXX
8,,SING,C4,C5,,,8,,60382,17054,SXX
9,,SING,C4,C10,,,9,,60382,17054,SXX
10,,DOUB,C5,C6,,,10,,60382,17054,SXX
11,,SING,C5,H5,,,11,,60382,17054,SXX
12,,SING,C6,O8,,,12,,60382,17054,SXX
13,,SING,O7,H7,,,13,,60382,17054,SXX
14,,SING,O8,C14,,,14,,60382,17054,SXX
15,,SING,O9,C15,,,15,,60382,17054,SXX
16,,DOUB,C10,C11,,,16,,60382,17054,SXX
17,,SING,C10,H10,,,17,,60382,17054,SXX
18,,SING,C11,C12,,,18,,60382,17054,SXX
19,,SING,C11,H11,,,19,,60382,17054,SXX
20,,SING,C12,O13,,,20,,60382,17054,SXX
21,,DOUB,C12,O14,,,21,,60382,17054,SXX
22,,SING,O13,H13,,,22,,60382,17054,SXX
23,,SING,C15,H151,,,23,,60382,17054,SXX
24,,SING,C15,H152,,,24,,60382,17054,SXX
25,,SING,C15,H153,,,25,,60382,17054,SXX
26,,SING,C14,H141,,,26,,60382,17054,SXX
27,,SING,C14,H142,,,27,,60382,17054,SXX
28,,SING,C14,H143,,,28,,60382,17054,SXX
1,,SING,F1,C2,,,1,,60414,17056,HLT
2,,SING,C2,F2,,,2,,60414,17056,HLT
3,,SING,C2,F3,,,3,,60414,17056,HLT
4,,SING,C2,C1,,,4,,60414,17056,HLT
5,,SING,C1,BR,,,5,,60414,17056,HLT
6,,SING,C1,CL,,,6,,60414,17056,HLT
7,,SING,C1,HC1,,,7,,60414,17056,HLT
1,,SING,C1,O1,no,N,1,,60430,17057,PLM
2,,DOUB,C1,O2,no,N,2,,60430,17057,PLM
3,,SING,C1,C2,no,N,3,,60430,17057,PLM
4,,SING,O1,H,no,N,4,,60430,17057,PLM
5,,SING,C2,C3,no,N,5,,60430,17057,PLM
6,,SING,C2,H21,no,N,6,,60430,17057,PLM
7,,SING,C2,H22,no,N,7,,60430,17057,PLM
8,,SING,C3,C4,no,N,8,,60430,17057,PLM
9,,SING,C3,H31,no,N,9,,60430,17057,PLM
10,,SING,C3,H32,no,N,10,,60430,17057,PLM
11,,SING,C4,C5,no,N,11,,60430,17057,PLM
12,,SING,C4,H41,no,N,12,,60430,17057,PLM
13,,SING,C4,H42,no,N,13,,60430,17057,PLM
14,,SING,C5,C6,no,N,14,,60430,17057,PLM
15,,SING,C5,H51,no,N,15,,60430,17057,PLM
16,,SING,C5,H52,no,N,16,,60430,17057,PLM
17,,SING,C6,C7,no,N,17,,60430,17057,PLM
18,,SING,C6,H61,no,N,18,,60430,17057,PLM
19,,SING,C6,H62,no,N,19,,60430,17057,PLM
20,,SING,C7,C8,no,N,20,,60430,17057,PLM
21,,SING,C7,H71,no,N,21,,60430,17057,PLM
22,,SING,C7,H72,no,N,22,,60430,17057,PLM
23,,SING,C8,C9,no,N,23,,60430,17057,PLM
24,,SING,C8,H81,no,N,24,,60430,17057,PLM
25,,SING,C8,H82,no,N,25,,60430,17057,PLM
26,,SING,C9,CA,no,N,26,,60430,17057,PLM
27,,SING,C9,H91,no,N,27,,60430,17057,PLM
28,,SING,C9,H92,no,N,28,,60430,17057,PLM
29,,SING,CA,CB,no,N,29,,60430,17057,PLM
30,,SING,CA,HA1,no,N,30,,60430,17057,PLM
31,,SING,CA,HA2,no,N,31,,60430,17057,PLM
32,,SING,CB,CC,no,N,32,,60430,17057,PLM
33,,SING,CB,HB1,no,N,33,,60430,17057,PLM
34,,SING,CB,HB2,no,N,34,,60430,17057,PLM
35,,SING,CC,CD,no,N,35,,60430,17057,PLM
36,,SING,CC,HC1,no,N,36,,60430,17057,PLM
37,,SING,CC,HC2,no,N,37,,60430,17057,PLM
38,,SING,CD,CE,no,N,38,,60430,17057,PLM
39,,SING,CD,HD1,no,N,39,,60430,17057,PLM
40,,SING,CD,HD2,no,N,40,,60430,17057,PLM
41,,SING,CE,CF,no,N,41,,60430,17057,PLM
42,,SING,CE,HE1,no,N,42,,60430,17057,PLM
43,,SING,CE,HE2,no,N,43,,60430,17057,PLM
44,,SING,CF,CG,no,N,44,,60430,17057,PLM
45,,SING,CF,HF1,no,N,45,,60430,17057,PLM
46,,SING,CF,HF2,no,N,46,,60430,17057,PLM
47,,SING,CG,HG1,no,N,47,,60430,17057,PLM
48,,SING,CG,HG2,no,N,48,,60430,17057,PLM
49,,SING,CG,HG3,no,N,49,,60430,17057,PLM
1,,TRIP,C,N,no,N,1,,60431,17057,CYN
1,,SING,C1,C2,,,1,,60564,17064,RET
5,,SING,C2,C3,,,5,,60564,17064,RET
6,,SING,C2,H21,,,6,,60564,17064,RET
7,,SING,C2,H22,,,7,,60564,17064,RET
8,,SING,C3,C4,,,8,,60564,17064,RET
9,,SING,C3,H31,,,9,,60564,17064,RET
10,,SING,C3,H32,,,10,,60564,17064,RET
11,,SING,C4,C5,,,11,,60564,17064,RET
12,,SING,C4,H41,,,12,,60564,17064,RET
13,,SING,C4,H42,,,13,,60564,17064,RET
14,,DOUB,C5,C6,,,14,,60564,17064,RET
15,,SING,C5,C18,,,15,,60564,17064,RET
16,,SING,C6,C7,,,16,,60564,17064,RET
17,,DOUB,C7,C8,,,17,,60564,17064,RET
18,,SING,C7,H7,,,18,,60564,17064,RET
19,,SING,C8,C9,,,19,,60564,17064,RET
20,,SING,C8,H8,,,20,,60564,17064,RET
21,,DOUB,C9,C10,,,21,,60564,17064,RET
22,,SING,C9,C19,,,22,,60564,17064,RET
23,,SING,C10,C11,,,23,,60564,17064,RET
24,,SING,C10,H10,,,24,,60564,17064,RET
25,,DOUB,C11,C12,,,25,,60564,17064,RET
26,,SING,C11,H11,,,26,,60564,17064,RET
27,,SING,C12,C13,,,27,,60564,17064,RET
28,,SING,C12,H12,,,28,,60564,17064,RET
29,,DOUB,C13,C14,,,29,,60564,17064,RET
30,,SING,C13,C20,,,30,,60564,17064,RET
31,,SING,C14,C15,,,31,,60564,17064,RET
32,,SING,C14,H14,,,32,,60564,17064,RET
33,,DOUB,C15,O1,,,33,,60564,17064,RET
34,,SING,C15,H15,,,34,,60564,17064,RET
35,,SING,C16,H161,,,35,,60564,17064,RET
36,,SING,C16,H162,,,36,,60564,17064,RET
37,,SING,C16,H163,,,37,,60564,17064,RET
38,,SING,C17,H171,,,38,,60564,17064,RET
39,,SING,C17,H172,,,39,,60564,17064,RET
40,,SING,C17,H173,,,40,,60564,17064,RET
41,,SING,C18,H181,,,41,,60564,17064,RET
42,,SING,C18,H182,,,42,,60564,17064,RET
43,,SING,C18,H183,,,43,,60564,17064,RET
44,,SING,C19,H191,,,44,,60564,17064,RET
45,,SING,C19,H192,,,45,,60564,17064,RET
46,,SING,C19,H193,,,46,,60564,17064,RET
47,,SING,C20,H201,,,47,,60564,17064,RET
48,,SING,C20,H202,,,48,,60564,17064,RET
49,,SING,C20,H203,,,49,,60564,17064,RET
1,,SING,N,CA,,,,,60704,17071,M3L
2,,SING,N,H,,,,,60704,17071,M3L
3,,SING,N,H2,,,,,60704,17071,M3L
4,,SING,CA,CB,,,,,60704,17071,M3L
5,,SING,CA,C,,,,,60704,17071,M3L
6,,SING,CA,HA,,,,,60704,17071,M3L
7,,SING,CB,CG,,,,,60704,17071,M3L
8,,SING,CB,HB2,,,,,60704,17071,M3L
9,,SING,CB,HB3,,,,,60704,17071,M3L
10,,SING,CG,CD,,,,,60704,17071,M3L
11,,SING,CG,HG2,,,,,60704,17071,M3L
12,,SING,CG,HG3,,,,,60704,17071,M3L
13,,SING,CD,CE,,,,,60704,17071,M3L
14,,SING,CD,HD2,,,,,60704,17071,M3L
15,,SING,CD,HD3,,,,,60704,17071,M3L
16,,SING,CE,NZ,,,,,60704,17071,M3L
17,,SING,CE,HE2,,,,,60704,17071,M3L
18,,SING,CE,HE3,,,,,60704,17071,M3L
19,,SING,NZ,CM1,,,,,60704,17071,M3L
20,,SING,NZ,CM2,,,,,60704,17071,M3L
21,,SING,NZ,CM3,,,,,60704,17071,M3L
22,,DOUB,C,O,,,,,60704,17071,M3L
23,,SING,C,OXT,,,,,60704,17071,M3L
24,,SING,OXT,HXT,,,,,60704,17071,M3L
25,,SING,CM1,HM11,,,,,60704,17071,M3L
26,,SING,CM1,HM12,,,,,60704,17071,M3L
27,,SING,CM1,HM13,,,,,60704,17071,M3L
28,,SING,CM2,HM21,,,,,60704,17071,M3L
29,,SING,CM2,HM22,,,,,60704,17071,M3L
30,,SING,CM2,HM23,,,,,60704,17071,M3L
31,,SING,CM3,HM31,,,,,60704,17071,M3L
32,,SING,CM3,HM32,,,,,60704,17071,M3L
33,,SING,CM3,HM33,,,,,60704,17071,M3L
1,,SING,N,CA,,,,,60730,17072,M3L
2,,SING,N,H,,,,,60730,17072,M3L
3,,SING,N,H2,,,,,60730,17072,M3L
4,,SING,CA,CB,,,,,60730,17072,M3L
5,,SING,CA,C,,,,,60730,17072,M3L
6,,SING,CA,HA,,,,,60730,17072,M3L
7,,SING,CB,CG,,,,,60730,17072,M3L
8,,SING,CB,HB2,,,,,60730,17072,M3L
9,,SING,CB,HB3,,,,,60730,17072,M3L
10,,SING,CG,CD,,,,,60730,17072,M3L
11,,SING,CG,HG2,,,,,60730,17072,M3L
12,,SING,CG,HG3,,,,,60730,17072,M3L
13,,SING,CD,CE,,,,,60730,17072,M3L
14,,SING,CD,HD2,,,,,60730,17072,M3L
15,,SING,CD,HD3,,,,,60730,17072,M3L
16,,SING,CE,NZ,,,,,60730,17072,M3L
17,,SING,CE,HE2,,,,,60730,17072,M3L
18,,SING,CE,HE3,,,,,60730,17072,M3L
19,,SING,NZ,CM1,,,,,60730,17072,M3L
20,,SING,NZ,CM2,,,,,60730,17072,M3L
21,,SING,NZ,CM3,,,,,60730,17072,M3L
22,,DOUB,C,O,,,,,60730,17072,M3L
23,,SING,C,OXT,,,,,60730,17072,M3L
24,,SING,OXT,HXT,,,,,60730,17072,M3L
25,,SING,CM1,HM11,,,,,60730,17072,M3L
26,,SING,CM1,HM12,,,,,60730,17072,M3L
27,,SING,CM1,HM13,,,,,60730,17072,M3L
28,,SING,CM2,HM21,,,,,60730,17072,M3L
29,,SING,CM2,HM22,,,,,60730,17072,M3L
30,,SING,CM2,HM23,,,,,60730,17072,M3L
31,,SING,CM3,HM31,,,,,60730,17072,M3L
32,,SING,CM3,HM32,,,,,60730,17072,M3L
33,,SING,CM3,HM33,,,,,60730,17072,M3L
1,,DOUB,P,OP1,,,1,,60845,17078,H2U
2,,SING,P,OP2,,,2,,60845,17078,H2U
3,,SING,P,OP3,,,3,,60845,17078,H2U
4,,SING,P,O5',,,4,,60845,17078,H2U
5,,SING,OP2,HOP2,,,5,,60845,17078,H2U
6,,SING,OP3,HOP3,,,6,,60845,17078,H2U
7,,SING,O5',C5',,,7,,60845,17078,H2U
8,,SING,C5',C4',,,8,,60845,17078,H2U
9,,SING,C5',H5',,,9,,60845,17078,H2U
10,,SING,C5',H5'',,,10,,60845,17078,H2U
11,,SING,C4',O4',,,11,,60845,17078,H2U
12,,SING,C4',C3',,,12,,60845,17078,H2U
13,,SING,C4',H4',,,13,,60845,17078,H2U
14,,SING,O4',C1',,,14,,60845,17078,H2U
15,,SING,C3',O3',,,15,,60845,17078,H2U
16,,SING,C3',C2',,,16,,60845,17078,H2U
17,,SING,C3',H3',,,17,,60845,17078,H2U
18,,SING,O3',HO3',,,18,,60845,17078,H2U
19,,SING,C1',C2',,,19,,60845,17078,H2U
20,,SING,C1',N1,,,20,,60845,17078,H2U
21,,SING,C1',H1',,,21,,60845,17078,H2U
22,,SING,C2',O2',,,22,,60845,17078,H2U
23,,SING,C2',H2',,,23,,60845,17078,H2U
24,,SING,O2',HO2',,,24,,60845,17078,H2U
25,,SING,N1,C2,,,25,,60845,17078,H2U
26,,SING,N1,C6,,,26,,60845,17078,H2U
27,,DOUB,C2,O2,,,27,,60845,17078,H2U
28,,SING,C2,N3,,,28,,60845,17078,H2U
29,,SING,N3,C4,,,29,,60845,17078,H2U
30,,SING,N3,HN3,,,30,,60845,17078,H2U
31,,DOUB,C4,O4,,,31,,60845,17078,H2U
32,,SING,C4,C5,,,32,,60845,17078,H2U
33,,SING,C5,C6,,,33,,60845,17078,H2U
34,,SING,C5,H51,,,34,,60845,17078,H2U
35,,SING,C5,H52,,,35,,60845,17078,H2U
36,,SING,C6,H61,,,36,,60845,17078,H2U
37,,SING,C6,H62,,,37,,60845,17078,H2U
1,,SING,N1,C2,,,1,,60846,17078,PSU
2,,SING,N1,C6,,,2,,60846,17078,PSU
3,,SING,N1,HN1,,,3,,60846,17078,PSU
4,,SING,C2,N3,,,4,,60846,17078,PSU
5,,DOUB,C2,O2,,,5,,60846,17078,PSU
6,,SING,N3,C4,,,6,,60846,17078,PSU
7,,SING,N3,HN3,,,7,,60846,17078,PSU
8,,SING,C4,C5,,,8,,60846,17078,PSU
9,,DOUB,C4,O4,,,9,,60846,17078,PSU
10,,DOUB,C5,C6,,,10,,60846,17078,PSU
11,,SING,C5,C1',,,11,,60846,17078,PSU
12,,SING,C6,H6,,,12,,60846,17078,PSU
13,,SING,C1',C2',,,13,,60846,17078,PSU
14,,SING,C1',O4',,,14,,60846,17078,PSU
15,,SING,C1',H1',,,15,,60846,17078,PSU
16,,SING,C2',O2',,,16,,60846,17078,PSU
17,,SING,C2',C3',,,17,,60846,17078,PSU
18,,SING,C2',H2',,,18,,60846,17078,PSU
19,,SING,O2',HO2',,,19,,60846,17078,PSU
20,,SING,C3',C4',,,20,,60846,17078,PSU
21,,SING,C3',O3',,,21,,60846,17078,PSU
22,,SING,C3',H3',,,22,,60846,17078,PSU
23,,SING,C4',O4',,,23,,60846,17078,PSU
24,,SING,C4',C5',,,24,,60846,17078,PSU
25,,SING,C4',H4',,,25,,60846,17078,PSU
26,,SING,O3',HO3',,,26,,60846,17078,PSU
27,,SING,C5',O5',,,27,,60846,17078,PSU
28,,SING,C5',H5',,,28,,60846,17078,PSU
29,,SING,C5',H5'',,,29,,60846,17078,PSU
30,,SING,O5',P,,,30,,60846,17078,PSU
31,,DOUB,P,OP1,,,31,,60846,17078,PSU
32,,SING,P,OP2,,,32,,60846,17078,PSU
33,,SING,P,OP3,,,33,,60846,17078,PSU
34,,SING,OP2,HOP2,,,34,,60846,17078,PSU
35,,SING,OP3,HOP3,,,35,,60846,17078,PSU
1,,SING,N1,C2,,,1,,60847,17078,5MU
2,,SING,N1,C6,,,2,,60847,17078,5MU
3,,SING,N1,C1',,,3,,60847,17078,5MU
4,,SING,C2,N3,,,4,,60847,17078,5MU
5,,DOUB,C2,O2,,,5,,60847,17078,5MU
6,,SING,N3,C4,,,6,,60847,17078,5MU
7,,SING,N3,HN3,,,7,,60847,17078,5MU
8,,SING,C4,C5,,,8,,60847,17078,5MU
9,,DOUB,C4,O4,,,9,,60847,17078,5MU
10,,SING,C5,C5M,,,10,,60847,17078,5MU
11,,DOUB,C5,C6,,,11,,60847,17078,5MU
12,,SING,C5M,H71,,,12,,60847,17078,5MU
13,,SING,C5M,H72,,,13,,60847,17078,5MU
14,,SING,C5M,H73,,,14,,60847,17078,5MU
15,,SING,C6,H6,,,15,,60847,17078,5MU
16,,SING,C1',C2',,,16,,60847,17078,5MU
17,,SING,C1',O4',,,17,,60847,17078,5MU
18,,SING,C1',H1',,,18,,60847,17078,5MU
19,,SING,C2',O2',,,19,,60847,17078,5MU
20,,SING,C2',C3',,,20,,60847,17078,5MU
21,,SING,C2',H2',,,21,,60847,17078,5MU
22,,SING,O2',HO2',,,22,,60847,17078,5MU
23,,SING,C3',C4',,,23,,60847,17078,5MU
24,,SING,C3',O3',,,24,,60847,17078,5MU
25,,SING,C3',H3',,,25,,60847,17078,5MU
26,,SING,C4',O4',,,26,,60847,17078,5MU
27,,SING,C4',C5',,,27,,60847,17078,5MU
28,,SING,C4',H4',,,28,,60847,17078,5MU
29,,SING,O3',HO3',,,29,,60847,17078,5MU
30,,SING,C5',O5',,,30,,60847,17078,5MU
31,,SING,C5',H5',,,31,,60847,17078,5MU
32,,SING,C5',H5'',,,32,,60847,17078,5MU
33,,SING,O5',P,,,33,,60847,17078,5MU
34,,DOUB,P,OP1,,,34,,60847,17078,5MU
35,,SING,P,OP2,,,35,,60847,17078,5MU
36,,SING,P,OP3,,,36,,60847,17078,5MU
37,,SING,OP2,HOP2,,,37,,60847,17078,5MU
38,,SING,OP3,HOP3,,,38,,60847,17078,5MU
1,,DOUB,P,OP1,,,1,,60848,17078,OMG
2,,SING,P,OP2,,,2,,60848,17078,OMG
3,,SING,P,OP3,,,3,,60848,17078,OMG
4,,SING,P,O5',,,4,,60848,17078,OMG
5,,SING,OP2,HOP2,,,5,,60848,17078,OMG
6,,SING,OP3,HOP3,,,6,,60848,17078,OMG
7,,SING,O5',C5',,,7,,60848,17078,OMG
8,,SING,C5',C4',,,8,,60848,17078,OMG
9,,SING,C5',H5',,,9,,60848,17078,OMG
10,,SING,C5',H5'',,,10,,60848,17078,OMG
11,,SING,C4',O4',,,11,,60848,17078,OMG
12,,SING,C4',C3',,,12,,60848,17078,OMG
13,,SING,C4',H4',,,13,,60848,17078,OMG
14,,SING,O4',C1',,,14,,60848,17078,OMG
15,,SING,C3',O3',,,15,,60848,17078,OMG
16,,SING,C3',C2',,,16,,60848,17078,OMG
17,,SING,C3',H3',,,17,,60848,17078,OMG
18,,SING,O3',HO3',,,18,,60848,17078,OMG
19,,SING,C2',O2',,,19,,60848,17078,OMG
20,,SING,C2',C1',,,20,,60848,17078,OMG
21,,SING,C2',H2',,,21,,60848,17078,OMG
22,,SING,O2',CM2,,,22,,60848,17078,OMG
23,,SING,CM2,HM21,,,23,,60848,17078,OMG
24,,SING,CM2,HM22,,,24,,60848,17078,OMG
25,,SING,CM2,HM23,,,25,,60848,17078,OMG
26,,SING,C1',N9,,,26,,60848,17078,OMG
27,,SING,C1',H1',,,27,,60848,17078,OMG
28,,SING,N9,C8,,,28,,60848,17078,OMG
29,,SING,N9,C4,,,29,,60848,17078,OMG
30,,DOUB,C8,N7,,,30,,60848,17078,OMG
31,,SING,C8,H8,,,31,,60848,17078,OMG
32,,SING,N7,C5,,,32,,60848,17078,OMG
33,,SING,C5,C6,,,33,,60848,17078,OMG
34,,DOUB,C5,C4,,,34,,60848,17078,OMG
35,,DOUB,C6,O6,,,35,,60848,17078,OMG
36,,SING,C6,N1,,,36,,60848,17078,OMG
37,,SING,N1,C2,,,37,,60848,17078,OMG
38,,SING,N1,HN1,,,38,,60848,17078,OMG
39,,SING,C2,N2,,,39,,60848,17078,OMG
40,,DOUB,C2,N3,,,40,,60848,17078,OMG
41,,SING,N2,HN21,,,41,,60848,17078,OMG
42,,SING,N2,HN22,,,42,,60848,17078,OMG
43,,SING,N3,C4,,,43,,60848,17078,OMG
1,,DOUB,P,OP1,,,1,,60849,17078,1MG
2,,SING,P,OP2,,,2,,60849,17078,1MG
3,,SING,P,OP3,,,3,,60849,17078,1MG
4,,SING,P,O5',,,4,,60849,17078,1MG
5,,SING,OP2,HOP2,,,5,,60849,17078,1MG
6,,SING,OP3,HOP3,,,6,,60849,17078,1MG
7,,SING,O5',C5',,,7,,60849,17078,1MG
8,,SING,C5',C4',,,8,,60849,17078,1MG
9,,SING,C5',H5',,,9,,60849,17078,1MG
10,,SING,C5',H5'',,,10,,60849,17078,1MG
11,,SING,C4',O4',,,11,,60849,17078,1MG
12,,SING,C4',C3',,,12,,60849,17078,1MG
13,,SING,C4',H4',,,13,,60849,17078,1MG
14,,SING,O4',C1',,,14,,60849,17078,1MG
15,,SING,C3',O3',,,15,,60849,17078,1MG
16,,SING,C3',C2',,,16,,60849,17078,1MG
17,,SING,C3',H3',,,17,,60849,17078,1MG
18,,SING,O3',HO3',,,18,,60849,17078,1MG
19,,SING,C2',O2',,,19,,60849,17078,1MG
20,,SING,C2',C1',,,20,,60849,17078,1MG
21,,SING,C2',H2',,,21,,60849,17078,1MG
22,,SING,O2',HO2',,,22,,60849,17078,1MG
23,,SING,C1',N9,,,23,,60849,17078,1MG
24,,SING,C1',H1',,,24,,60849,17078,1MG
25,,SING,N9,C8,,,25,,60849,17078,1MG
26,,SING,N9,C4,,,26,,60849,17078,1MG
27,,DOUB,C8,N7,,,27,,60849,17078,1MG
28,,SING,C8,H8,,,28,,60849,17078,1MG
29,,SING,N7,C5,,,29,,60849,17078,1MG
30,,SING,C5,C6,,,30,,60849,17078,1MG
31,,DOUB,C5,C4,,,31,,60849,17078,1MG
32,,DOUB,C6,O6,,,32,,60849,17078,1MG
33,,SING,C6,N1,,,33,,60849,17078,1MG
34,,SING,N1,CM1,,,34,,60849,17078,1MG
35,,SING,N1,C2,,,35,,60849,17078,1MG
36,,SING,CM1,HM11,,,36,,60849,17078,1MG
37,,SING,CM1,HM12,,,37,,60849,17078,1MG
38,,SING,CM1,HM13,,,38,,60849,17078,1MG
39,,SING,C2,N2,,,39,,60849,17078,1MG
40,,DOUB,C2,N3,,,40,,60849,17078,1MG
41,,SING,N2,HN21,,,41,,60849,17078,1MG
42,,SING,N2,HN22,,,42,,60849,17078,1MG
43,,SING,N3,C4,,,43,,60849,17078,1MG
1,,SING,N,CA,,,1,,60867,17079,M3L
2,,SING,N,H,,,2,,60867,17079,M3L
3,,SING,N,H2,,,3,,60867,17079,M3L
4,,SING,CA,CB,,,4,,60867,17079,M3L
5,,SING,CA,C,,,5,,60867,17079,M3L
6,,SING,CA,HA,,,6,,60867,17079,M3L
7,,SING,CB,CG,,,7,,60867,17079,M3L
8,,SING,CB,HB2,,,8,,60867,17079,M3L
9,,SING,CB,HB3,,,9,,60867,17079,M3L
10,,SING,CG,CD,,,10,,60867,17079,M3L
11,,SING,CG,HG2,,,11,,60867,17079,M3L
12,,SING,CG,HG3,,,12,,60867,17079,M3L
13,,SING,CD,CE,,,13,,60867,17079,M3L
14,,SING,CD,HD2,,,14,,60867,17079,M3L
15,,SING,CD,HD3,,,15,,60867,17079,M3L
16,,SING,CE,NZ,,,16,,60867,17079,M3L
17,,SING,CE,HE2,,,17,,60867,17079,M3L
18,,SING,CE,HE3,,,18,,60867,17079,M3L
19,,SING,NZ,CM1,,,19,,60867,17079,M3L
20,,SING,NZ,CM2,,,20,,60867,17079,M3L
21,,SING,NZ,CM3,,,21,,60867,17079,M3L
22,,DOUB,C,O,,,22,,60867,17079,M3L
23,,SING,C,OXT,,,23,,60867,17079,M3L
24,,SING,OXT,HXT,,,24,,60867,17079,M3L
25,,SING,CM1,HM11,,,25,,60867,17079,M3L
26,,SING,CM1,HM12,,,26,,60867,17079,M3L
27,,SING,CM1,HM13,,,27,,60867,17079,M3L
28,,SING,CM2,HM21,,,28,,60867,17079,M3L
29,,SING,CM2,HM22,,,29,,60867,17079,M3L
30,,SING,CM2,HM23,,,30,,60867,17079,M3L
31,,SING,CM3,HM31,,,31,,60867,17079,M3L
32,,SING,CM3,HM32,,,32,,60867,17079,M3L
33,,SING,CM3,HM33,,,33,,60867,17079,M3L
1,,SING,N,CA,no,N,1,,60893,17080,PTR
2,,SING,N,H,no,N,2,,60893,17080,PTR
3,,SING,N,HN2,no,N,3,,60893,17080,PTR
4,,SING,CA,C,no,N,4,,60893,17080,PTR
5,,SING,CA,CB,no,N,5,,60893,17080,PTR
6,,SING,CA,HA,no,N,6,,60893,17080,PTR
7,,DOUB,C,O,no,N,7,,60893,17080,PTR
8,,SING,C,OXT,no,N,8,,60893,17080,PTR
9,,SING,OXT,HXT,no,N,9,,60893,17080,PTR
10,,SING,CB,CG,no,N,10,,60893,17080,PTR
11,,SING,CB,HB2,no,N,11,,60893,17080,PTR
12,,SING,CB,HB3,no,N,12,,60893,17080,PTR
13,,DOUB,CG,CD1,yes,N,13,,60893,17080,PTR
14,,SING,CG,CD2,yes,N,14,,60893,17080,PTR
15,,SING,CD1,CE1,yes,N,15,,60893,17080,PTR
16,,SING,CD1,HD1,no,N,16,,60893,17080,PTR
17,,DOUB,CD2,CE2,yes,N,17,,60893,17080,PTR
18,,SING,CD2,HD2,no,N,18,,60893,17080,PTR
19,,DOUB,CE1,CZ,yes,N,19,,60893,17080,PTR
20,,SING,CE1,HE1,no,N,20,,60893,17080,PTR
21,,SING,CE2,CZ,yes,N,21,,60893,17080,PTR
22,,SING,CE2,HE2,no,N,22,,60893,17080,PTR
23,,SING,CZ,OH,no,N,23,,60893,17080,PTR
24,,SING,OH,P,no,N,24,,60893,17080,PTR
25,,DOUB,P,O1P,no,N,25,,60893,17080,PTR
26,,SING,P,O2P,no,N,26,,60893,17080,PTR
27,,SING,P,O3P,no,N,27,,60893,17080,PTR
28,,SING,O2P,HO2P,no,N,28,,60893,17080,PTR
29,,SING,O3P,HO3P,no,N,29,,60893,17080,PTR
1,,SING,N1,C2,no,N,1,,61055,17088,PSU
2,,SING,N1,C6,no,N,2,,61055,17088,PSU
3,,SING,N1,HN1,no,N,3,,61055,17088,PSU
4,,SING,C2,N3,no,N,4,,61055,17088,PSU
5,,DOUB,C2,O2,no,N,5,,61055,17088,PSU
6,,SING,N3,C4,no,N,6,,61055,17088,PSU
7,,SING,N3,HN3,no,N,7,,61055,17088,PSU
8,,SING,C4,C5,no,N,8,,61055,17088,PSU
9,,DOUB,C4,O4,no,N,9,,61055,17088,PSU
10,,DOUB,C5,C6,no,N,10,,61055,17088,PSU
11,,SING,C5,C1',no,N,11,,61055,17088,PSU
12,,SING,C6,H6,no,N,12,,61055,17088,PSU
13,,SING,C1',C2',no,N,13,,61055,17088,PSU
14,,SING,C1',O4',no,N,14,,61055,17088,PSU
15,,SING,C1',H1',no,N,15,,61055,17088,PSU
16,,SING,C2',O2',no,N,16,,61055,17088,PSU
17,,SING,C2',C3',no,N,17,,61055,17088,PSU
18,,SING,C2',H2',no,N,18,,61055,17088,PSU
19,,SING,O2',HO2',no,N,19,,61055,17088,PSU
20,,SING,C3',C4',no,N,20,,61055,17088,PSU
21,,SING,C3',O3',no,N,21,,61055,17088,PSU
22,,SING,C3',H3',no,N,22,,61055,17088,PSU
23,,SING,C4',O4',no,N,23,,61055,17088,PSU
24,,SING,C4',C5',no,N,24,,61055,17088,PSU
25,,SING,C4',H4',no,N,25,,61055,17088,PSU
26,,SING,O3',HO3',no,N,26,,61055,17088,PSU
27,,SING,C5',O5',no,N,27,,61055,17088,PSU
28,,SING,C5',H5',no,N,28,,61055,17088,PSU
29,,SING,C5',H5'',no,N,29,,61055,17088,PSU
30,,SING,O5',P,no,N,30,,61055,17088,PSU
31,,DOUB,P,OP1,no,N,31,,61055,17088,PSU
32,,SING,P,OP2,no,N,32,,61055,17088,PSU
33,,SING,P,OP3,no,N,33,,61055,17088,PSU
34,,SING,OP2,HOP2,no,N,34,,61055,17088,PSU
35,,SING,OP3,HOP3,no,N,35,,61055,17088,PSU
1,,SING,C1,C2,no,N,1,,61171,17093,TSA
2,,SING,C1,C6,no,N,2,,61171,17093,TSA
3,,SING,C1,C9,no,N,3,,61171,17093,TSA
4,,SING,C1,C10,no,N,4,,61171,17093,TSA
5,,DOUB,C2,C3,no,N,5,,61171,17093,TSA
6,,SING,C2,H2,no,N,6,,61171,17093,TSA
7,,SING,C3,C4,no,N,7,,61171,17093,TSA
8,,SING,C3,H3,no,N,8,,61171,17093,TSA
9,,SING,C4,O5,no,N,9,,61171,17093,TSA
10,,SING,C4,C5,no,N,10,,61171,17093,TSA
11,,SING,C4,H4,no,N,11,,61171,17093,TSA
12,,SING,O5,HO5,no,N,12,,61171,17093,TSA
13,,SING,C5,C6,no,N,13,,61171,17093,TSA
14,,SING,C5,O7,no,N,14,,61171,17093,TSA
15,,SING,C5,H5,no,N,15,,61171,17093,TSA
16,,SING,C6,H61,no,N,16,,61171,17093,TSA
17,,SING,C6,H62,no,N,17,,61171,17093,TSA
18,,SING,O7,C8,no,N,18,,61171,17093,TSA
19,,SING,C8,C9,no,N,19,,61171,17093,TSA
20,,SING,C8,C11,no,N,20,,61171,17093,TSA
21,,SING,C8,H8,no,N,21,,61171,17093,TSA
22,,SING,C9,H91,no,N,22,,61171,17093,TSA
23,,SING,C9,H92,no,N,23,,61171,17093,TSA
24,,DOUB,C10,O1,no,N,24,,61171,17093,TSA
25,,SING,C10,O2,no,N,25,,61171,17093,TSA
26,,SING,O2,HO2,no,N,26,,61171,17093,TSA
27,,DOUB,C11,O3,no,N,27,,61171,17093,TSA
28,,SING,C11,O4,no,N,28,,61171,17093,TSA
29,,SING,O4,HO4,no,N,29,,61171,17093,TSA
1,,DOUB,C1,C2,,,1,,61191,17094,BRN
2,,SING,C1,C6,,,2,,61191,17094,BRN
3,,SING,C1,N1,,,3,,61191,17094,BRN
4,,SING,C2,C3,,,4,,61191,17094,BRN
5,,SING,C2,H2,,,5,,61191,17094,BRN
6,,DOUB,C3,C4,,,6,,61191,17094,BRN
7,,SING,C3,H3,,,7,,61191,17094,BRN
8,,SING,C4,C5,,,8,,61191,17094,BRN
9,,SING,C4,C7,,,9,,61191,17094,BRN
10,,DOUB,C5,C6,,,10,,61191,17094,BRN
11,,SING,C5,H5,,,11,,61191,17094,BRN
12,,SING,C6,H6,,,12,,61191,17094,BRN
13,,DOUB,C7,NA,,,13,,61191,17094,BRN
14,,SING,C7,NB,,,14,,61191,17094,BRN
15,,SING,NA,HA,,,15,,61191,17094,BRN
16,,SING,NB,HB1,,,16,,61191,17094,BRN
17,,SING,NB,HB2,,,17,,61191,17094,BRN
18,,SING,N1,N,,,18,,61191,17094,BRN
19,,SING,N1,HN1,,,19,,61191,17094,BRN
20,,DOUB,N,N1',,,20,,61191,17094,BRN
21,,SING,N1',C1',,,21,,61191,17094,BRN
22,,DOUB,C1',C2',,,22,,61191,17094,BRN
23,,SING,C1',C6',,,23,,61191,17094,BRN
24,,SING,C2',C3',,,24,,61191,17094,BRN
25,,SING,C2',H2',,,25,,61191,17094,BRN
26,,DOUB,C3',C4',,,26,,61191,17094,BRN
27,,SING,C3',H3',,,27,,61191,17094,BRN
28,,SING,C4',C5',,,28,,61191,17094,BRN
29,,SING,C4',C7',,,29,,61191,17094,BRN
30,,DOUB,C5',C6',,,30,,61191,17094,BRN
31,,SING,C5',H5',,,31,,61191,17094,BRN
32,,SING,C6',H6',,,32,,61191,17094,BRN
33,,DOUB,C7',NA',,,33,,61191,17094,BRN
34,,SING,C7',NB',,,34,,61191,17094,BRN
35,,SING,NA',HA',,,35,,61191,17094,BRN
36,,SING,NB',HB'1,,,36,,61191,17094,BRN
37,,SING,NB',HB'2,,,37,,61191,17094,BRN
1,,SING,N1,C2,,,1,,61246,17097,IMD
2,,SING,N1,C5,,,2,,61246,17097,IMD
3,,SING,N1,HN1,,,3,,61246,17097,IMD
4,,DOUB,C2,N3,,,4,,61246,17097,IMD
5,,SING,C2,H2,,,5,,61246,17097,IMD
6,,SING,N3,C4,,,6,,61246,17097,IMD
7,,SING,N3,HN3,,,7,,61246,17097,IMD
8,,DOUB,C4,C5,,,8,,61246,17097,IMD
9,,SING,C4,H4,,,9,,61246,17097,IMD
10,,SING,C5,H5,,,10,,61246,17097,IMD
1,,SING,N1,C2,,,1,,61247,17097,2MZ
2,,SING,N1,C5,,,2,,61247,17097,2MZ
3,,SING,N1,HN1,,,3,,61247,17097,2MZ
4,,DOUB,C2,N3,,,4,,61247,17097,2MZ
5,,SING,C2,C6,,,5,,61247,17097,2MZ
6,,SING,N3,C4,,,6,,61247,17097,2MZ
7,,DOUB,C4,C5,,,7,,61247,17097,2MZ
8,,SING,C4,H4,,,8,,61247,17097,2MZ
9,,SING,C5,H5,,,9,,61247,17097,2MZ
10,,SING,C6,H61,,,10,,61247,17097,2MZ
11,,SING,C6,H62,,,11,,61247,17097,2MZ
12,,SING,C6,H63,,,12,,61247,17097,2MZ
1,,DOUB,PG,O1G,,,1,,61263,17098,ATP
2,,SING,PG,O2G,,,2,,61263,17098,ATP
3,,SING,PG,O3G,,,3,,61263,17098,ATP
4,,SING,PG,O3B,,,4,,61263,17098,ATP
5,,SING,O2G,HOG2,,,5,,61263,17098,ATP
6,,SING,O3G,HOG3,,,6,,61263,17098,ATP
7,,DOUB,PB,O1B,,,7,,61263,17098,ATP
8,,SING,PB,O2B,,,8,,61263,17098,ATP
9,,SING,PB,O3B,,,9,,61263,17098,ATP
10,,SING,PB,O3A,,,10,,61263,17098,ATP
11,,SING,O2B,HOB2,,,11,,61263,17098,ATP
12,,DOUB,PA,O1A,,,12,,61263,17098,ATP
13,,SING,PA,O2A,,,13,,61263,17098,ATP
14,,SING,PA,O3A,,,14,,61263,17098,ATP
15,,SING,PA,O5',,,15,,61263,17098,ATP
16,,SING,O2A,HOA2,,,16,,61263,17098,ATP
17,,SING,O5',C5',,,17,,61263,17098,ATP
18,,SING,C5',C4',,,18,,61263,17098,ATP
19,,SING,C5',H5'1,,,19,,61263,17098,ATP
20,,SING,C5',H5'2,,,20,,61263,17098,ATP
21,,SING,C4',O4',,,21,,61263,17098,ATP
22,,SING,C4',C3',,,22,,61263,17098,ATP
23,,SING,C4',H4',,,23,,61263,17098,ATP
24,,SING,O4',C1',,,24,,61263,17098,ATP
25,,SING,C3',O3',,,25,,61263,17098,ATP
26,,SING,C3',C2',,,26,,61263,17098,ATP
27,,SING,C3',H3',,,27,,61263,17098,ATP
28,,SING,O3',HO3',,,28,,61263,17098,ATP
29,,SING,C2',O2',,,29,,61263,17098,ATP
30,,SING,C2',C1',,,30,,61263,17098,ATP
31,,SING,C2',H2',,,31,,61263,17098,ATP
32,,SING,O2',HO2',,,32,,61263,17098,ATP
33,,SING,C1',N9,,,33,,61263,17098,ATP
34,,SING,C1',H1',,,34,,61263,17098,ATP
35,,SING,N9,C8,,,35,,61263,17098,ATP
36,,SING,N9,C4,,,36,,61263,17098,ATP
37,,DOUB,C8,N7,,,37,,61263,17098,ATP
38,,SING,C8,H8,,,38,,61263,17098,ATP
39,,SING,N7,C5,,,39,,61263,17098,ATP
40,,SING,C5,C6,,,40,,61263,17098,ATP
41,,DOUB,C5,C4,,,41,,61263,17098,ATP
42,,SING,C6,N6,,,42,,61263,17098,ATP
43,,DOUB,C6,N1,,,43,,61263,17098,ATP
44,,SING,N6,HN61,,,44,,61263,17098,ATP
45,,SING,N6,HN62,,,45,,61263,17098,ATP
46,,SING,N1,C2,,,46,,61263,17098,ATP
47,,DOUB,C2,N3,,,47,,61263,17098,ATP
48,,SING,C2,H2,,,48,,61263,17098,ATP
49,,SING,N3,C4,,,49,,61263,17098,ATP
1,,SING,O20,C5,no,N,1,,61280,17099,EDT
2,,SING,O20,H20,no,N,2,,61280,17099,EDT
3,,DOUB,C5,O19,no,N,3,,61280,17099,EDT
4,,SING,C5,C4,no,N,4,,61280,17099,EDT
5,,SING,C4,N3,no,N,5,,61280,17099,EDT
6,,SING,C4,H041,no,N,6,,61280,17099,EDT
7,,SING,C4,H042,no,N,7,,61280,17099,EDT
8,,SING,N3,C2,no,N,8,,61280,17099,EDT
9,,SING,N3,C6,no,N,9,,61280,17099,EDT
10,,SING,C2,C1,no,N,10,,61280,17099,EDT
11,,SING,C2,H021,no,N,11,,61280,17099,EDT
12,,SING,C2,H022,no,N,12,,61280,17099,EDT
13,,DOUB,C1,O18,no,N,13,,61280,17099,EDT
14,,SING,C1,O17,no,N,14,,61280,17099,EDT
15,,SING,O17,H17,no,N,15,,61280,17099,EDT
16,,SING,C6,C7,no,N,16,,61280,17099,EDT
17,,SING,C6,H061,no,N,17,,61280,17099,EDT
18,,SING,C6,H062,no,N,18,,61280,17099,EDT
19,,SING,C7,N8,no,N,19,,61280,17099,EDT
20,,SING,C7,H071,no,N,20,,61280,17099,EDT
21,,SING,C7,H072,no,N,21,,61280,17099,EDT
22,,SING,N8,C9,no,N,22,,61280,17099,EDT
23,,SING,N8,C11,no,N,23,,61280,17099,EDT
24,,SING,C9,C10,no,N,24,,61280,17099,EDT
25,,SING,C9,H091,no,N,25,,61280,17099,EDT
26,,SING,C9,H092,no,N,26,,61280,17099,EDT
27,,SING,C10,O16,no,N,27,,61280,17099,EDT
28,,DOUB,C10,O15,no,N,28,,61280,17099,EDT
29,,SING,O16,H16,no,N,29,,61280,17099,EDT
30,,SING,C11,C12,no,N,30,,61280,17099,EDT
31,,SING,C11,H111,no,N,31,,61280,17099,EDT
32,,SING,C11,H112,no,N,32,,61280,17099,EDT
33,,DOUB,C12,O13,no,N,33,,61280,17099,EDT
34,,SING,C12,O14,no,N,34,,61280,17099,EDT
35,,SING,O14,H14,no,N,35,,61280,17099,EDT
1,,SING,N,CA,no,N,1,,61323,17100,PTR
2,,SING,N,H,no,N,2,,61323,17100,PTR
3,,SING,N,HN2,no,N,3,,61323,17100,PTR
4,,SING,CA,C,no,N,4,,61323,17100,PTR
5,,SING,CA,CB,no,N,5,,61323,17100,PTR
6,,SING,CA,HA,no,N,6,,61323,17100,PTR
7,,DOUB,C,O,no,N,7,,61323,17100,PTR
8,,SING,C,OXT,no,N,8,,61323,17100,PTR
9,,SING,OXT,HXT,no,N,9,,61323,17100,PTR
10,,SING,CB,CG,no,N,10,,61323,17100,PTR
11,,SING,CB,HB2,no,N,11,,61323,17100,PTR
12,,SING,CB,HB3,no,N,12,,61323,17100,PTR
13,,DOUB,CG,CD1,yes,N,13,,61323,17100,PTR
14,,SING,CG,CD2,yes,N,14,,61323,17100,PTR
15,,SING,CD1,CE1,yes,N,15,,61323,17100,PTR
16,,SING,CD1,HD1,no,N,16,,61323,17100,PTR
17,,DOUB,CD2,CE2,yes,N,17,,61323,17100,PTR
18,,SING,CD2,HD2,no,N,18,,61323,17100,PTR
19,,DOUB,CE1,CZ,yes,N,19,,61323,17100,PTR
20,,SING,CE1,HE1,no,N,20,,61323,17100,PTR
21,,SING,CE2,CZ,yes,N,21,,61323,17100,PTR
22,,SING,CE2,HE2,no,N,22,,61323,17100,PTR
23,,SING,CZ,OH,no,N,23,,61323,17100,PTR
24,,SING,OH,P,no,N,24,,61323,17100,PTR
25,,DOUB,P,O1P,no,N,25,,61323,17100,PTR
26,,SING,P,O2P,no,N,26,,61323,17100,PTR
27,,SING,P,O3P,no,N,27,,61323,17100,PTR
28,,SING,O2P,HO2P,no,N,28,,61323,17100,PTR
29,,SING,O3P,HO3P,no,N,29,,61323,17100,PTR
1,,SING,C11,C21,no,N,1,,61338,17101,CTO
2,,SING,C11,O51,no,N,2,,61338,17101,CTO
3,,SING,C11,O42,no,N,3,,61338,17101,CTO
4,,SING,C11,H11,no,N,4,,61338,17101,CTO
5,,SING,C21,N21,no,N,5,,61338,17101,CTO
6,,SING,C21,C31,no,N,6,,61338,17101,CTO
7,,SING,C21,H21,no,N,7,,61338,17101,CTO
8,,SING,N21,C71,no,N,8,,61338,17101,CTO
9,,SING,N21,HNL,no,N,9,,61338,17101,CTO
10,,DOUB,C71,O71,no,N,10,,61338,17101,CTO
11,,SING,C71,C81,no,N,11,,61338,17101,CTO
12,,SING,C81,H811,no,N,12,,61338,17101,CTO
13,,SING,C81,H812,no,N,13,,61338,17101,CTO
14,,SING,C81,H813,no,N,14,,61338,17101,CTO
15,,SING,C31,O31,no,N,15,,61338,17101,CTO
16,,SING,C31,C41,no,N,16,,61338,17101,CTO
17,,SING,C31,H31,no,N,17,,61338,17101,CTO
18,,SING,O31,HOV,no,N,18,,61338,17101,CTO
19,,SING,C41,O41,no,N,19,,61338,17101,CTO
20,,SING,C41,C51,no,N,20,,61338,17101,CTO
21,,SING,C41,H41,no,N,21,,61338,17101,CTO
22,,SING,O41,HO4,no,N,22,,61338,17101,CTO
23,,SING,C51,O51,no,N,23,,61338,17101,CTO
24,,SING,C51,C61,no,N,24,,61338,17101,CTO
25,,SING,C51,H51,no,N,25,,61338,17101,CTO
26,,SING,C61,O61,no,N,26,,61338,17101,CTO
27,,SING,C61,H611,no,N,27,,61338,17101,CTO
28,,SING,C61,H612,no,N,28,,61338,17101,CTO
29,,SING,O61,HO6,no,N,29,,61338,17101,CTO
30,,SING,C12,C22,no,N,30,,61338,17101,CTO
31,,SING,C12,O52,no,N,31,,61338,17101,CTO
32,,SING,C12,O43,no,N,32,,61338,17101,CTO
33,,SING,C12,H12,no,N,33,,61338,17101,CTO
34,,SING,C22,N22,no,N,34,,61338,17101,CTO
35,,SING,C22,C32,no,N,35,,61338,17101,CTO
36,,SING,C22,H22,no,N,36,,61338,17101,CTO
37,,SING,N22,C72,no,N,37,,61338,17101,CTO
38,,SING,N22,HNM,no,N,38,,61338,17101,CTO
39,,DOUB,C72,O72,no,N,39,,61338,17101,CTO
40,,SING,C72,C82,no,N,40,,61338,17101,CTO
41,,SING,C82,H821,no,N,41,,61338,17101,CTO
42,,SING,C82,H822,no,N,42,,61338,17101,CTO
43,,SING,C82,H823,no,N,43,,61338,17101,CTO
44,,SING,C32,O32,no,N,44,,61338,17101,CTO
45,,SING,C32,C42,no,N,45,,61338,17101,CTO
46,,SING,C32,H32,no,N,46,,61338,17101,CTO
47,,SING,O32,HOW,no,N,47,,61338,17101,CTO
48,,SING,C42,O42,no,N,48,,61338,17101,CTO
49,,SING,C42,C52,no,N,49,,61338,17101,CTO
50,,SING,C42,H42,no,N,50,,61338,17101,CTO
51,,SING,C52,O52,no,N,51,,61338,17101,CTO
52,,SING,C52,C62,no,N,52,,61338,17101,CTO
53,,SING,C52,H52,no,N,53,,61338,17101,CTO
54,,SING,C62,O62,no,N,54,,61338,17101,CTO
55,,SING,C62,H621,no,N,55,,61338,17101,CTO
56,,SING,C62,H622,no,N,56,,61338,17101,CTO
57,,SING,O62,HO2,no,N,57,,61338,17101,CTO
58,,SING,C13,O13,no,N,58,,61338,17101,CTO
59,,SING,C13,C23,no,N,59,,61338,17101,CTO
60,,SING,C13,O53,no,N,60,,61338,17101,CTO
61,,SING,C13,H13,no,N,61,,61338,17101,CTO
62,,SING,O13,HOD,no,N,62,,61338,17101,CTO
63,,SING,C23,N23,no,N,63,,61338,17101,CTO
64,,SING,C23,C33,no,N,64,,61338,17101,CTO
65,,SING,C23,H23,no,N,65,,61338,17101,CTO
66,,SING,N23,C73,no,N,66,,61338,17101,CTO
67,,SING,N23,HNN,no,N,67,,61338,17101,CTO
68,,DOUB,C73,O73,no,N,68,,61338,17101,CTO
69,,SING,C73,C83,no,N,69,,61338,17101,CTO
70,,SING,C83,H831,no,N,70,,61338,17101,CTO
71,,SING,C83,H832,no,N,71,,61338,17101,CTO
72,,SING,C83,H833,no,N,72,,61338,17101,CTO
73,,SING,C33,O33,no,N,73,,61338,17101,CTO
74,,SING,C33,C43,no,N,74,,61338,17101,CTO
75,,SING,C33,H33,no,N,75,,61338,17101,CTO
76,,SING,O33,HOX,no,N,76,,61338,17101,CTO
77,,SING,C43,O43,no,N,77,,61338,17101,CTO
78,,SING,C43,C53,no,N,78,,61338,17101,CTO
79,,SING,C43,H43,no,N,79,,61338,17101,CTO
80,,SING,C53,O53,no,N,80,,61338,17101,CTO
81,,SING,C53,C63,no,N,81,,61338,17101,CTO
82,,SING,C53,H53,no,N,82,,61338,17101,CTO
83,,SING,C63,O63,no,N,83,,61338,17101,CTO
84,,SING,C63,H631,no,N,84,,61338,17101,CTO
85,,SING,C63,H632,no,N,85,,61338,17101,CTO
86,,SING,O63,HO3,no,N,86,,61338,17101,CTO
1,,SING,N1,C2,,,,,61431,17106,PRF
2,,SING,N1,C6,,,,,61431,17106,PRF
3,,SING,N1,H91,,,,,61431,17106,PRF
4,,DOUB,C2,N3,,,,,61431,17106,PRF
5,,SING,C2,N2,,,,,61431,17106,PRF
6,,SING,N3,C4,,,,,61431,17106,PRF
7,,DOUB,C4,C5,,,,,61431,17106,PRF
8,,SING,C4,N9,,,,,61431,17106,PRF
9,,SING,C5,C6,,,,,61431,17106,PRF
10,,SING,C5,C7,,,,,61431,17106,PRF
11,,DOUB,C6,O6,,,,,61431,17106,PRF
12,,SING,C7,C10,,,,,61431,17106,PRF
13,,DOUB,C7,C8,,,,,61431,17106,PRF
14,,SING,C10,N11,,,,,61431,17106,PRF
15,,SING,C10,H101,,,,,61431,17106,PRF
16,,SING,C10,H102,,,,,61431,17106,PRF
17,,SING,N11,H111,,,,,61431,17106,PRF
18,,SING,N11,H112,,,,,61431,17106,PRF
19,,SING,C8,N9,,,,,61431,17106,PRF
20,,SING,C8,H81,,,,,61431,17106,PRF
21,,SING,N9,HN91,,,,,61431,17106,PRF
22,,SING,N2,HN21,,,,,61431,17106,PRF
23,,SING,N2,HN22,,,,,61431,17106,PRF
1,,SING,N,CA,,,,,61457,17107,DAL
2,,SING,N,H,,,,,61457,17107,DAL
3,,SING,N,H2,,,,,61457,17107,DAL
4,,SING,CA,CB,,,,,61457,17107,DAL
5,,SING,CA,C,,,,,61457,17107,DAL
6,,SING,CA,HA,,,,,61457,17107,DAL
7,,SING,CB,HB1,,,,,61457,17107,DAL
8,,SING,CB,HB2,,,,,61457,17107,DAL
9,,SING,CB,HB3,,,,,61457,17107,DAL
10,,DOUB,C,O,,,,,61457,17107,DAL
11,,SING,C,OXT,,,,,61457,17107,DAL
12,,SING,OXT,HXT,,,,,61457,17107,DAL
1,,DOUB,O,C,no,N,1,,61610,17116,OPY
2,,SING,CA,C,no,N,2,,61610,17116,OPY
3,,SING,C,NAM,no,N,3,,61610,17116,OPY
4,,SING,N,CA,no,N,4,,61610,17116,OPY
5,,SING,N,HN,no,N,5,,61610,17116,OPY
6,,SING,N,HNA,no,N,6,,61610,17116,OPY
7,,SING,CA,CB,no,N,7,,61610,17116,OPY
8,,SING,CA,HA,no,N,8,,61610,17116,OPY
9,,SING,CB,CAD,no,N,9,,61610,17116,OPY
10,,SING,CB,HB,no,N,10,,61610,17116,OPY
11,,SING,CB,HBA,no,N,11,,61610,17116,OPY
12,,SING,CAD,NAA,no,N,12,,61610,17116,OPY
13,,SING,NAA,HNAA,no,N,13,,61610,17116,OPY
14,,SING,NAA,HNAB,no,N,14,,61610,17116,OPY
15,,SING,CAD,HAD,no,N,15,,61610,17116,OPY
16,,SING,CAD,HADA,no,N,16,,61610,17116,OPY
17,,SING,CAF,CAE,no,N,17,,61610,17116,OPY
18,,SING,CAG,CAE,no,N,18,,61610,17116,OPY
19,,SING,CAE,HAE,no,N,19,,61610,17116,OPY
20,,SING,CAE,HAEA,no,N,20,,61610,17116,OPY
21,,SING,CAI,CAF,no,N,21,,61610,17116,OPY
22,,SING,CAF,HAF,no,N,22,,61610,17116,OPY
23,,SING,CAF,HAFA,no,N,23,,61610,17116,OPY
24,,SING,CAJ,CAG,no,N,24,,61610,17116,OPY
25,,SING,CAG,HAG,no,N,25,,61610,17116,OPY
26,,SING,CAG,HAGA,no,N,26,,61610,17116,OPY
27,,SING,NAM,CAI,no,N,27,,61610,17116,OPY
28,,SING,CAI,HAI,no,N,28,,61610,17116,OPY
29,,SING,CAI,HAIA,no,N,29,,61610,17116,OPY
30,,SING,NAM,CAJ,no,N,30,,61610,17116,OPY
31,,SING,CAJ,HAJ,no,N,31,,61610,17116,OPY
32,,SING,CAJ,HAJA,no,N,32,,61610,17116,OPY
1,,SING,N1,C2,yes,N,1,,61674,17120,1MZ
2,,SING,N1,C5,yes,N,2,,61674,17120,1MZ
3,,SING,N1,CM1,no,N,3,,61674,17120,1MZ
4,,DOUB,C2,N3,yes,N,4,,61674,17120,1MZ
5,,SING,C2,H2,no,N,5,,61674,17120,1MZ
6,,SING,N3,C4,yes,N,6,,61674,17120,1MZ
7,,SING,N3,HN3,no,N,7,,61674,17120,1MZ
8,,DOUB,C4,C5,yes,N,8,,61674,17120,1MZ
9,,SING,C4,H4,no,N,9,,61674,17120,1MZ
10,,SING,C5,H5,no,N,10,,61674,17120,1MZ
11,,SING,CM1,HM11,no,N,11,,61674,17120,1MZ
12,,SING,CM1,HM12,no,N,12,,61674,17120,1MZ
13,,SING,CM1,HM13,no,N,13,,61674,17120,1MZ
1,,SING,N,CA,,,1,,61706,17122,FTR
2,,SING,N,H,,,2,,61706,17122,FTR
3,,SING,N,H2,,,3,,61706,17122,FTR
4,,SING,CA,CB,,,4,,61706,17122,FTR
5,,SING,CA,C,,,5,,61706,17122,FTR
6,,SING,CA,HA,,,6,,61706,17122,FTR
7,,SING,CB,CG,,,7,,61706,17122,FTR
8,,SING,CB,HB2,,,8,,61706,17122,FTR
9,,SING,CB,HB3,,,9,,61706,17122,FTR
10,,SING,CG,CD2,,,10,,61706,17122,FTR
11,,DOUB,CG,CD1,,,11,,61706,17122,FTR
12,,DOUB,CD2,CE2,,,12,,61706,17122,FTR
13,,SING,CD2,CE3,,,13,,61706,17122,FTR
14,,SING,CE2,NE1,,,14,,61706,17122,FTR
15,,SING,CE2,CZ2,,,15,,61706,17122,FTR
16,,DOUB,CE3,CZ3,,,16,,61706,17122,FTR
17,,SING,CE3,HE3,,,17,,61706,17122,FTR
18,,SING,CD1,NE1,,,18,,61706,17122,FTR
19,,SING,CD1,HD1,,,19,,61706,17122,FTR
20,,SING,NE1,HE1,,,20,,61706,17122,FTR
21,,DOUB,CZ2,CH2,,,21,,61706,17122,FTR
22,,SING,CZ2,HZ2,,,22,,61706,17122,FTR
23,,SING,CZ3,F,,,23,,61706,17122,FTR
24,,SING,CZ3,CH2,,,24,,61706,17122,FTR
25,,SING,CH2,HH2,,,25,,61706,17122,FTR
26,,DOUB,C,O,,,26,,61706,17122,FTR
27,,SING,C,OXT,,,27,,61706,17122,FTR
28,,SING,OXT,HXT,,,28,,61706,17122,FTR
1,,SING,O1,C1,no,N,1,,61707,17122,G3P
2,,SING,C1,C2,no,N,2,,61707,17122,G3P
3,,SING,C2,O2,no,N,3,,61707,17122,G3P
4,,SING,C2,C3,no,N,4,,61707,17122,G3P
5,,SING,C3,O1P,no,N,5,,61707,17122,G3P
6,,SING,O1P,P,no,N,6,,61707,17122,G3P
7,,SING,O4P,P,no,N,7,,61707,17122,G3P
8,,DOUB,O2P,P,no,N,8,,61707,17122,G3P
9,,SING,O3P,P,no,N,9,,61707,17122,G3P
10,,SING,O1,HO1,no,N,10,,61707,17122,G3P
11,,SING,C1,H11,no,N,11,,61707,17122,G3P
12,,SING,C1,H12,no,N,12,,61707,17122,G3P
13,,SING,C2,H2,no,N,13,,61707,17122,G3P
14,,SING,O2,HO2,no,N,14,,61707,17122,G3P
15,,SING,C3,H31,no,N,15,,61707,17122,G3P
16,,SING,C3,H32,no,N,16,,61707,17122,G3P
17,,SING,O3P,HOP3,no,N,17,,61707,17122,G3P
18,,SING,O4P,HOP4,no,N,18,,61707,17122,G3P
1,,SING,FE,NA,,,,,62113,17144,HEM
2,,SING,FE,NB,,,,,62113,17144,HEM
3,,SING,FE,NC,,,,,62113,17144,HEM
4,,SING,FE,ND,,,,,62113,17144,HEM
5,,DOUB,CHA,C1A,,,,,62113,17144,HEM
6,,SING,CHA,C4D,,,,,62113,17144,HEM
7,,SING,CHA,HHA,,,,,62113,17144,HEM
8,,DOUB,CHB,C4A,,,,,62113,17144,HEM
9,,SING,CHB,C1B,,,,,62113,17144,HEM
10,,SING,CHB,HHB,,,,,62113,17144,HEM
11,,DOUB,CHC,C4B,,,,,62113,17144,HEM
12,,SING,CHC,C1C,,,,,62113,17144,HEM
13,,SING,CHC,HHC,,,,,62113,17144,HEM
14,,SING,CHD,C4C,,,,,62113,17144,HEM
15,,DOUB,CHD,C1D,,,,,62113,17144,HEM
16,,SING,CHD,HHD,,,,,62113,17144,HEM
17,,SING,NA,C1A,,,,,62113,17144,HEM
18,,SING,NA,C4A,,,,,62113,17144,HEM
19,,SING,C1A,C2A,,,,,62113,17144,HEM
20,,DOUB,C2A,C3A,,,,,62113,17144,HEM
21,,SING,C2A,CAA,,,,,62113,17144,HEM
22,,SING,C3A,C4A,,,,,62113,17144,HEM
23,,SING,C3A,CMA,,,,,62113,17144,HEM
24,,SING,CMA,HMA1,,,,,62113,17144,HEM
25,,SING,CMA,HMA2,,,,,62113,17144,HEM
26,,SING,CMA,HMA3,,,,,62113,17144,HEM
27,,SING,CAA,CBA,,,,,62113,17144,HEM
28,,SING,CAA,HAA1,,,,,62113,17144,HEM
29,,SING,CAA,HAA2,,,,,62113,17144,HEM
30,,SING,CBA,CGA,,,,,62113,17144,HEM
31,,SING,CBA,HBA1,,,,,62113,17144,HEM
32,,SING,CBA,HBA2,,,,,62113,17144,HEM
33,,DOUB,CGA,O1A,,,,,62113,17144,HEM
34,,SING,CGA,O2A,,,,,62113,17144,HEM
35,,SING,O2A,H2A,,,,,62113,17144,HEM
36,,DOUB,NB,C1B,,,,,62113,17144,HEM
37,,SING,NB,C4B,,,,,62113,17144,HEM
38,,SING,C1B,C2B,,,,,62113,17144,HEM
39,,DOUB,C2B,C3B,,,,,62113,17144,HEM
40,,SING,C2B,CMB,,,,,62113,17144,HEM
41,,SING,C3B,C4B,,,,,62113,17144,HEM
42,,SING,C3B,CAB,,,,,62113,17144,HEM
43,,SING,CMB,HMB1,,,,,62113,17144,HEM
44,,SING,CMB,HMB2,,,,,62113,17144,HEM
45,,SING,CMB,HMB3,,,,,62113,17144,HEM
46,,DOUB,CAB,CBB,,,,,62113,17144,HEM
47,,SING,CAB,HAB,,,,,62113,17144,HEM
48,,SING,CBB,HBB1,,,,,62113,17144,HEM
49,,SING,CBB,HBB2,,,,,62113,17144,HEM
50,,SING,NC,C1C,,,,,62113,17144,HEM
51,,SING,NC,C4C,,,,,62113,17144,HEM
52,,DOUB,C1C,C2C,,,,,62113,17144,HEM
53,,SING,C2C,C3C,,,,,62113,17144,HEM
54,,SING,C2C,CMC,,,,,62113,17144,HEM
55,,DOUB,C3C,C4C,,,,,62113,17144,HEM
56,,SING,C3C,CAC,,,,,62113,17144,HEM
57,,SING,CMC,HMC1,,,,,62113,17144,HEM
58,,SING,CMC,HMC2,,,,,62113,17144,HEM
59,,SING,CMC,HMC3,,,,,62113,17144,HEM
60,,DOUB,CAC,CBC,,,,,62113,17144,HEM
61,,SING,CAC,HAC,,,,,62113,17144,HEM
62,,SING,CBC,HBC1,,,,,62113,17144,HEM
63,,SING,CBC,HBC2,,,,,62113,17144,HEM
64,,SING,ND,C1D,,,,,62113,17144,HEM
65,,DOUB,ND,C4D,,,,,62113,17144,HEM
66,,SING,C1D,C2D,,,,,62113,17144,HEM
67,,DOUB,C2D,C3D,,,,,62113,17144,HEM
68,,SING,C2D,CMD,,,,,62113,17144,HEM
69,,SING,C3D,C4D,,,,,62113,17144,HEM
70,,SING,C3D,CAD,,,,,62113,17144,HEM
71,,SING,CMD,HMD1,,,,,62113,17144,HEM
72,,SING,CMD,HMD2,,,,,62113,17144,HEM
73,,SING,CMD,HMD3,,,,,62113,17144,HEM
74,,SING,CAD,CBD,,,,,62113,17144,HEM
75,,SING,CAD,HAD1,,,,,62113,17144,HEM
76,,SING,CAD,HAD2,,,,,62113,17144,HEM
77,,SING,CBD,CGD,,,,,62113,17144,HEM
78,,SING,CBD,HBD1,,,,,62113,17144,HEM
79,,SING,CBD,HBD2,,,,,62113,17144,HEM
80,,DOUB,CGD,O1D,,,,,62113,17144,HEM
81,,SING,CGD,O2D,,,,,62113,17144,HEM
82,,SING,O2D,H2D,,,,,62113,17144,HEM
1,,SING,FE,NA,,,,,62151,17146,HEM
2,,SING,FE,NB,,,,,62151,17146,HEM
3,,SING,FE,NC,,,,,62151,17146,HEM
4,,SING,FE,ND,,,,,62151,17146,HEM
5,,DOUB,CHA,C1A,,,,,62151,17146,HEM
6,,SING,CHA,C4D,,,,,62151,17146,HEM
7,,SING,CHA,HHA,,,,,62151,17146,HEM
8,,DOUB,CHB,C4A,,,,,62151,17146,HEM
9,,SING,CHB,C1B,,,,,62151,17146,HEM
10,,SING,CHB,HHB,,,,,62151,17146,HEM
11,,DOUB,CHC,C4B,,,,,62151,17146,HEM
12,,SING,CHC,C1C,,,,,62151,17146,HEM
13,,SING,CHC,HHC,,,,,62151,17146,HEM
14,,SING,CHD,C4C,,,,,62151,17146,HEM
15,,DOUB,CHD,C1D,,,,,62151,17146,HEM
16,,SING,CHD,HHD,,,,,62151,17146,HEM
17,,SING,NA,C1A,,,,,62151,17146,HEM
18,,SING,NA,C4A,,,,,62151,17146,HEM
19,,SING,C1A,C2A,,,,,62151,17146,HEM
20,,DOUB,C2A,C3A,,,,,62151,17146,HEM
21,,SING,C2A,CAA,,,,,62151,17146,HEM
22,,SING,C3A,C4A,,,,,62151,17146,HEM
23,,SING,C3A,CMA,,,,,62151,17146,HEM
24,,SING,CMA,HMA1,,,,,62151,17146,HEM
25,,SING,CMA,HMA2,,,,,62151,17146,HEM
26,,SING,CMA,HMA3,,,,,62151,17146,HEM
27,,SING,CAA,CBA,,,,,62151,17146,HEM
28,,SING,CAA,HAA1,,,,,62151,17146,HEM
29,,SING,CAA,HAA2,,,,,62151,17146,HEM
30,,SING,CBA,CGA,,,,,62151,17146,HEM
31,,SING,CBA,HBA1,,,,,62151,17146,HEM
32,,SING,CBA,HBA2,,,,,62151,17146,HEM
33,,DOUB,CGA,O1A,,,,,62151,17146,HEM
34,,SING,CGA,O2A,,,,,62151,17146,HEM
35,,SING,O2A,H2A,,,,,62151,17146,HEM
36,,DOUB,NB,C1B,,,,,62151,17146,HEM
37,,SING,NB,C4B,,,,,62151,17146,HEM
38,,SING,C1B,C2B,,,,,62151,17146,HEM
39,,DOUB,C2B,C3B,,,,,62151,17146,HEM
40,,SING,C2B,CMB,,,,,62151,17146,HEM
41,,SING,C3B,C4B,,,,,62151,17146,HEM
42,,SING,C3B,CAB,,,,,62151,17146,HEM
43,,SING,CMB,HMB1,,,,,62151,17146,HEM
44,,SING,CMB,HMB2,,,,,62151,17146,HEM
45,,SING,CMB,HMB3,,,,,62151,17146,HEM
46,,DOUB,CAB,CBB,,,,,62151,17146,HEM
47,,SING,CAB,HAB,,,,,62151,17146,HEM
48,,SING,CBB,HBB1,,,,,62151,17146,HEM
49,,SING,CBB,HBB2,,,,,62151,17146,HEM
50,,SING,NC,C1C,,,,,62151,17146,HEM
51,,SING,NC,C4C,,,,,62151,17146,HEM
52,,DOUB,C1C,C2C,,,,,62151,17146,HEM
53,,SING,C2C,C3C,,,,,62151,17146,HEM
54,,SING,C2C,CMC,,,,,62151,17146,HEM
55,,DOUB,C3C,C4C,,,,,62151,17146,HEM
56,,SING,C3C,CAC,,,,,62151,17146,HEM
57,,SING,CMC,HMC1,,,,,62151,17146,HEM
58,,SING,CMC,HMC2,,,,,62151,17146,HEM
59,,SING,CMC,HMC3,,,,,62151,17146,HEM
60,,DOUB,CAC,CBC,,,,,62151,17146,HEM
61,,SING,CAC,HAC,,,,,62151,17146,HEM
62,,SING,CBC,HBC1,,,,,62151,17146,HEM
63,,SING,CBC,HBC2,,,,,62151,17146,HEM
64,,SING,ND,C1D,,,,,62151,17146,HEM
65,,DOUB,ND,C4D,,,,,62151,17146,HEM
66,,SING,C1D,C2D,,,,,62151,17146,HEM
67,,DOUB,C2D,C3D,,,,,62151,17146,HEM
68,,SING,C2D,CMD,,,,,62151,17146,HEM
69,,SING,C3D,C4D,,,,,62151,17146,HEM
70,,SING,C3D,CAD,,,,,62151,17146,HEM
71,,SING,CMD,HMD1,,,,,62151,17146,HEM
72,,SING,CMD,HMD2,,,,,62151,17146,HEM
73,,SING,CMD,HMD3,,,,,62151,17146,HEM
74,,SING,CAD,CBD,,,,,62151,17146,HEM
75,,SING,CAD,HAD1,,,,,62151,17146,HEM
76,,SING,CAD,HAD2,,,,,62151,17146,HEM
77,,SING,CBD,CGD,,,,,62151,17146,HEM
78,,SING,CBD,HBD1,,,,,62151,17146,HEM
79,,SING,CBD,HBD2,,,,,62151,17146,HEM
80,,DOUB,CGD,O1D,,,,,62151,17146,HEM
81,,SING,CGD,O2D,,,,,62151,17146,HEM
82,,SING,O2D,H2D,,,,,62151,17146,HEM
1,,DOUB,O12,C11,no,N,1,,62308,17153,QUA
2,,SING,C11,C2,no,N,2,,62308,17153,QUA
3,,SING,C11,O1',no,N,3,,62308,17153,QUA
4,,DOUB,C2,N1,yes,N,4,,62308,17153,QUA
5,,SING,C2,C3,yes,N,5,,62308,17153,QUA
6,,SING,N1,C9,yes,N,6,,62308,17153,QUA
7,,DOUB,C3,C4,yes,N,7,,62308,17153,QUA
8,,SING,C3,HC3,no,N,8,,62308,17153,QUA
9,,SING,C9,C8,no,N,9,,62308,17153,QUA
10,,DOUB,C9,C10,yes,N,10,,62308,17153,QUA
11,,SING,C4,C10,yes,N,11,,62308,17153,QUA
12,,SING,C4,C13,no,N,12,,62308,17153,QUA
13,,SING,C8,O16,no,N,13,,62308,17153,QUA
14,,SING,C8,C7,no,N,14,,62308,17153,QUA
15,,SING,C8,HC8,no,N,15,,62308,17153,QUA
16,,SING,C10,C5,no,N,16,,62308,17153,QUA
17,,SING,O16,H16,no,N,17,,62308,17153,QUA
18,,SING,C7,C6,no,N,18,,62308,17153,QUA
19,,SING,C7,HC71,no,N,19,,62308,17153,QUA
20,,SING,C7,HC72,no,N,20,,62308,17153,QUA
21,,SING,C13,O15,no,N,21,,62308,17153,QUA
22,,SING,C13,C14,no,N,22,,62308,17153,QUA
23,,SING,C13,H13,no,N,23,,62308,17153,QUA
24,,SING,O15,H15,no,N,24,,62308,17153,QUA
25,,DOUB,C5,C6,no,N,25,,62308,17153,QUA
26,,SING,C5,HC5,no,N,26,,62308,17153,QUA
27,,SING,C14,H141,no,N,27,,62308,17153,QUA
28,,SING,C14,H142,no,N,28,,62308,17153,QUA
29,,SING,C14,H143,no,N,29,,62308,17153,QUA
30,,SING,C6,HC6,no,N,30,,62308,17153,QUA
31,,SING,O1',H1',no,N,31,,62308,17153,QUA
1,,SING,N,CA,no,N,1,,62309,17153,DHA
2,,SING,N,H,no,N,2,,62309,17153,DHA
3,,SING,N,H2,no,N,3,,62309,17153,DHA
4,,DOUB,CA,CB,no,N,4,,62309,17153,DHA
5,,SING,CA,C,no,N,5,,62309,17153,DHA
6,,SING,CB,HB1,no,N,6,,62309,17153,DHA
7,,SING,CB,HB2,no,N,7,,62309,17153,DHA
8,,DOUB,C,O,no,N,8,,62309,17153,DHA
9,,SING,C,OXT,no,N,9,,62309,17153,DHA
10,,SING,OXT,HXT,no,N,10,,62309,17153,DHA
1,,SING,N,CA,no,N,1,,62310,17153,BB9
2,,SING,CA,C,no,N,2,,62310,17153,BB9
3,,DOUB,CA,CB,no,N,3,,62310,17153,BB9
4,,DOUB,C,O,no,N,4,,62310,17153,BB9
5,,SING,C,OXT,no,Z,5,,62310,17153,BB9
6,,SING,CB,SG,no,N,6,,62310,17153,BB9
7,,SING,N,HN1,no,N,7,,62310,17153,BB9
8,,SING,N,HN2,no,N,8,,62310,17153,BB9
9,,SING,CB,HB,no,N,9,,62310,17153,BB9
10,,SING,OXT,HXT,no,N,10,,62310,17153,BB9
11,,SING,SG,HG,no,N,11,,62310,17153,BB9
1,,SING,N,CA,no,N,1,,62311,17153,DBU
2,,SING,N,H,no,N,2,,62311,17153,DBU
3,,SING,N,H2,no,N,3,,62311,17153,DBU
4,,DOUB,CA,CB,no,Z,4,,62311,17153,DBU
5,,SING,CA,C,no,N,5,,62311,17153,DBU
6,,SING,CB,CG,no,N,6,,62311,17153,DBU
7,,SING,CB,HB,no,N,7,,62311,17153,DBU
8,,SING,CG,HG1,no,N,8,,62311,17153,DBU
9,,SING,CG,HG2,no,N,9,,62311,17153,DBU
10,,SING,CG,HG3,no,N,10,,62311,17153,DBU
11,,DOUB,C,O,no,N,11,,62311,17153,DBU
12,,SING,C,OXT,no,N,12,,62311,17153,DBU
13,,SING,OXT,HXT,no,N,13,,62311,17153,DBU
1,,SING,N,CA,no,N,1,,62312,17153,DCY
2,,SING,N,H,no,N,2,,62312,17153,DCY
3,,SING,N,H2,no,N,3,,62312,17153,DCY
4,,SING,CA,C,no,N,4,,62312,17153,DCY
5,,SING,CA,CB,no,N,5,,62312,17153,DCY
6,,SING,CA,HA,no,N,6,,62312,17153,DCY
7,,DOUB,C,O,no,N,7,,62312,17153,DCY
8,,SING,C,OXT,no,N,8,,62312,17153,DCY
9,,SING,CB,SG,no,N,9,,62312,17153,DCY
10,,SING,CB,HB2,no,N,10,,62312,17153,DCY
11,,SING,CB,HB3,no,N,11,,62312,17153,DCY
12,,SING,SG,HG,no,N,12,,62312,17153,DCY
13,,SING,OXT,HXT,no,N,13,,62312,17153,DCY
1,,SING,N,CA,no,N,1,,62313,17153,TS9
2,,SING,CA,C,no,N,2,,62313,17153,TS9
3,,SING,CA,CB,no,N,3,,62313,17153,TS9
4,,SING,C,OXT,no,N,4,,62313,17153,TS9
5,,DOUB,C,O,no,N,5,,62313,17153,TS9
6,,SING,CB,OG3,no,N,6,,62313,17153,TS9
7,,SING,CB,CG2,no,N,7,,62313,17153,TS9
8,,SING,CB,CG1,no,N,8,,62313,17153,TS9
9,,SING,CG1,OD2,no,N,9,,62313,17153,TS9
10,,SING,CG1,CD1,no,N,10,,62313,17153,TS9
11,,SING,N,H,no,N,11,,62313,17153,TS9
12,,SING,N,H2,no,N,12,,62313,17153,TS9
13,,SING,CA,HA,no,N,13,,62313,17153,TS9
14,,SING,OXT,HXT,no,N,14,,62313,17153,TS9
15,,SING,OG3,HG3,no,N,15,,62313,17153,TS9
16,,SING,CG2,HG21,no,N,16,,62313,17153,TS9
17,,SING,CG2,HG22,no,N,17,,62313,17153,TS9
18,,SING,CG2,HG23,no,N,18,,62313,17153,TS9
19,,SING,CG1,HG1,no,N,19,,62313,17153,TS9
20,,SING,OD2,HD2,no,N,20,,62313,17153,TS9
21,,SING,CD1,HD11,no,N,21,,62313,17153,TS9
22,,SING,CD1,HD12,no,N,22,,62313,17153,TS9
23,,SING,CD1,HD13,no,N,23,,62313,17153,TS9
1,,DOUB,N,CA,no,N,1,,62314,17153,MH6
2,,SING,CA,C,no,N,2,,62314,17153,MH6
3,,SING,CA,CB,no,N,3,,62314,17153,MH6
4,,DOUB,C,O,no,N,4,,62314,17153,MH6
5,,SING,C,OXT,no,N,5,,62314,17153,MH6
6,,SING,CB,OG,no,N,6,,62314,17153,MH6
7,,SING,N,H,no,N,7,,62314,17153,MH6
8,,SING,CB,HB2,no,N,8,,62314,17153,MH6
9,,SING,CB,HB3,no,N,9,,62314,17153,MH6
10,,SING,OXT,HXT,no,N,10,,62314,17153,MH6
11,,SING,OG,HG,no,N,11,,62314,17153,MH6
1,,SING,N,HN1,no,N,1,,62315,17153,NH2
2,,SING,N,HN2,no,N,2,,62315,17153,NH2
1,,DOUB,O12,C11,no,N,1,,62333,17154,QUA
2,,SING,C11,C2,no,N,2,,62333,17154,QUA
3,,SING,C11,O1',no,N,3,,62333,17154,QUA
4,,DOUB,C2,N1,yes,N,4,,62333,17154,QUA
5,,SING,C2,C3,yes,N,5,,62333,17154,QUA
6,,SING,N1,C9,yes,N,6,,62333,17154,QUA
7,,DOUB,C3,C4,yes,N,7,,62333,17154,QUA
8,,SING,C3,HC3,no,N,8,,62333,17154,QUA
9,,SING,C9,C8,no,N,9,,62333,17154,QUA
10,,DOUB,C9,C10,yes,N,10,,62333,17154,QUA
11,,SING,C4,C10,yes,N,11,,62333,17154,QUA
12,,SING,C4,C13,no,N,12,,62333,17154,QUA
13,,SING,C8,O16,no,N,13,,62333,17154,QUA
14,,SING,C8,C7,no,N,14,,62333,17154,QUA
15,,SING,C8,HC8,no,N,15,,62333,17154,QUA
16,,SING,C10,C5,no,N,16,,62333,17154,QUA
17,,SING,O16,H16,no,N,17,,62333,17154,QUA
18,,SING,C7,C6,no,N,18,,62333,17154,QUA
19,,SING,C7,HC71,no,N,19,,62333,17154,QUA
20,,SING,C7,HC72,no,N,20,,62333,17154,QUA
21,,SING,C13,O15,no,N,21,,62333,17154,QUA
22,,SING,C13,C14,no,N,22,,62333,17154,QUA
23,,SING,C13,H13,no,N,23,,62333,17154,QUA
24,,SING,O15,H15,no,N,24,,62333,17154,QUA
25,,DOUB,C5,C6,no,N,25,,62333,17154,QUA
26,,SING,C5,HC5,no,N,26,,62333,17154,QUA
27,,SING,C14,H141,no,N,27,,62333,17154,QUA
28,,SING,C14,H142,no,N,28,,62333,17154,QUA
29,,SING,C14,H143,no,N,29,,62333,17154,QUA
30,,SING,C6,HC6,no,N,30,,62333,17154,QUA
31,,SING,O1',H1',no,N,31,,62333,17154,QUA
1,,SING,N,CA,no,N,1,,62334,17154,DHA
2,,SING,N,H,no,N,2,,62334,17154,DHA
3,,SING,N,H2,no,N,3,,62334,17154,DHA
4,,DOUB,CA,CB,no,N,4,,62334,17154,DHA
5,,SING,CA,C,no,N,5,,62334,17154,DHA
6,,SING,CB,HB1,no,N,6,,62334,17154,DHA
7,,SING,CB,HB2,no,N,7,,62334,17154,DHA
8,,DOUB,C,O,no,N,8,,62334,17154,DHA
9,,SING,C,OXT,no,N,9,,62334,17154,DHA
10,,SING,OXT,HXT,no,N,10,,62334,17154,DHA
1,,SING,N,CA,no,N,1,,62335,17154,BB9
2,,SING,CA,C,no,N,2,,62335,17154,BB9
3,,DOUB,CA,CB,no,N,3,,62335,17154,BB9
4,,DOUB,C,O,no,N,4,,62335,17154,BB9
5,,SING,C,OXT,no,Z,5,,62335,17154,BB9
6,,SING,CB,SG,no,N,6,,62335,17154,BB9
7,,SING,N,HN1,no,N,7,,62335,17154,BB9
8,,SING,N,HN2,no,N,8,,62335,17154,BB9
9,,SING,CB,HB,no,N,9,,62335,17154,BB9
10,,SING,OXT,HXT,no,N,10,,62335,17154,BB9
11,,SING,SG,HG,no,N,11,,62335,17154,BB9
1,,SING,N,CA,no,N,1,,62336,17154,DBU
2,,SING,N,H,no,N,2,,62336,17154,DBU
3,,SING,N,H2,no,N,3,,62336,17154,DBU
4,,DOUB,CA,CB,no,Z,4,,62336,17154,DBU
5,,SING,CA,C,no,N,5,,62336,17154,DBU
6,,SING,CB,CG,no,N,6,,62336,17154,DBU
7,,SING,CB,HB,no,N,7,,62336,17154,DBU
8,,SING,CG,HG1,no,N,8,,62336,17154,DBU
9,,SING,CG,HG2,no,N,9,,62336,17154,DBU
10,,SING,CG,HG3,no,N,10,,62336,17154,DBU
11,,DOUB,C,O,no,N,11,,62336,17154,DBU
12,,SING,C,OXT,no,N,12,,62336,17154,DBU
13,,SING,OXT,HXT,no,N,13,,62336,17154,DBU
1,,SING,N,CA,no,N,1,,62337,17154,DCY
2,,SING,N,H,no,N,2,,62337,17154,DCY
3,,SING,N,H2,no,N,3,,62337,17154,DCY
4,,SING,CA,C,no,N,4,,62337,17154,DCY
5,,SING,CA,CB,no,N,5,,62337,17154,DCY
6,,SING,CA,HA,no,N,6,,62337,17154,DCY
7,,DOUB,C,O,no,N,7,,62337,17154,DCY
8,,SING,C,OXT,no,N,8,,62337,17154,DCY
9,,SING,CB,SG,no,N,9,,62337,17154,DCY
10,,SING,CB,HB2,no,N,10,,62337,17154,DCY
11,,SING,CB,HB3,no,N,11,,62337,17154,DCY
12,,SING,SG,HG,no,N,12,,62337,17154,DCY
13,,SING,OXT,HXT,no,N,13,,62337,17154,DCY
1,,SING,N,CA,no,N,1,,62338,17154,TS9
2,,SING,CA,C,no,N,2,,62338,17154,TS9
3,,SING,CA,CB,no,N,3,,62338,17154,TS9
4,,SING,C,OXT,no,N,4,,62338,17154,TS9
5,,DOUB,C,O,no,N,5,,62338,17154,TS9
6,,SING,CB,OG3,no,N,6,,62338,17154,TS9
7,,SING,CB,CG2,no,N,7,,62338,17154,TS9
8,,SING,CB,CG1,no,N,8,,62338,17154,TS9
9,,SING,CG1,OD2,no,N,9,,62338,17154,TS9
10,,SING,CG1,CD1,no,N,10,,62338,17154,TS9
11,,SING,N,H,no,N,11,,62338,17154,TS9
12,,SING,N,H2,no,N,12,,62338,17154,TS9
13,,SING,CA,HA,no,N,13,,62338,17154,TS9
14,,SING,OXT,HXT,no,N,14,,62338,17154,TS9
15,,SING,OG3,HG3,no,N,15,,62338,17154,TS9
16,,SING,CG2,HG21,no,N,16,,62338,17154,TS9
17,,SING,CG2,HG22,no,N,17,,62338,17154,TS9
18,,SING,CG2,HG23,no,N,18,,62338,17154,TS9
19,,SING,CG1,HG1,no,N,19,,62338,17154,TS9
20,,SING,OD2,HD2,no,N,20,,62338,17154,TS9
21,,SING,CD1,HD11,no,N,21,,62338,17154,TS9
22,,SING,CD1,HD12,no,N,22,,62338,17154,TS9
23,,SING,CD1,HD13,no,N,23,,62338,17154,TS9
1,,DOUB,N,CA,no,N,1,,62339,17154,MH6
2,,SING,CA,C,no,N,2,,62339,17154,MH6
3,,SING,CA,CB,no,N,3,,62339,17154,MH6
4,,DOUB,C,O,no,N,4,,62339,17154,MH6
5,,SING,C,OXT,no,N,5,,62339,17154,MH6
6,,SING,CB,OG,no,N,6,,62339,17154,MH6
7,,SING,N,H,no,N,7,,62339,17154,MH6
8,,SING,CB,HB2,no,N,8,,62339,17154,MH6
9,,SING,CB,HB3,no,N,9,,62339,17154,MH6
10,,SING,OXT,HXT,no,N,10,,62339,17154,MH6
11,,SING,OG,HG,no,N,11,,62339,17154,MH6
1,,SING,N,HN1,no,N,1,,62340,17154,NH2
2,,SING,N,HN2,no,N,2,,62340,17154,NH2
1,,DOUB,O12,C11,no,N,1,,62358,17155,QUA
2,,SING,C11,C2,no,N,2,,62358,17155,QUA
3,,SING,C11,O1',no,N,3,,62358,17155,QUA
4,,DOUB,C2,N1,yes,N,4,,62358,17155,QUA
5,,SING,C2,C3,yes,N,5,,62358,17155,QUA
6,,SING,N1,C9,yes,N,6,,62358,17155,QUA
7,,DOUB,C3,C4,yes,N,7,,62358,17155,QUA
8,,SING,C3,HC3,no,N,8,,62358,17155,QUA
9,,SING,C9,C8,no,N,9,,62358,17155,QUA
10,,DOUB,C9,C10,yes,N,10,,62358,17155,QUA
11,,SING,C4,C10,yes,N,11,,62358,17155,QUA
12,,SING,C4,C13,no,N,12,,62358,17155,QUA
13,,SING,C8,O16,no,N,13,,62358,17155,QUA
14,,SING,C8,C7,no,N,14,,62358,17155,QUA
15,,SING,C8,HC8,no,N,15,,62358,17155,QUA
16,,SING,C10,C5,no,N,16,,62358,17155,QUA
17,,SING,O16,H16,no,N,17,,62358,17155,QUA
18,,SING,C7,C6,no,N,18,,62358,17155,QUA
19,,SING,C7,HC71,no,N,19,,62358,17155,QUA
20,,SING,C7,HC72,no,N,20,,62358,17155,QUA
21,,SING,C13,O15,no,N,21,,62358,17155,QUA
22,,SING,C13,C14,no,N,22,,62358,17155,QUA
23,,SING,C13,H13,no,N,23,,62358,17155,QUA
24,,SING,O15,H15,no,N,24,,62358,17155,QUA
25,,DOUB,C5,C6,no,N,25,,62358,17155,QUA
26,,SING,C5,HC5,no,N,26,,62358,17155,QUA
27,,SING,C14,H141,no,N,27,,62358,17155,QUA
28,,SING,C14,H142,no,N,28,,62358,17155,QUA
29,,SING,C14,H143,no,N,29,,62358,17155,QUA
30,,SING,C6,HC6,no,N,30,,62358,17155,QUA
31,,SING,O1',H1',no,N,31,,62358,17155,QUA
1,,SING,N,CA,no,N,1,,62359,17155,DHA
2,,SING,N,H,no,N,2,,62359,17155,DHA
3,,SING,N,H2,no,N,3,,62359,17155,DHA
4,,DOUB,CA,CB,no,N,4,,62359,17155,DHA
5,,SING,CA,C,no,N,5,,62359,17155,DHA
6,,SING,CB,HB1,no,N,6,,62359,17155,DHA
7,,SING,CB,HB2,no,N,7,,62359,17155,DHA
8,,DOUB,C,O,no,N,8,,62359,17155,DHA
9,,SING,C,OXT,no,N,9,,62359,17155,DHA
10,,SING,OXT,HXT,no,N,10,,62359,17155,DHA
1,,SING,N,CA,no,N,1,,62360,17155,BB9
2,,SING,CA,C,no,N,2,,62360,17155,BB9
3,,DOUB,CA,CB,no,N,3,,62360,17155,BB9
4,,DOUB,C,O,no,N,4,,62360,17155,BB9
5,,SING,C,OXT,no,Z,5,,62360,17155,BB9
6,,SING,CB,SG,no,N,6,,62360,17155,BB9
7,,SING,N,HN1,no,N,7,,62360,17155,BB9
8,,SING,N,HN2,no,N,8,,62360,17155,BB9
9,,SING,CB,HB,no,N,9,,62360,17155,BB9
10,,SING,OXT,HXT,no,N,10,,62360,17155,BB9
11,,SING,SG,HG,no,N,11,,62360,17155,BB9
1,,SING,N,CA,no,N,1,,62361,17155,DBU
2,,SING,N,H,no,N,2,,62361,17155,DBU
3,,SING,N,H2,no,N,3,,62361,17155,DBU
4,,DOUB,CA,CB,no,Z,4,,62361,17155,DBU
5,,SING,CA,C,no,N,5,,62361,17155,DBU
6,,SING,CB,CG,no,N,6,,62361,17155,DBU
7,,SING,CB,HB,no,N,7,,62361,17155,DBU
8,,SING,CG,HG1,no,N,8,,62361,17155,DBU
9,,SING,CG,HG2,no,N,9,,62361,17155,DBU
10,,SING,CG,HG3,no,N,10,,62361,17155,DBU
11,,DOUB,C,O,no,N,11,,62361,17155,DBU
12,,SING,C,OXT,no,N,12,,62361,17155,DBU
13,,SING,OXT,HXT,no,N,13,,62361,17155,DBU
1,,SING,N,CA,no,N,1,,62362,17155,DCY
2,,SING,N,H,no,N,2,,62362,17155,DCY
3,,SING,N,H2,no,N,3,,62362,17155,DCY
4,,SING,CA,C,no,N,4,,62362,17155,DCY
5,,SING,CA,CB,no,N,5,,62362,17155,DCY
6,,SING,CA,HA,no,N,6,,62362,17155,DCY
7,,DOUB,C,O,no,N,7,,62362,17155,DCY
8,,SING,C,OXT,no,N,8,,62362,17155,DCY
9,,SING,CB,SG,no,N,9,,62362,17155,DCY
10,,SING,CB,HB2,no,N,10,,62362,17155,DCY
11,,SING,CB,HB3,no,N,11,,62362,17155,DCY
12,,SING,SG,HG,no,N,12,,62362,17155,DCY
13,,SING,OXT,HXT,no,N,13,,62362,17155,DCY
1,,SING,N,CA,no,N,1,,62363,17155,TS9
2,,SING,CA,C,no,N,2,,62363,17155,TS9
3,,SING,CA,CB,no,N,3,,62363,17155,TS9
4,,SING,C,OXT,no,N,4,,62363,17155,TS9
5,,DOUB,C,O,no,N,5,,62363,17155,TS9
6,,SING,CB,OG3,no,N,6,,62363,17155,TS9
7,,SING,CB,CG2,no,N,7,,62363,17155,TS9
8,,SING,CB,CG1,no,N,8,,62363,17155,TS9
9,,SING,CG1,OD2,no,N,9,,62363,17155,TS9
10,,SING,CG1,CD1,no,N,10,,62363,17155,TS9
11,,SING,N,H,no,N,11,,62363,17155,TS9
12,,SING,N,H2,no,N,12,,62363,17155,TS9
13,,SING,CA,HA,no,N,13,,62363,17155,TS9
14,,SING,OXT,HXT,no,N,14,,62363,17155,TS9
15,,SING,OG3,HG3,no,N,15,,62363,17155,TS9
16,,SING,CG2,HG21,no,N,16,,62363,17155,TS9
17,,SING,CG2,HG22,no,N,17,,62363,17155,TS9
18,,SING,CG2,HG23,no,N,18,,62363,17155,TS9
19,,SING,CG1,HG1,no,N,19,,62363,17155,TS9
20,,SING,OD2,HD2,no,N,20,,62363,17155,TS9
21,,SING,CD1,HD11,no,N,21,,62363,17155,TS9
22,,SING,CD1,HD12,no,N,22,,62363,17155,TS9
23,,SING,CD1,HD13,no,N,23,,62363,17155,TS9
1,,DOUB,N,CA,no,N,1,,62364,17155,MH6
2,,SING,CA,C,no,N,2,,62364,17155,MH6
3,,SING,CA,CB,no,N,3,,62364,17155,MH6
4,,DOUB,C,O,no,N,4,,62364,17155,MH6
5,,SING,C,OXT,no,N,5,,62364,17155,MH6
6,,SING,CB,OG,no,N,6,,62364,17155,MH6
7,,SING,N,H,no,N,7,,62364,17155,MH6
8,,SING,CB,HB2,no,N,8,,62364,17155,MH6
9,,SING,CB,HB3,no,N,9,,62364,17155,MH6
10,,SING,OXT,HXT,no,N,10,,62364,17155,MH6
11,,SING,OG,HG,no,N,11,,62364,17155,MH6
1,,SING,N,HN1,no,N,1,,62365,17155,NH2
2,,SING,N,HN2,no,N,2,,62365,17155,NH2
1,,DOUB,O12,C11,no,N,1,,62383,17156,QUA
2,,SING,C11,C2,no,N,2,,62383,17156,QUA
3,,SING,C11,O1',no,N,3,,62383,17156,QUA
4,,DOUB,C2,N1,yes,N,4,,62383,17156,QUA
5,,SING,C2,C3,yes,N,5,,62383,17156,QUA
6,,SING,N1,C9,yes,N,6,,62383,17156,QUA
7,,DOUB,C3,C4,yes,N,7,,62383,17156,QUA
8,,SING,C3,HC3,no,N,8,,62383,17156,QUA
9,,SING,C9,C8,no,N,9,,62383,17156,QUA
10,,DOUB,C9,C10,yes,N,10,,62383,17156,QUA
11,,SING,C4,C10,yes,N,11,,62383,17156,QUA
12,,SING,C4,C13,no,N,12,,62383,17156,QUA
13,,SING,C8,O16,no,N,13,,62383,17156,QUA
14,,SING,C8,C7,no,N,14,,62383,17156,QUA
15,,SING,C8,HC8,no,N,15,,62383,17156,QUA
16,,SING,C10,C5,no,N,16,,62383,17156,QUA
17,,SING,O16,H16,no,N,17,,62383,17156,QUA
18,,SING,C7,C6,no,N,18,,62383,17156,QUA
19,,SING,C7,HC71,no,N,19,,62383,17156,QUA
20,,SING,C7,HC72,no,N,20,,62383,17156,QUA
21,,SING,C13,O15,no,N,21,,62383,17156,QUA
22,,SING,C13,C14,no,N,22,,62383,17156,QUA
23,,SING,C13,H13,no,N,23,,62383,17156,QUA
24,,SING,O15,H15,no,N,24,,62383,17156,QUA
25,,DOUB,C5,C6,no,N,25,,62383,17156,QUA
26,,SING,C5,HC5,no,N,26,,62383,17156,QUA
27,,SING,C14,H141,no,N,27,,62383,17156,QUA
28,,SING,C14,H142,no,N,28,,62383,17156,QUA
29,,SING,C14,H143,no,N,29,,62383,17156,QUA
30,,SING,C6,HC6,no,N,30,,62383,17156,QUA
31,,SING,O1',H1',no,N,31,,62383,17156,QUA
1,,SING,N,CA,no,N,1,,62384,17156,DHA
2,,SING,N,H,no,N,2,,62384,17156,DHA
3,,SING,N,H2,no,N,3,,62384,17156,DHA
4,,DOUB,CA,CB,no,N,4,,62384,17156,DHA
5,,SING,CA,C,no,N,5,,62384,17156,DHA
6,,SING,CB,HB1,no,N,6,,62384,17156,DHA
7,,SING,CB,HB2,no,N,7,,62384,17156,DHA
8,,DOUB,C,O,no,N,8,,62384,17156,DHA
9,,SING,C,OXT,no,N,9,,62384,17156,DHA
10,,SING,OXT,HXT,no,N,10,,62384,17156,DHA
1,,SING,N,CA,no,N,1,,62385,17156,BB9
2,,SING,CA,C,no,N,2,,62385,17156,BB9
3,,DOUB,CA,CB,no,N,3,,62385,17156,BB9
4,,DOUB,C,O,no,N,4,,62385,17156,BB9
5,,SING,C,OXT,no,Z,5,,62385,17156,BB9
6,,SING,CB,SG,no,N,6,,62385,17156,BB9
7,,SING,N,HN1,no,N,7,,62385,17156,BB9
8,,SING,N,HN2,no,N,8,,62385,17156,BB9
9,,SING,CB,HB,no,N,9,,62385,17156,BB9
10,,SING,OXT,HXT,no,N,10,,62385,17156,BB9
11,,SING,SG,HG,no,N,11,,62385,17156,BB9
1,,SING,N,CA,no,N,1,,62386,17156,DBU
2,,SING,N,H,no,N,2,,62386,17156,DBU
3,,SING,N,H2,no,N,3,,62386,17156,DBU
4,,DOUB,CA,CB,no,Z,4,,62386,17156,DBU
5,,SING,CA,C,no,N,5,,62386,17156,DBU
6,,SING,CB,CG,no,N,6,,62386,17156,DBU
7,,SING,CB,HB,no,N,7,,62386,17156,DBU
8,,SING,CG,HG1,no,N,8,,62386,17156,DBU
9,,SING,CG,HG2,no,N,9,,62386,17156,DBU
10,,SING,CG,HG3,no,N,10,,62386,17156,DBU
11,,DOUB,C,O,no,N,11,,62386,17156,DBU
12,,SING,C,OXT,no,N,12,,62386,17156,DBU
13,,SING,OXT,HXT,no,N,13,,62386,17156,DBU
1,,SING,N,CA,no,N,1,,62387,17156,DCY
2,,SING,N,H,no,N,2,,62387,17156,DCY
3,,SING,N,H2,no,N,3,,62387,17156,DCY
4,,SING,CA,C,no,N,4,,62387,17156,DCY
5,,SING,CA,CB,no,N,5,,62387,17156,DCY
6,,SING,CA,HA,no,N,6,,62387,17156,DCY
7,,DOUB,C,O,no,N,7,,62387,17156,DCY
8,,SING,C,OXT,no,N,8,,62387,17156,DCY
9,,SING,CB,SG,no,N,9,,62387,17156,DCY
10,,SING,CB,HB2,no,N,10,,62387,17156,DCY
11,,SING,CB,HB3,no,N,11,,62387,17156,DCY
12,,SING,SG,HG,no,N,12,,62387,17156,DCY
13,,SING,OXT,HXT,no,N,13,,62387,17156,DCY
1,,SING,N,CA,no,N,1,,62388,17156,TS9
2,,SING,CA,C,no,N,2,,62388,17156,TS9
3,,SING,CA,CB,no,N,3,,62388,17156,TS9
4,,SING,C,OXT,no,N,4,,62388,17156,TS9
5,,DOUB,C,O,no,N,5,,62388,17156,TS9
6,,SING,CB,OG3,no,N,6,,62388,17156,TS9
7,,SING,CB,CG2,no,N,7,,62388,17156,TS9
8,,SING,CB,CG1,no,N,8,,62388,17156,TS9
9,,SING,CG1,OD2,no,N,9,,62388,17156,TS9
10,,SING,CG1,CD1,no,N,10,,62388,17156,TS9
11,,SING,N,H,no,N,11,,62388,17156,TS9
12,,SING,N,H2,no,N,12,,62388,17156,TS9
13,,SING,CA,HA,no,N,13,,62388,17156,TS9
17,,SING,C8,C9,,,,,64118,17243,EGC
14,,SING,OXT,HXT,no,N,14,,62388,17156,TS9
15,,SING,OG3,HG3,no,N,15,,62388,17156,TS9
16,,SING,CG2,HG21,no,N,16,,62388,17156,TS9
17,,SING,CG2,HG22,no,N,17,,62388,17156,TS9
18,,SING,CG2,HG23,no,N,18,,62388,17156,TS9
19,,SING,CG1,HG1,no,N,19,,62388,17156,TS9
20,,SING,OD2,HD2,no,N,20,,62388,17156,TS9
21,,SING,CD1,HD11,no,N,21,,62388,17156,TS9
22,,SING,CD1,HD12,no,N,22,,62388,17156,TS9
23,,SING,CD1,HD13,no,N,23,,62388,17156,TS9
1,,DOUB,N,CA,no,N,1,,62389,17156,MH6
2,,SING,CA,C,no,N,2,,62389,17156,MH6
3,,SING,CA,CB,no,N,3,,62389,17156,MH6
4,,DOUB,C,O,no,N,4,,62389,17156,MH6
5,,SING,C,OXT,no,N,5,,62389,17156,MH6
6,,SING,CB,OG,no,N,6,,62389,17156,MH6
7,,SING,N,H,no,N,7,,62389,17156,MH6
8,,SING,CB,HB2,no,N,8,,62389,17156,MH6
9,,SING,CB,HB3,no,N,9,,62389,17156,MH6
10,,SING,OXT,HXT,no,N,10,,62389,17156,MH6
11,,SING,OG,HG,no,N,11,,62389,17156,MH6
1,,SING,N,HN1,no,N,1,,62390,17156,NH2
2,,SING,N,HN2,no,N,2,,62390,17156,NH2
1,,SING,N,CA1,no,N,1,,62506,17162,GYC
2,,SING,N,HN1,no,N,2,,62506,17162,GYC
3,,SING,N,HN2,no,N,3,,62506,17162,GYC
4,,SING,SG1,CB1,no,N,4,,62506,17162,GYC
5,,SING,SG1,HG1,no,N,5,,62506,17162,GYC
6,,SING,CB1,CA1,no,N,6,,62506,17162,GYC
7,,SING,CB1,HB11,no,N,7,,62506,17162,GYC
8,,SING,CB1,HB12,no,N,8,,62506,17162,GYC
9,,SING,CA1,C1,no,N,9,,62506,17162,GYC
10,,SING,CA1,HA1,no,N,10,,62506,17162,GYC
11,,DOUB,C1,N2,no,N,11,,62506,17162,GYC
12,,SING,C1,N3,no,N,12,,62506,17162,GYC
13,,SING,N2,CA2,no,N,13,,62506,17162,GYC
14,,SING,N3,C2,no,N,14,,62506,17162,GYC
15,,SING,N3,CA3,no,N,15,,62506,17162,GYC
16,,DOUB,C2,O2,no,N,16,,62506,17162,GYC
17,,SING,C2,CA2,no,N,17,,62506,17162,GYC
18,,DOUB,CA2,CB2,no,Z,18,,62506,17162,GYC
19,,SING,CA3,C,no,N,19,,62506,17162,GYC
20,,SING,CA3,HA31,no,N,20,,62506,17162,GYC
21,,SING,CA3,HA32,no,N,21,,62506,17162,GYC
22,,SING,CB2,CG2,no,N,22,,62506,17162,GYC
23,,SING,CB2,HB2,no,N,23,,62506,17162,GYC
24,,DOUB,CG2,CD1,yes,N,24,,62506,17162,GYC
25,,SING,CG2,CD2,yes,N,25,,62506,17162,GYC
26,,SING,CD1,CE1,yes,N,26,,62506,17162,GYC
27,,SING,CD1,HD1,no,N,27,,62506,17162,GYC
28,,DOUB,CD2,CE2,yes,N,28,,62506,17162,GYC
29,,SING,CD2,HD2,no,N,29,,62506,17162,GYC
30,,DOUB,CE1,CZ,yes,N,30,,62506,17162,GYC
31,,SING,CE1,HE1,no,N,31,,62506,17162,GYC
32,,SING,CE2,CZ,yes,N,32,,62506,17162,GYC
33,,SING,CE2,HE2,no,N,33,,62506,17162,GYC
34,,SING,CZ,OH,no,N,34,,62506,17162,GYC
35,,SING,OH,HOH,no,N,35,,62506,17162,GYC
36,,DOUB,C,O,no,N,36,,62506,17162,GYC
37,,SING,C,OXT,no,N,37,,62506,17162,GYC
38,,SING,OXT,HXT,no,N,38,,62506,17162,GYC
1,,SING,N,CA1,no,N,1,,62522,17163,GYC
2,,SING,N,HN1,no,N,2,,62522,17163,GYC
3,,SING,N,HN2,no,N,3,,62522,17163,GYC
4,,SING,SG1,CB1,no,N,4,,62522,17163,GYC
5,,SING,SG1,HG1,no,N,5,,62522,17163,GYC
6,,SING,CB1,CA1,no,N,6,,62522,17163,GYC
7,,SING,CB1,HB11,no,N,7,,62522,17163,GYC
8,,SING,CB1,HB12,no,N,8,,62522,17163,GYC
9,,SING,CA1,C1,no,N,9,,62522,17163,GYC
10,,SING,CA1,HA1,no,N,10,,62522,17163,GYC
11,,DOUB,C1,N2,no,N,11,,62522,17163,GYC
12,,SING,C1,N3,no,N,12,,62522,17163,GYC
13,,SING,N2,CA2,no,N,13,,62522,17163,GYC
14,,SING,N3,C2,no,N,14,,62522,17163,GYC
15,,SING,N3,CA3,no,N,15,,62522,17163,GYC
16,,DOUB,C2,O2,no,N,16,,62522,17163,GYC
17,,SING,C2,CA2,no,N,17,,62522,17163,GYC
18,,DOUB,CA2,CB2,no,Z,18,,62522,17163,GYC
19,,SING,CA3,C,no,N,19,,62522,17163,GYC
20,,SING,CA3,HA31,no,N,20,,62522,17163,GYC
21,,SING,CA3,HA32,no,N,21,,62522,17163,GYC
22,,SING,CB2,CG2,no,N,22,,62522,17163,GYC
23,,SING,CB2,HB2,no,N,23,,62522,17163,GYC
24,,DOUB,CG2,CD1,yes,N,24,,62522,17163,GYC
25,,SING,CG2,CD2,yes,N,25,,62522,17163,GYC
26,,SING,CD1,CE1,yes,N,26,,62522,17163,GYC
27,,SING,CD1,HD1,no,N,27,,62522,17163,GYC
28,,DOUB,CD2,CE2,yes,N,28,,62522,17163,GYC
29,,SING,CD2,HD2,no,N,29,,62522,17163,GYC
30,,DOUB,CE1,CZ,yes,N,30,,62522,17163,GYC
31,,SING,CE1,HE1,no,N,31,,62522,17163,GYC
32,,SING,CE2,CZ,yes,N,32,,62522,17163,GYC
33,,SING,CE2,HE2,no,N,33,,62522,17163,GYC
34,,SING,CZ,OH,no,N,34,,62522,17163,GYC
35,,SING,OH,HOH,no,N,35,,62522,17163,GYC
36,,DOUB,C,O,no,N,36,,62522,17163,GYC
37,,SING,C,OXT,no,N,37,,62522,17163,GYC
38,,SING,OXT,HXT,no,N,38,,62522,17163,GYC
1,,SING,C1,N1,no,N,1,,62870,17180,TEP
2,,SING,C1,H11,no,N,2,,62870,17180,TEP
3,,SING,C1,H12,no,N,3,,62870,17180,TEP
4,,SING,C1,H13,no,N,4,,62870,17180,TEP
5,,SING,N1,C2,yes,N,5,,62870,17180,TEP
6,,SING,N1,C6,yes,N,6,,62870,17180,TEP
7,,DOUB,C2,O2,no,N,7,,62870,17180,TEP
8,,SING,C2,N3,yes,N,8,,62870,17180,TEP
9,,SING,N3,C3,no,N,9,,62870,17180,TEP
10,,SING,N3,C4,yes,N,10,,62870,17180,TEP
11,,SING,C3,H31,no,N,11,,62870,17180,TEP
12,,SING,C3,H32,no,N,12,,62870,17180,TEP
13,,SING,C3,H33,no,N,13,,62870,17180,TEP
14,,DOUB,C4,C5,yes,N,14,,62870,17180,TEP
15,,SING,C4,N9,yes,N,15,,62870,17180,TEP
16,,SING,C5,C6,yes,N,16,,62870,17180,TEP
17,,SING,C5,N7,yes,N,17,,62870,17180,TEP
18,,DOUB,C6,O6,no,N,18,,62870,17180,TEP
19,,SING,N7,C8,yes,N,19,,62870,17180,TEP
20,,SING,N7,HN7,no,N,20,,62870,17180,TEP
21,,DOUB,C8,N9,yes,N,21,,62870,17180,TEP
22,,SING,C8,H8,no,N,22,,62870,17180,TEP
1,,SING,C1,C2,no,N,1,,62906,17182,ARA
2,,SING,C1,O1,no,N,2,,62906,17182,ARA
3,,SING,C1,O5,no,N,3,,62906,17182,ARA
4,,SING,C1,H1,no,N,4,,62906,17182,ARA
5,,SING,C2,C3,no,N,5,,62906,17182,ARA
6,,SING,C2,O2,no,N,6,,62906,17182,ARA
7,,SING,C2,H2,no,N,7,,62906,17182,ARA
8,,SING,C3,C4,no,N,8,,62906,17182,ARA
9,,SING,C3,O3,no,N,9,,62906,17182,ARA
10,,SING,C3,H3,no,N,10,,62906,17182,ARA
11,,SING,C4,C5,no,N,11,,62906,17182,ARA
12,,SING,C4,O4,no,N,12,,62906,17182,ARA
13,,SING,C4,H4,no,N,13,,62906,17182,ARA
14,,SING,C5,O5,no,N,14,,62906,17182,ARA
15,,SING,C5,H51,no,N,15,,62906,17182,ARA
16,,SING,C5,H52,no,N,16,,62906,17182,ARA
17,,SING,O1,HO1,no,N,17,,62906,17182,ARA
18,,SING,O2,HO2,no,N,18,,62906,17182,ARA
19,,SING,O3,HO3,no,N,19,,62906,17182,ARA
20,,SING,O4,HO4,no,N,20,,62906,17182,ARA
1,,DOUB,PG,O1G,no,N,1,,62923,17183,GNP
2,,SING,PG,O2G,no,N,2,,62923,17183,GNP
3,,SING,PG,O3G,no,N,3,,62923,17183,GNP
4,,SING,PG,N3B,no,N,4,,62923,17183,GNP
5,,SING,O2G,HOG2,no,N,5,,62923,17183,GNP
6,,SING,O3G,HOG3,no,N,6,,62923,17183,GNP
7,,SING,N3B,PB,no,N,7,,62923,17183,GNP
8,,SING,N3B,HNB3,no,N,8,,62923,17183,GNP
9,,DOUB,PB,O1B,no,N,9,,62923,17183,GNP
10,,SING,PB,O2B,no,N,10,,62923,17183,GNP
11,,SING,PB,O3A,no,N,11,,62923,17183,GNP
12,,SING,O2B,HOB2,no,N,12,,62923,17183,GNP
13,,SING,O3A,PA,no,N,13,,62923,17183,GNP
14,,DOUB,PA,O1A,no,N,14,,62923,17183,GNP
15,,SING,PA,O2A,no,N,15,,62923,17183,GNP
16,,SING,PA,O5',no,N,16,,62923,17183,GNP
17,,SING,O2A,HOA2,no,N,17,,62923,17183,GNP
18,,SING,O5',C5',no,N,18,,62923,17183,GNP
19,,SING,C5',C4',no,N,19,,62923,17183,GNP
20,,SING,C5',H5'2,no,N,20,,62923,17183,GNP
21,,SING,C5',H5'1,no,N,21,,62923,17183,GNP
22,,SING,C4',O4',no,N,22,,62923,17183,GNP
23,,SING,C4',C3',no,N,23,,62923,17183,GNP
24,,SING,C4',H4',no,N,24,,62923,17183,GNP
25,,SING,O4',C1',no,N,25,,62923,17183,GNP
26,,SING,C3',O3',no,N,26,,62923,17183,GNP
27,,SING,C3',C2',no,N,27,,62923,17183,GNP
28,,SING,C3',H3',no,N,28,,62923,17183,GNP
29,,SING,O3',HO3',no,N,29,,62923,17183,GNP
30,,SING,C2',O2',no,N,30,,62923,17183,GNP
31,,SING,C2',C1',no,N,31,,62923,17183,GNP
32,,SING,C2',H2',no,N,32,,62923,17183,GNP
33,,SING,O2',HO2',no,N,33,,62923,17183,GNP
34,,SING,C1',N9,no,N,34,,62923,17183,GNP
35,,SING,C1',H1',no,N,35,,62923,17183,GNP
36,,SING,N9,C8,yes,N,36,,62923,17183,GNP
37,,SING,N9,C4,yes,N,37,,62923,17183,GNP
38,,DOUB,C8,N7,yes,N,38,,62923,17183,GNP
39,,SING,C8,H8,no,N,39,,62923,17183,GNP
40,,SING,N7,C5,yes,N,40,,62923,17183,GNP
41,,SING,C5,C6,yes,N,41,,62923,17183,GNP
42,,DOUB,C5,C4,yes,N,42,,62923,17183,GNP
43,,DOUB,C6,O6,no,N,43,,62923,17183,GNP
44,,SING,C6,N1,yes,N,44,,62923,17183,GNP
45,,SING,N1,C2,yes,N,45,,62923,17183,GNP
46,,SING,N1,HN1,no,N,46,,62923,17183,GNP
47,,SING,C2,N2,no,N,47,,62923,17183,GNP
48,,DOUB,C2,N3,yes,N,48,,62923,17183,GNP
49,,SING,N2,HN21,no,N,49,,62923,17183,GNP
50,,SING,N2,HN22,no,N,50,,62923,17183,GNP
51,,SING,N3,C4,yes,N,51,,62923,17183,GNP
1,,SING,C1,C2,no,N,1,,62938,17184,LAT
2,,SING,C1,O1,no,N,2,,62938,17184,LAT
3,,SING,C1,O5,no,N,3,,62938,17184,LAT
4,,SING,C1,H1,no,N,4,,62938,17184,LAT
5,,SING,C2,C3,no,N,5,,62938,17184,LAT
6,,SING,C2,O2,no,N,6,,62938,17184,LAT
7,,SING,C2,H2,no,N,7,,62938,17184,LAT
8,,SING,C3,C4,no,N,8,,62938,17184,LAT
9,,SING,C3,O3,no,N,9,,62938,17184,LAT
10,,SING,C3,H3,no,N,10,,62938,17184,LAT
11,,SING,C4,C5,no,N,11,,62938,17184,LAT
12,,SING,C4,O4,no,N,12,,62938,17184,LAT
13,,SING,C4,H4,no,N,13,,62938,17184,LAT
14,,SING,C5,C6,no,N,14,,62938,17184,LAT
15,,SING,C5,O5,no,N,15,,62938,17184,LAT
16,,SING,C5,H5,no,N,16,,62938,17184,LAT
17,,SING,C6,O6,no,N,17,,62938,17184,LAT
18,,SING,C6,H61,no,N,18,,62938,17184,LAT
19,,SING,C6,H62,no,N,19,,62938,17184,LAT
20,,SING,O1,C4',no,N,20,,62938,17184,LAT
21,,SING,O2,HO2,no,N,21,,62938,17184,LAT
22,,SING,O3,HO3,no,N,22,,62938,17184,LAT
23,,SING,O4,HO4,no,N,23,,62938,17184,LAT
24,,SING,O6,HO6,no,N,24,,62938,17184,LAT
25,,SING,C1',C2',no,N,25,,62938,17184,LAT
26,,SING,C1',O1',no,N,26,,62938,17184,LAT
27,,SING,C1',O5',no,N,27,,62938,17184,LAT
28,,SING,C1',H1',no,N,28,,62938,17184,LAT
29,,SING,C2',C3',no,N,29,,62938,17184,LAT
30,,SING,C2',O2',no,N,30,,62938,17184,LAT
31,,SING,C2',H2',no,N,31,,62938,17184,LAT
32,,SING,C3',C4',no,N,32,,62938,17184,LAT
33,,SING,C3',O3',no,N,33,,62938,17184,LAT
34,,SING,C3',H3',no,N,34,,62938,17184,LAT
35,,SING,C4',C5',no,N,35,,62938,17184,LAT
36,,SING,C4',H4',no,N,36,,62938,17184,LAT
37,,SING,C5',C6',no,N,37,,62938,17184,LAT
38,,SING,C5',O5',no,N,38,,62938,17184,LAT
39,,SING,C5',H5',no,N,39,,62938,17184,LAT
40,,SING,C6',O6',no,N,40,,62938,17184,LAT
41,,SING,C6',H6'1,no,N,41,,62938,17184,LAT
42,,SING,C6',H6'2,no,N,42,,62938,17184,LAT
43,,SING,O1',HO1',no,N,43,,62938,17184,LAT
44,,SING,O2',HO2',no,N,44,,62938,17184,LAT
45,,SING,O3',HO3',no,N,45,,62938,17184,LAT
46,,SING,O6',HO6',no,N,46,,62938,17184,LAT
1,,SING,N,CA,no,N,1,,62956,17185,DPN
2,,SING,N,H,no,N,2,,62956,17185,DPN
3,,SING,N,H2,no,N,3,,62956,17185,DPN
4,,SING,CA,C,no,N,4,,62956,17185,DPN
5,,SING,CA,CB,no,N,5,,62956,17185,DPN
6,,SING,CA,HA,no,N,6,,62956,17185,DPN
7,,DOUB,C,O,no,N,7,,62956,17185,DPN
8,,SING,C,OXT,no,N,8,,62956,17185,DPN
9,,SING,OXT,HXT,no,N,9,,62956,17185,DPN
10,,SING,CB,CG,no,N,10,,62956,17185,DPN
11,,SING,CB,HB2,no,N,11,,62956,17185,DPN
12,,SING,CB,HB3,no,N,12,,62956,17185,DPN
13,,DOUB,CG,CD1,yes,N,13,,62956,17185,DPN
14,,SING,CG,CD2,yes,N,14,,62956,17185,DPN
15,,SING,CD1,CE1,yes,N,15,,62956,17185,DPN
16,,SING,CD1,HD1,no,N,16,,62956,17185,DPN
17,,DOUB,CD2,CE2,yes,N,17,,62956,17185,DPN
18,,SING,CD2,HD2,no,N,18,,62956,17185,DPN
19,,DOUB,CE1,CZ,yes,N,19,,62956,17185,DPN
20,,SING,CE1,HE1,no,N,20,,62956,17185,DPN
21,,SING,CE2,CZ,yes,N,21,,62956,17185,DPN
22,,SING,CE2,HE2,no,N,22,,62956,17185,DPN
23,,SING,CZ,HZ,no,N,23,,62956,17185,DPN
1,,SING,FE,NA,no,N,1,,63049,1719,HEC
2,,SING,FE,NB,no,N,2,,63049,1719,HEC
3,,SING,FE,NC,no,N,3,,63049,1719,HEC
4,,SING,FE,ND,no,N,4,,63049,1719,HEC
5,,DOUB,CHA,C1A,no,N,5,,63049,1719,HEC
6,,SING,CHA,C4D,no,N,6,,63049,1719,HEC
7,,SING,CHA,HHA,no,N,7,,63049,1719,HEC
8,,DOUB,CHB,C4A,no,N,8,,63049,1719,HEC
9,,SING,CHB,C1B,no,N,9,,63049,1719,HEC
10,,SING,CHB,HHB,no,N,10,,63049,1719,HEC
11,,DOUB,CHC,C4B,no,N,11,,63049,1719,HEC
12,,SING,CHC,C1C,no,N,12,,63049,1719,HEC
13,,SING,CHC,HHC,no,N,13,,63049,1719,HEC
14,,DOUB,CHD,C4C,no,N,14,,63049,1719,HEC
15,,SING,CHD,C1D,no,N,15,,63049,1719,HEC
16,,SING,CHD,HHD,no,N,16,,63049,1719,HEC
17,,SING,NA,C1A,yes,N,17,,63049,1719,HEC
18,,SING,NA,C4A,yes,N,18,,63049,1719,HEC
19,,SING,C1A,C2A,yes,N,19,,63049,1719,HEC
20,,DOUB,C2A,C3A,yes,N,20,,63049,1719,HEC
21,,SING,C2A,CAA,no,N,21,,63049,1719,HEC
22,,SING,C3A,C4A,yes,N,22,,63049,1719,HEC
23,,SING,C3A,CMA,no,N,23,,63049,1719,HEC
24,,SING,CMA,HMA1,no,N,24,,63049,1719,HEC
25,,SING,CMA,HMA2,no,N,25,,63049,1719,HEC
26,,SING,CMA,HMA3,no,N,26,,63049,1719,HEC
27,,SING,CAA,CBA,no,N,27,,63049,1719,HEC
28,,SING,CAA,HAA1,no,N,28,,63049,1719,HEC
29,,SING,CAA,HAA2,no,N,29,,63049,1719,HEC
30,,SING,CBA,CGA,no,N,30,,63049,1719,HEC
31,,SING,CBA,HBA1,no,N,31,,63049,1719,HEC
32,,SING,CBA,HBA2,no,N,32,,63049,1719,HEC
33,,DOUB,CGA,O1A,no,N,33,,63049,1719,HEC
34,,SING,CGA,O2A,no,N,34,,63049,1719,HEC
35,,SING,O2A,H2A,no,N,35,,63049,1719,HEC
36,,SING,NB,C1B,yes,N,36,,63049,1719,HEC
37,,SING,NB,C4B,yes,N,37,,63049,1719,HEC
38,,DOUB,C1B,C2B,yes,N,38,,63049,1719,HEC
39,,SING,C2B,C3B,yes,N,39,,63049,1719,HEC
40,,SING,C2B,CMB,no,N,40,,63049,1719,HEC
41,,SING,C3B,C4B,yes,N,41,,63049,1719,HEC
42,,DOUB,C3B,CAB,no,E,42,,63049,1719,HEC
43,,SING,CMB,HMB1,no,N,43,,63049,1719,HEC
44,,SING,CMB,HMB2,no,N,44,,63049,1719,HEC
45,,SING,CMB,HMB3,no,N,45,,63049,1719,HEC
46,,SING,CAB,CBB,no,N,46,,63049,1719,HEC
47,,SING,CAB,HAB,no,N,47,,63049,1719,HEC
48,,SING,CBB,HBB1,no,N,48,,63049,1719,HEC
49,,SING,CBB,HBB2,no,N,49,,63049,1719,HEC
50,,SING,CBB,HBB3,no,N,50,,63049,1719,HEC
51,,SING,NC,C1C,yes,N,51,,63049,1719,HEC
52,,SING,NC,C4C,yes,N,52,,63049,1719,HEC
53,,DOUB,C1C,C2C,yes,N,53,,63049,1719,HEC
54,,SING,C2C,C3C,yes,N,54,,63049,1719,HEC
55,,SING,C2C,CMC,no,N,55,,63049,1719,HEC
56,,SING,C3C,C4C,yes,N,56,,63049,1719,HEC
57,,DOUB,C3C,CAC,no,E,57,,63049,1719,HEC
58,,SING,CMC,HMC1,no,N,58,,63049,1719,HEC
59,,SING,CMC,HMC2,no,N,59,,63049,1719,HEC
60,,SING,CMC,HMC3,no,N,60,,63049,1719,HEC
61,,SING,CAC,CBC,no,N,61,,63049,1719,HEC
62,,SING,CAC,HAC,no,N,62,,63049,1719,HEC
63,,SING,CBC,HBC1,no,N,63,,63049,1719,HEC
64,,SING,CBC,HBC2,no,N,64,,63049,1719,HEC
65,,SING,CBC,HBC3,no,N,65,,63049,1719,HEC
66,,SING,ND,C1D,yes,N,66,,63049,1719,HEC
67,,SING,ND,C4D,yes,N,67,,63049,1719,HEC
68,,DOUB,C1D,C2D,yes,N,68,,63049,1719,HEC
69,,SING,C2D,C3D,yes,N,69,,63049,1719,HEC
70,,SING,C2D,CMD,no,N,70,,63049,1719,HEC
71,,DOUB,C3D,C4D,yes,N,71,,63049,1719,HEC
72,,SING,C3D,CAD,no,N,72,,63049,1719,HEC
73,,SING,CMD,HMD1,no,N,73,,63049,1719,HEC
74,,SING,CMD,HMD2,no,N,74,,63049,1719,HEC
75,,SING,CMD,HMD3,no,N,75,,63049,1719,HEC
76,,SING,CAD,CBD,no,N,76,,63049,1719,HEC
77,,SING,CAD,HAD1,no,N,77,,63049,1719,HEC
78,,SING,CAD,HAD2,no,N,78,,63049,1719,HEC
79,,SING,CBD,CGD,no,N,79,,63049,1719,HEC
80,,SING,CBD,HBD1,no,N,80,,63049,1719,HEC
81,,SING,CBD,HBD2,no,N,81,,63049,1719,HEC
82,,DOUB,CGD,O1D,no,N,82,,63049,1719,HEC
83,,SING,CGD,O2D,no,N,83,,63049,1719,HEC
84,,SING,O2D,H2D,no,N,84,,63049,1719,HEC
1,,SING,N,CA,no,N,1,,63050,1719,M3L
2,,SING,N,H,no,N,2,,63050,1719,M3L
3,,SING,N,H2,no,N,3,,63050,1719,M3L
4,,SING,CA,CB,no,N,4,,63050,1719,M3L
5,,SING,CA,C,no,N,5,,63050,1719,M3L
6,,SING,CA,HA,no,N,6,,63050,1719,M3L
7,,SING,CB,CG,no,N,7,,63050,1719,M3L
8,,SING,CB,HB2,no,N,8,,63050,1719,M3L
9,,SING,CB,HB3,no,N,9,,63050,1719,M3L
10,,SING,CG,CD,no,N,10,,63050,1719,M3L
11,,SING,CG,HG2,no,N,11,,63050,1719,M3L
12,,SING,CG,HG3,no,N,12,,63050,1719,M3L
13,,SING,CD,CE,no,N,13,,63050,1719,M3L
14,,SING,CD,HD2,no,N,14,,63050,1719,M3L
15,,SING,CD,HD3,no,N,15,,63050,1719,M3L
16,,SING,CE,NZ,no,N,16,,63050,1719,M3L
17,,SING,CE,HE2,no,N,17,,63050,1719,M3L
18,,SING,CE,HE3,no,N,18,,63050,1719,M3L
19,,SING,NZ,CM1,no,N,19,,63050,1719,M3L
20,,SING,NZ,CM2,no,N,20,,63050,1719,M3L
21,,SING,NZ,CM3,no,N,21,,63050,1719,M3L
22,,DOUB,C,O,no,N,22,,63050,1719,M3L
23,,SING,C,OXT,no,N,23,,63050,1719,M3L
24,,SING,OXT,HXT,no,N,24,,63050,1719,M3L
25,,SING,CM1,HM11,no,N,25,,63050,1719,M3L
26,,SING,CM1,HM12,no,N,26,,63050,1719,M3L
27,,SING,CM1,HM13,no,N,27,,63050,1719,M3L
28,,SING,CM2,HM21,no,N,28,,63050,1719,M3L
29,,SING,CM2,HM22,no,N,29,,63050,1719,M3L
30,,SING,CM2,HM23,no,N,30,,63050,1719,M3L
31,,SING,CM3,HM31,no,N,31,,63050,1719,M3L
32,,SING,CM3,HM32,no,N,32,,63050,1719,M3L
33,,SING,CM3,HM33,no,N,33,,63050,1719,M3L
1,,SING,FE,NA,no,N,1,,63247,1720,HEC
2,,SING,FE,NB,no,N,2,,63247,1720,HEC
3,,SING,FE,NC,no,N,3,,63247,1720,HEC
4,,SING,FE,ND,no,N,4,,63247,1720,HEC
5,,DOUB,CHA,C1A,no,N,5,,63247,1720,HEC
6,,SING,CHA,C4D,no,N,6,,63247,1720,HEC
7,,SING,CHA,HHA,no,N,7,,63247,1720,HEC
8,,DOUB,CHB,C4A,no,N,8,,63247,1720,HEC
9,,SING,CHB,C1B,no,N,9,,63247,1720,HEC
10,,SING,CHB,HHB,no,N,10,,63247,1720,HEC
11,,DOUB,CHC,C4B,no,N,11,,63247,1720,HEC
12,,SING,CHC,C1C,no,N,12,,63247,1720,HEC
13,,SING,CHC,HHC,no,N,13,,63247,1720,HEC
14,,DOUB,CHD,C4C,no,N,14,,63247,1720,HEC
15,,SING,CHD,C1D,no,N,15,,63247,1720,HEC
16,,SING,CHD,HHD,no,N,16,,63247,1720,HEC
17,,SING,NA,C1A,yes,N,17,,63247,1720,HEC
18,,SING,NA,C4A,yes,N,18,,63247,1720,HEC
19,,SING,C1A,C2A,yes,N,19,,63247,1720,HEC
20,,DOUB,C2A,C3A,yes,N,20,,63247,1720,HEC
21,,SING,C2A,CAA,no,N,21,,63247,1720,HEC
22,,SING,C3A,C4A,yes,N,22,,63247,1720,HEC
23,,SING,C3A,CMA,no,N,23,,63247,1720,HEC
24,,SING,CMA,HMA1,no,N,24,,63247,1720,HEC
25,,SING,CMA,HMA2,no,N,25,,63247,1720,HEC
26,,SING,CMA,HMA3,no,N,26,,63247,1720,HEC
27,,SING,CAA,CBA,no,N,27,,63247,1720,HEC
28,,SING,CAA,HAA1,no,N,28,,63247,1720,HEC
29,,SING,CAA,HAA2,no,N,29,,63247,1720,HEC
30,,SING,CBA,CGA,no,N,30,,63247,1720,HEC
31,,SING,CBA,HBA1,no,N,31,,63247,1720,HEC
32,,SING,CBA,HBA2,no,N,32,,63247,1720,HEC
33,,DOUB,CGA,O1A,no,N,33,,63247,1720,HEC
34,,SING,CGA,O2A,no,N,34,,63247,1720,HEC
35,,SING,O2A,H2A,no,N,35,,63247,1720,HEC
36,,SING,NB,C1B,yes,N,36,,63247,1720,HEC
37,,SING,NB,C4B,yes,N,37,,63247,1720,HEC
38,,DOUB,C1B,C2B,yes,N,38,,63247,1720,HEC
39,,SING,C2B,C3B,yes,N,39,,63247,1720,HEC
40,,SING,C2B,CMB,no,N,40,,63247,1720,HEC
41,,SING,C3B,C4B,yes,N,41,,63247,1720,HEC
42,,DOUB,C3B,CAB,no,E,42,,63247,1720,HEC
43,,SING,CMB,HMB1,no,N,43,,63247,1720,HEC
44,,SING,CMB,HMB2,no,N,44,,63247,1720,HEC
45,,SING,CMB,HMB3,no,N,45,,63247,1720,HEC
46,,SING,CAB,CBB,no,N,46,,63247,1720,HEC
47,,SING,CAB,HAB,no,N,47,,63247,1720,HEC
48,,SING,CBB,HBB1,no,N,48,,63247,1720,HEC
49,,SING,CBB,HBB2,no,N,49,,63247,1720,HEC
50,,SING,CBB,HBB3,no,N,50,,63247,1720,HEC
51,,SING,NC,C1C,yes,N,51,,63247,1720,HEC
52,,SING,NC,C4C,yes,N,52,,63247,1720,HEC
53,,DOUB,C1C,C2C,yes,N,53,,63247,1720,HEC
54,,SING,C2C,C3C,yes,N,54,,63247,1720,HEC
55,,SING,C2C,CMC,no,N,55,,63247,1720,HEC
56,,SING,C3C,C4C,yes,N,56,,63247,1720,HEC
57,,DOUB,C3C,CAC,no,E,57,,63247,1720,HEC
58,,SING,CMC,HMC1,no,N,58,,63247,1720,HEC
59,,SING,CMC,HMC2,no,N,59,,63247,1720,HEC
60,,SING,CMC,HMC3,no,N,60,,63247,1720,HEC
61,,SING,CAC,CBC,no,N,61,,63247,1720,HEC
62,,SING,CAC,HAC,no,N,62,,63247,1720,HEC
63,,SING,CBC,HBC1,no,N,63,,63247,1720,HEC
64,,SING,CBC,HBC2,no,N,64,,63247,1720,HEC
65,,SING,CBC,HBC3,no,N,65,,63247,1720,HEC
66,,SING,ND,C1D,yes,N,66,,63247,1720,HEC
67,,SING,ND,C4D,yes,N,67,,63247,1720,HEC
68,,DOUB,C1D,C2D,yes,N,68,,63247,1720,HEC
69,,SING,C2D,C3D,yes,N,69,,63247,1720,HEC
70,,SING,C2D,CMD,no,N,70,,63247,1720,HEC
71,,DOUB,C3D,C4D,yes,N,71,,63247,1720,HEC
72,,SING,C3D,CAD,no,N,72,,63247,1720,HEC
73,,SING,CMD,HMD1,no,N,73,,63247,1720,HEC
74,,SING,CMD,HMD2,no,N,74,,63247,1720,HEC
75,,SING,CMD,HMD3,no,N,75,,63247,1720,HEC
76,,SING,CAD,CBD,no,N,76,,63247,1720,HEC
77,,SING,CAD,HAD1,no,N,77,,63247,1720,HEC
78,,SING,CAD,HAD2,no,N,78,,63247,1720,HEC
79,,SING,CBD,CGD,no,N,79,,63247,1720,HEC
80,,SING,CBD,HBD1,no,N,80,,63247,1720,HEC
81,,SING,CBD,HBD2,no,N,81,,63247,1720,HEC
82,,DOUB,CGD,O1D,no,N,82,,63247,1720,HEC
83,,SING,CGD,O2D,no,N,83,,63247,1720,HEC
84,,SING,O2D,H2D,no,N,84,,63247,1720,HEC
1,,SING,N,CA,no,N,1,,63248,1720,M3L
2,,SING,N,H,no,N,2,,63248,1720,M3L
3,,SING,N,H2,no,N,3,,63248,1720,M3L
4,,SING,CA,CB,no,N,4,,63248,1720,M3L
5,,SING,CA,C,no,N,5,,63248,1720,M3L
6,,SING,CA,HA,no,N,6,,63248,1720,M3L
7,,SING,CB,CG,no,N,7,,63248,1720,M3L
8,,SING,CB,HB2,no,N,8,,63248,1720,M3L
9,,SING,CB,HB3,no,N,9,,63248,1720,M3L
10,,SING,CG,CD,no,N,10,,63248,1720,M3L
11,,SING,CG,HG2,no,N,11,,63248,1720,M3L
12,,SING,CG,HG3,no,N,12,,63248,1720,M3L
13,,SING,CD,CE,no,N,13,,63248,1720,M3L
14,,SING,CD,HD2,no,N,14,,63248,1720,M3L
15,,SING,CD,HD3,no,N,15,,63248,1720,M3L
16,,SING,CE,NZ,no,N,16,,63248,1720,M3L
17,,SING,CE,HE2,no,N,17,,63248,1720,M3L
18,,SING,CE,HE3,no,N,18,,63248,1720,M3L
19,,SING,NZ,CM1,no,N,19,,63248,1720,M3L
20,,SING,NZ,CM2,no,N,20,,63248,1720,M3L
21,,SING,NZ,CM3,no,N,21,,63248,1720,M3L
22,,DOUB,C,O,no,N,22,,63248,1720,M3L
23,,SING,C,OXT,no,N,23,,63248,1720,M3L
24,,SING,OXT,HXT,no,N,24,,63248,1720,M3L
25,,SING,CM1,HM11,no,N,25,,63248,1720,M3L
26,,SING,CM1,HM12,no,N,26,,63248,1720,M3L
27,,SING,CM1,HM13,no,N,27,,63248,1720,M3L
28,,SING,CM2,HM21,no,N,28,,63248,1720,M3L
29,,SING,CM2,HM22,no,N,29,,63248,1720,M3L
30,,SING,CM2,HM23,no,N,30,,63248,1720,M3L
31,,SING,CM3,HM31,no,N,31,,63248,1720,M3L
32,,SING,CM3,HM32,no,N,32,,63248,1720,M3L
33,,SING,CM3,HM33,no,N,33,,63248,1720,M3L
1,,SING,N,CA,,,,,63263,17200,M3L
2,,SING,N,H,,,,,63263,17200,M3L
3,,SING,N,H2,,,,,63263,17200,M3L
4,,SING,CA,CB,,,,,63263,17200,M3L
5,,SING,CA,C,,,,,63263,17200,M3L
6,,SING,CA,HA,,,,,63263,17200,M3L
7,,SING,CB,CG,,,,,63263,17200,M3L
8,,SING,CB,HB2,,,,,63263,17200,M3L
9,,SING,CB,HB3,,,,,63263,17200,M3L
10,,SING,CG,CD,,,,,63263,17200,M3L
11,,SING,CG,HG2,,,,,63263,17200,M3L
12,,SING,CG,HG3,,,,,63263,17200,M3L
13,,SING,CD,CE,,,,,63263,17200,M3L
14,,SING,CD,HD2,,,,,63263,17200,M3L
15,,SING,CD,HD3,,,,,63263,17200,M3L
16,,SING,CE,NZ,,,,,63263,17200,M3L
17,,SING,CE,HE2,,,,,63263,17200,M3L
18,,SING,CE,HE3,,,,,63263,17200,M3L
19,,SING,NZ,CM1,,,,,63263,17200,M3L
20,,SING,NZ,CM2,,,,,63263,17200,M3L
21,,SING,NZ,CM3,,,,,63263,17200,M3L
22,,DOUB,C,O,,,,,63263,17200,M3L
23,,SING,C,OXT,,,,,63263,17200,M3L
24,,SING,OXT,HXT,,,,,63263,17200,M3L
25,,SING,CM1,HM11,,,,,63263,17200,M3L
26,,SING,CM1,HM12,,,,,63263,17200,M3L
27,,SING,CM1,HM13,,,,,63263,17200,M3L
28,,SING,CM2,HM21,,,,,63263,17200,M3L
29,,SING,CM2,HM22,,,,,63263,17200,M3L
30,,SING,CM2,HM23,,,,,63263,17200,M3L
31,,SING,CM3,HM31,,,,,63263,17200,M3L
32,,SING,CM3,HM32,,,,,63263,17200,M3L
33,,SING,CM3,HM33,,,,,63263,17200,M3L
1,,DOUB,PB,O1B,no,N,1,,63432,17208,ADP
2,,SING,PB,O2B,no,N,2,,63432,17208,ADP
3,,SING,PB,O3B,no,N,3,,63432,17208,ADP
4,,SING,PB,O3A,no,N,4,,63432,17208,ADP
5,,SING,O2B,HOB2,no,N,5,,63432,17208,ADP
6,,SING,O3B,HOB3,no,N,6,,63432,17208,ADP
7,,DOUB,PA,O1A,no,N,7,,63432,17208,ADP
8,,SING,PA,O2A,no,N,8,,63432,17208,ADP
9,,SING,PA,O3A,no,N,9,,63432,17208,ADP
10,,SING,PA,O5',no,N,10,,63432,17208,ADP
11,,SING,O2A,HOA2,no,N,11,,63432,17208,ADP
12,,SING,O5',C5',no,N,12,,63432,17208,ADP
13,,SING,C5',C4',no,N,13,,63432,17208,ADP
14,,SING,C5',H5'1,no,N,14,,63432,17208,ADP
15,,SING,C5',H5'2,no,N,15,,63432,17208,ADP
16,,SING,C4',O4',no,N,16,,63432,17208,ADP
17,,SING,C4',C3',no,N,17,,63432,17208,ADP
18,,SING,C4',H4',no,N,18,,63432,17208,ADP
19,,SING,O4',C1',no,N,19,,63432,17208,ADP
20,,SING,C3',O3',no,N,20,,63432,17208,ADP
21,,SING,C3',C2',no,N,21,,63432,17208,ADP
22,,SING,C3',H3',no,N,22,,63432,17208,ADP
23,,SING,O3',HO3',no,N,23,,63432,17208,ADP
24,,SING,C2',O2',no,N,24,,63432,17208,ADP
25,,SING,C2',C1',no,N,25,,63432,17208,ADP
26,,SING,C2',H2',no,N,26,,63432,17208,ADP
27,,SING,O2',HO2',no,N,27,,63432,17208,ADP
28,,SING,C1',N9,no,N,28,,63432,17208,ADP
29,,SING,C1',H1',no,N,29,,63432,17208,ADP
30,,SING,N9,C8,yes,N,30,,63432,17208,ADP
31,,SING,N9,C4,yes,N,31,,63432,17208,ADP
32,,DOUB,C8,N7,yes,N,32,,63432,17208,ADP
33,,SING,C8,H8,no,N,33,,63432,17208,ADP
34,,SING,N7,C5,yes,N,34,,63432,17208,ADP
35,,SING,C5,C6,yes,N,35,,63432,17208,ADP
36,,DOUB,C5,C4,yes,N,36,,63432,17208,ADP
37,,SING,C6,N6,no,N,37,,63432,17208,ADP
38,,DOUB,C6,N1,yes,N,38,,63432,17208,ADP
39,,SING,N6,HN61,no,N,39,,63432,17208,ADP
40,,SING,N6,HN62,no,N,40,,63432,17208,ADP
41,,SING,N1,C2,yes,N,41,,63432,17208,ADP
42,,DOUB,C2,N3,yes,N,42,,63432,17208,ADP
43,,SING,C2,H2,no,N,43,,63432,17208,ADP
44,,SING,N3,C4,yes,N,44,,63432,17208,ADP
1,,DOUB,P,O1,no,N,1,,63434,17208,PO4
2,,SING,P,O2,no,N,2,,63434,17208,PO4
3,,SING,P,O3,no,N,3,,63434,17208,PO4
4,,SING,P,O4,no,N,4,,63434,17208,PO4
1,,DOUB,PG,O1G,no,N,1,,63478,17210,ATP
2,,SING,PG,O2G,no,N,2,,63478,17210,ATP
3,,SING,PG,O3G,no,N,3,,63478,17210,ATP
4,,SING,PG,O3B,no,N,4,,63478,17210,ATP
5,,SING,O2G,HOG2,no,N,5,,63478,17210,ATP
6,,SING,O3G,HOG3,no,N,6,,63478,17210,ATP
7,,DOUB,PB,O1B,no,N,7,,63478,17210,ATP
8,,SING,PB,O2B,no,N,8,,63478,17210,ATP
9,,SING,PB,O3B,no,N,9,,63478,17210,ATP
10,,SING,PB,O3A,no,N,10,,63478,17210,ATP
11,,SING,O2B,HOB2,no,N,11,,63478,17210,ATP
12,,DOUB,PA,O1A,no,N,12,,63478,17210,ATP
13,,SING,PA,O2A,no,N,13,,63478,17210,ATP
14,,SING,PA,O3A,no,N,14,,63478,17210,ATP
15,,SING,PA,O5',no,N,15,,63478,17210,ATP
16,,SING,O2A,HOA2,no,N,16,,63478,17210,ATP
17,,SING,O5',C5',no,N,17,,63478,17210,ATP
18,,SING,C5',C4',no,N,18,,63478,17210,ATP
19,,SING,C5',H5'1,no,N,19,,63478,17210,ATP
20,,SING,C5',H5'2,no,N,20,,63478,17210,ATP
21,,SING,C4',O4',no,N,21,,63478,17210,ATP
22,,SING,C4',C3',no,N,22,,63478,17210,ATP
23,,SING,C4',H4',no,N,23,,63478,17210,ATP
24,,SING,O4',C1',no,N,24,,63478,17210,ATP
25,,SING,C3',O3',no,N,25,,63478,17210,ATP
26,,SING,C3',C2',no,N,26,,63478,17210,ATP
27,,SING,C3',H3',no,N,27,,63478,17210,ATP
28,,SING,O3',HO3',no,N,28,,63478,17210,ATP
29,,SING,C2',O2',no,N,29,,63478,17210,ATP
30,,SING,C2',C1',no,N,30,,63478,17210,ATP
31,,SING,C2',H2',no,N,31,,63478,17210,ATP
32,,SING,O2',HO2',no,N,32,,63478,17210,ATP
33,,SING,C1',N9,no,N,33,,63478,17210,ATP
34,,SING,C1',H1',no,N,34,,63478,17210,ATP
35,,SING,N9,C8,yes,N,35,,63478,17210,ATP
36,,SING,N9,C4,yes,N,36,,63478,17210,ATP
37,,DOUB,C8,N7,yes,N,37,,63478,17210,ATP
38,,SING,C8,H8,no,N,38,,63478,17210,ATP
39,,SING,N7,C5,yes,N,39,,63478,17210,ATP
40,,SING,C5,C6,yes,N,40,,63478,17210,ATP
41,,DOUB,C5,C4,yes,N,41,,63478,17210,ATP
42,,SING,C6,N6,no,N,42,,63478,17210,ATP
43,,DOUB,C6,N1,yes,N,43,,63478,17210,ATP
44,,SING,N6,HN61,no,N,44,,63478,17210,ATP
45,,SING,N6,HN62,no,N,45,,63478,17210,ATP
46,,SING,N1,C2,yes,N,46,,63478,17210,ATP
47,,DOUB,C2,N3,yes,N,47,,63478,17210,ATP
48,,SING,C2,H2,no,N,48,,63478,17210,ATP
49,,SING,N3,C4,yes,N,49,,63478,17210,ATP
1,,SING,PG,S1G,no,N,1,,63479,17210,AGS
2,,SING,PG,O2G,no,N,2,,63479,17210,AGS
3,,DOUB,PG,O3G,no,N,3,,63479,17210,AGS
4,,SING,PG,O3B,no,N,4,,63479,17210,AGS
5,,SING,S1G,HSG,no,N,5,,63479,17210,AGS
6,,SING,O2G,HOG2,no,N,6,,63479,17210,AGS
7,,DOUB,PB,O1B,no,N,7,,63479,17210,AGS
8,,SING,PB,O2B,no,N,8,,63479,17210,AGS
9,,SING,PB,O3B,no,N,9,,63479,17210,AGS
10,,SING,PB,O3A,no,N,10,,63479,17210,AGS
11,,SING,O2B,HOB2,no,N,11,,63479,17210,AGS
12,,DOUB,PA,O1A,no,N,12,,63479,17210,AGS
13,,SING,PA,O2A,no,N,13,,63479,17210,AGS
14,,SING,PA,O3A,no,N,14,,63479,17210,AGS
15,,SING,PA,O5',no,N,15,,63479,17210,AGS
16,,SING,O2A,HOA2,no,N,16,,63479,17210,AGS
17,,SING,O5',C5',no,N,17,,63479,17210,AGS
18,,SING,C5',C4',no,N,18,,63479,17210,AGS
19,,SING,C5',H5'1,no,N,19,,63479,17210,AGS
20,,SING,C5',H5'2,no,N,20,,63479,17210,AGS
21,,SING,C4',O4',no,N,21,,63479,17210,AGS
22,,SING,C4',C3',no,N,22,,63479,17210,AGS
23,,SING,C4',H4',no,N,23,,63479,17210,AGS
24,,SING,O4',C1',no,N,24,,63479,17210,AGS
25,,SING,C3',O3',no,N,25,,63479,17210,AGS
26,,SING,C3',C2',no,N,26,,63479,17210,AGS
27,,SING,C3',H3',no,N,27,,63479,17210,AGS
28,,SING,O3',HO3',no,N,28,,63479,17210,AGS
29,,SING,C2',O2',no,N,29,,63479,17210,AGS
30,,SING,C2',C1',no,N,30,,63479,17210,AGS
31,,SING,C2',H2',no,N,31,,63479,17210,AGS
32,,SING,O2',HO2',no,N,32,,63479,17210,AGS
33,,SING,C1',N9,no,N,33,,63479,17210,AGS
34,,SING,C1',H1',no,N,34,,63479,17210,AGS
35,,SING,N9,C8,yes,N,35,,63479,17210,AGS
36,,SING,N9,C4,yes,N,36,,63479,17210,AGS
37,,DOUB,C8,N7,yes,N,37,,63479,17210,AGS
38,,SING,C8,H8,no,N,38,,63479,17210,AGS
39,,SING,N7,C5,yes,N,39,,63479,17210,AGS
40,,SING,C5,C6,yes,N,40,,63479,17210,AGS
41,,DOUB,C5,C4,yes,N,41,,63479,17210,AGS
42,,SING,C6,N6,no,N,42,,63479,17210,AGS
43,,DOUB,C6,N1,yes,N,43,,63479,17210,AGS
44,,SING,N6,HN61,no,N,44,,63479,17210,AGS
45,,SING,N6,HN62,no,N,45,,63479,17210,AGS
46,,SING,N1,C2,yes,N,46,,63479,17210,AGS
47,,DOUB,C2,N3,yes,N,47,,63479,17210,AGS
48,,SING,C2,H2,no,N,48,,63479,17210,AGS
49,,SING,N3,C4,yes,N,49,,63479,17210,AGS
1,,SING,N5',C5',,,,,63602,17217,5AT
2,,SING,N5',HN51,,,,,63602,17217,5AT
3,,SING,N5',HN52,,,,,63602,17217,5AT
4,,SING,N1,C6,,,,,63602,17217,5AT
5,,SING,N1,C2,,,,,63602,17217,5AT
6,,SING,N1,C1',,,,,63602,17217,5AT
7,,DOUB,C6,C5,,,,,63602,17217,5AT
8,,SING,C6,H6,,,,,63602,17217,5AT
9,,DOUB,C2,O2,,,,,63602,17217,5AT
10,,SING,C2,N3,,,,,63602,17217,5AT
11,,SING,N3,C4,,,,,63602,17217,5AT
12,,SING,N3,H3,,,,,63602,17217,5AT
13,,DOUB,C4,O4,,,,,63602,17217,5AT
14,,SING,C4,C5,,,,,63602,17217,5AT
15,,SING,C5,C7,,,,,63602,17217,5AT
16,,SING,C7,H71,,,,,63602,17217,5AT
17,,SING,C7,H72,,,,,63602,17217,5AT
18,,SING,C7,H73,,,,,63602,17217,5AT
19,,SING,C2',C1',,,,,63602,17217,5AT
20,,SING,C2',C3',,,,,63602,17217,5AT
21,,SING,C2',H2',,,,,63602,17217,5AT
22,,SING,C2',H2'',,,,,63602,17217,5AT
23,,SING,C5',C4',,,,,63602,17217,5AT
24,,SING,C5',H5',,,,,63602,17217,5AT
25,,SING,C5',H5'',,,,,63602,17217,5AT
26,,SING,C4',O4',,,,,63602,17217,5AT
27,,SING,C4',C3',,,,,63602,17217,5AT
28,,SING,C4',H4',,,,,63602,17217,5AT
29,,SING,O4',C1',,,,,63602,17217,5AT
30,,SING,C1',H1',,,,,63602,17217,5AT
31,,SING,C3',O3',,,,,63602,17217,5AT
32,,SING,C3',H3',,,,,63602,17217,5AT
33,,SING,O3',HO3',,,,,63602,17217,5AT
1,,DOUB,C1,O1,no,N,1,,63619,17218,SIN
2,,SING,C1,O2,no,N,2,,63619,17218,SIN
3,,SING,C1,C2,no,N,3,,63619,17218,SIN
4,,SING,O2,HO2,no,N,4,,63619,17218,SIN
5,,SING,C2,C3,no,N,5,,63619,17218,SIN
6,,SING,C2,H21,no,N,6,,63619,17218,SIN
7,,SING,C2,H22,no,N,7,,63619,17218,SIN
8,,SING,C3,C4,no,N,8,,63619,17218,SIN
9,,SING,C3,H31,no,N,9,,63619,17218,SIN
10,,SING,C3,H32,no,N,10,,63619,17218,SIN
11,,DOUB,C4,O3,no,N,11,,63619,17218,SIN
12,,SING,C4,O4,no,N,12,,63619,17218,SIN
13,,SING,O4,HO4,no,N,13,,63619,17218,SIN
1,,SING,N1,C1,no,N,1,,63620,17218,NIT
2,,SING,N1,HN11,no,N,2,,63620,17218,NIT
3,,SING,N1,HN12,no,N,3,,63620,17218,NIT
4,,DOUB,C1,C2,yes,N,4,,63620,17218,NIT
5,,SING,C1,C6,yes,N,5,,63620,17218,NIT
6,,SING,C2,C3,yes,N,6,,63620,17218,NIT
7,,SING,C2,H2,no,N,7,,63620,17218,NIT
8,,DOUB,C3,C4,yes,N,8,,63620,17218,NIT
9,,SING,C3,H3,no,N,9,,63620,17218,NIT
10,,SING,C4,N4,no,N,10,,63620,17218,NIT
11,,SING,C4,C5,yes,N,11,,63620,17218,NIT
12,,SING,N4,ON1,no,N,12,,63620,17218,NIT
13,,DOUB,N4,ON2,no,N,13,,63620,17218,NIT
14,,DOUB,C5,C6,yes,N,14,,63620,17218,NIT
15,,SING,C5,H5,no,N,15,,63620,17218,NIT
16,,SING,C6,H6,no,N,16,,63620,17218,NIT
1,,SING,C1,C2,no,N,1,,63636,17219,RNS
2,,DOUB,C1,O1,no,N,2,,63636,17219,RNS
3,,SING,C1,H11,no,N,3,,63636,17219,RNS
4,,SING,C2,C3,no,N,4,,63636,17219,RNS
5,,SING,C2,O2,no,N,5,,63636,17219,RNS
6,,SING,C2,H2,no,N,6,,63636,17219,RNS
7,,SING,C3,C4,no,N,7,,63636,17219,RNS
8,,SING,C3,O3,no,N,8,,63636,17219,RNS
9,,SING,C3,H3,no,N,9,,63636,17219,RNS
10,,SING,C4,C5,no,N,10,,63636,17219,RNS
11,,SING,C4,O4,no,N,11,,63636,17219,RNS
12,,SING,C4,H4,no,N,12,,63636,17219,RNS
13,,SING,C5,C6,no,N,13,,63636,17219,RNS
14,,SING,C5,O5,no,N,14,,63636,17219,RNS
15,,SING,C5,H5,no,N,15,,63636,17219,RNS
16,,SING,C6,H61,no,N,16,,63636,17219,RNS
17,,SING,C6,H62,no,N,17,,63636,17219,RNS
18,,SING,C6,H63,no,N,18,,63636,17219,RNS
19,,SING,O2,HO2,no,N,19,,63636,17219,RNS
20,,SING,O3,HO3,no,N,20,,63636,17219,RNS
21,,SING,O4,HO4,no,N,21,,63636,17219,RNS
22,,SING,O5,HO5,no,N,22,,63636,17219,RNS
1,,SING,C,O,no,N,1,,63664,17220,GCH
2,,SING,C,C1,no,N,2,,63664,17220,GCH
3,,SING,C,C5,no,N,3,,63664,17220,GCH
4,,SING,C,H12,no,N,4,,63664,17220,GCH
5,,SING,O,H1,no,N,5,,63664,17220,GCH
6,,SING,C1,C2,no,N,6,,63664,17220,GCH
7,,SING,C1,H10,no,N,7,,63664,17220,GCH
8,,SING,C1,H11,no,N,8,,63664,17220,GCH
9,,SING,C2,C3,no,N,9,,63664,17220,GCH
10,,SING,C2,C7,no,N,10,,63664,17220,GCH
11,,SING,C2,H9,no,N,11,,63664,17220,GCH
12,,SING,C3,C4,no,N,12,,63664,17220,GCH
13,,SING,C3,C6,no,N,13,,63664,17220,GCH
14,,SING,C3,C10,no,N,14,,63664,17220,GCH
15,,SING,C4,C5,no,N,15,,63664,17220,GCH
16,,SING,C4,H4,no,N,16,,63664,17220,GCH
17,,SING,C4,H5,no,N,17,,63664,17220,GCH
18,,SING,C5,H2,no,N,18,,63664,17220,GCH
19,,SING,C5,H3,no,N,19,,63664,17220,GCH
20,,SING,C6,H6,no,N,20,,63664,17220,GCH
21,,SING,C6,H7,no,N,21,,63664,17220,GCH
22,,SING,C6,H8,no,N,22,,63664,17220,GCH
23,,SING,C7,C8,no,N,23,,63664,17220,GCH
24,,SING,C7,H17,no,N,24,,63664,17220,GCH
25,,SING,C7,H18,no,N,25,,63664,17220,GCH
26,,SING,C8,O1,no,N,26,,63664,17220,GCH
27,,SING,C8,C9,no,N,27,,63664,17220,GCH
28,,SING,C8,H16,no,N,28,,63664,17220,GCH
29,,SING,O1,H13,no,N,29,,63664,17220,GCH
30,,SING,C9,C10,no,N,30,,63664,17220,GCH
31,,SING,C9,C14,no,N,31,,63664,17220,GCH
32,,SING,C9,H15,no,N,32,,63664,17220,GCH
33,,SING,C10,C11,no,N,33,,63664,17220,GCH
34,,SING,C10,H14,no,N,34,,63664,17220,GCH
35,,SING,C11,C12,no,N,35,,63664,17220,GCH
36,,SING,C11,H41,no,N,36,,63664,17220,GCH
37,,SING,C11,H42,no,N,37,,63664,17220,GCH
38,,SING,C12,C13,no,N,38,,63664,17220,GCH
39,,SING,C12,O3,no,N,39,,63664,17220,GCH
40,,SING,C12,H40,no,N,40,,63664,17220,GCH
41,,SING,C13,C14,no,N,41,,63664,17220,GCH
42,,SING,C13,C17,no,N,42,,63664,17220,GCH
43,,SING,C13,C23,no,N,43,,63664,17220,GCH
44,,SING,C14,C15,no,N,44,,63664,17220,GCH
45,,SING,C14,H35,no,N,45,,63664,17220,GCH
46,,SING,C15,C16,no,N,46,,63664,17220,GCH
47,,SING,C15,H33,no,N,47,,63664,17220,GCH
48,,SING,C15,H34,no,N,48,,63664,17220,GCH
49,,SING,C16,C17,no,N,49,,63664,17220,GCH
50,,SING,C16,H31,no,N,50,,63664,17220,GCH
51,,SING,C16,H32,no,N,51,,63664,17220,GCH
52,,SING,C17,C18,no,N,52,,63664,17220,GCH
53,,SING,C17,H30,no,N,53,,63664,17220,GCH
54,,SING,C18,C19,no,N,54,,63664,17220,GCH
55,,SING,C18,C20,no,N,55,,63664,17220,GCH
56,,SING,C18,H29,no,N,56,,63664,17220,GCH
57,,SING,C19,H19,no,N,57,,63664,17220,GCH
58,,SING,C19,H20,no,N,58,,63664,17220,GCH
59,,SING,C19,H21,no,N,59,,63664,17220,GCH
60,,SING,C20,C21,no,N,60,,63664,17220,GCH
61,,SING,C20,H27,no,N,61,,63664,17220,GCH
62,,SING,C20,H28,no,N,62,,63664,17220,GCH
63,,SING,C21,C22,no,N,63,,63664,17220,GCH
64,,SING,C21,H25,no,N,64,,63664,17220,GCH
65,,SING,C21,H26,no,N,65,,63664,17220,GCH
66,,SING,C22,N,no,N,66,,63664,17220,GCH
67,,DOUB,C22,O2,no,N,67,,63664,17220,GCH
68,,SING,N,CA,no,N,68,,63664,17220,GCH
69,,SING,N,H24,no,N,69,,63664,17220,GCH
70,,SING,CA,C24,no,N,70,,63664,17220,GCH
71,,SING,CA,H22,no,N,71,,63664,17220,GCH
72,,SING,CA,H23,no,N,72,,63664,17220,GCH
73,,SING,C23,H36,no,N,73,,63664,17220,GCH
74,,SING,C23,H37,no,N,74,,63664,17220,GCH
75,,SING,C23,H38,no,N,75,,63664,17220,GCH
76,,SING,O3,H39,no,N,76,,63664,17220,GCH
77,,SING,C24,O4,no,N,77,,63664,17220,GCH
78,,DOUB,C24,O5,no,N,78,,63664,17220,GCH
79,,SING,O4,H43,no,N,79,,63664,17220,GCH
1,,SING,N,CA,no,N,1,,63693,17222,YOF
2,,SING,N,H,no,N,2,,63693,17222,YOF
3,,SING,N,H2,no,N,3,,63693,17222,YOF
4,,SING,CA,C,no,N,4,,63693,17222,YOF
5,,SING,CA,CB,no,N,5,,63693,17222,YOF
6,,SING,CA,HA,no,N,6,,63693,17222,YOF
7,,DOUB,C,O,no,N,7,,63693,17222,YOF
8,,SING,C,OXT,no,N,8,,63693,17222,YOF
9,,SING,OXT,HXT,no,N,9,,63693,17222,YOF
10,,SING,CB,CG,no,N,10,,63693,17222,YOF
11,,SING,CB,HB2,no,N,11,,63693,17222,YOF
12,,SING,CB,HB3,no,N,12,,63693,17222,YOF
13,,DOUB,CG,CD1,yes,N,13,,63693,17222,YOF
14,,SING,CG,CD2,yes,N,14,,63693,17222,YOF
15,,SING,CD1,CE1,yes,N,15,,63693,17222,YOF
16,,SING,CD1,HD1,no,N,16,,63693,17222,YOF
17,,DOUB,CD2,CE2,yes,N,17,,63693,17222,YOF
18,,SING,CD2,HD2,no,N,18,,63693,17222,YOF
19,,DOUB,CE1,CZ,yes,N,19,,63693,17222,YOF
20,,SING,CE1,F,no,N,20,,63693,17222,YOF
21,,SING,CE2,CZ,yes,N,21,,63693,17222,YOF
22,,SING,CE2,HE2,no,N,22,,63693,17222,YOF
23,,SING,CZ,OH,no,N,23,,63693,17222,YOF
24,,SING,OH,HH,no,N,24,,63693,17222,YOF
1,,TRIP,C,N,,,1,,63768,17226,CYN
1,,SING,FE,NA,no,N,1,,63966,17236,HEC
2,,SING,FE,NB,no,N,2,,63966,17236,HEC
3,,SING,FE,NC,no,N,3,,63966,17236,HEC
4,,SING,FE,ND,no,N,4,,63966,17236,HEC
5,,DOUB,CHA,C1A,no,N,5,,63966,17236,HEC
6,,SING,CHA,C4D,no,N,6,,63966,17236,HEC
7,,SING,CHA,HHA,no,N,7,,63966,17236,HEC
8,,DOUB,CHB,C4A,no,N,8,,63966,17236,HEC
9,,SING,CHB,C1B,no,N,9,,63966,17236,HEC
10,,SING,CHB,HHB,no,N,10,,63966,17236,HEC
11,,DOUB,CHC,C4B,no,N,11,,63966,17236,HEC
12,,SING,CHC,C1C,no,N,12,,63966,17236,HEC
13,,SING,CHC,HHC,no,N,13,,63966,17236,HEC
14,,DOUB,CHD,C4C,no,N,14,,63966,17236,HEC
15,,SING,CHD,C1D,no,N,15,,63966,17236,HEC
16,,SING,CHD,HHD,no,N,16,,63966,17236,HEC
17,,SING,NA,C1A,yes,N,17,,63966,17236,HEC
18,,SING,NA,C4A,yes,N,18,,63966,17236,HEC
19,,SING,C1A,C2A,yes,N,19,,63966,17236,HEC
20,,DOUB,C2A,C3A,yes,N,20,,63966,17236,HEC
21,,SING,C2A,CAA,no,N,21,,63966,17236,HEC
22,,SING,C3A,C4A,yes,N,22,,63966,17236,HEC
23,,SING,C3A,CMA,no,N,23,,63966,17236,HEC
24,,SING,CMA,HMA1,no,N,24,,63966,17236,HEC
25,,SING,CMA,HMA2,no,N,25,,63966,17236,HEC
26,,SING,CMA,HMA3,no,N,26,,63966,17236,HEC
27,,SING,CAA,CBA,no,N,27,,63966,17236,HEC
28,,SING,CAA,HAA1,no,N,28,,63966,17236,HEC
29,,SING,CAA,HAA2,no,N,29,,63966,17236,HEC
30,,SING,CBA,CGA,no,N,30,,63966,17236,HEC
31,,SING,CBA,HBA1,no,N,31,,63966,17236,HEC
32,,SING,CBA,HBA2,no,N,32,,63966,17236,HEC
33,,DOUB,CGA,O1A,no,N,33,,63966,17236,HEC
34,,SING,CGA,O2A,no,N,34,,63966,17236,HEC
35,,SING,O2A,H2A,no,N,35,,63966,17236,HEC
36,,SING,NB,C1B,yes,N,36,,63966,17236,HEC
37,,SING,NB,C4B,yes,N,37,,63966,17236,HEC
38,,DOUB,C1B,C2B,yes,N,38,,63966,17236,HEC
39,,SING,C2B,C3B,yes,N,39,,63966,17236,HEC
40,,SING,C2B,CMB,no,N,40,,63966,17236,HEC
41,,SING,C3B,C4B,yes,N,41,,63966,17236,HEC
42,,DOUB,C3B,CAB,no,E,42,,63966,17236,HEC
43,,SING,CMB,HMB1,no,N,43,,63966,17236,HEC
44,,SING,CMB,HMB2,no,N,44,,63966,17236,HEC
45,,SING,CMB,HMB3,no,N,45,,63966,17236,HEC
46,,SING,CAB,CBB,no,N,46,,63966,17236,HEC
47,,SING,CAB,HAB,no,N,47,,63966,17236,HEC
48,,SING,CBB,HBB1,no,N,48,,63966,17236,HEC
49,,SING,CBB,HBB2,no,N,49,,63966,17236,HEC
50,,SING,CBB,HBB3,no,N,50,,63966,17236,HEC
51,,SING,NC,C1C,yes,N,51,,63966,17236,HEC
52,,SING,NC,C4C,yes,N,52,,63966,17236,HEC
53,,DOUB,C1C,C2C,yes,N,53,,63966,17236,HEC
54,,SING,C2C,C3C,yes,N,54,,63966,17236,HEC
55,,SING,C2C,CMC,no,N,55,,63966,17236,HEC
56,,SING,C3C,C4C,yes,N,56,,63966,17236,HEC
57,,DOUB,C3C,CAC,no,E,57,,63966,17236,HEC
58,,SING,CMC,HMC1,no,N,58,,63966,17236,HEC
59,,SING,CMC,HMC2,no,N,59,,63966,17236,HEC
60,,SING,CMC,HMC3,no,N,60,,63966,17236,HEC
61,,SING,CAC,CBC,no,N,61,,63966,17236,HEC
62,,SING,CAC,HAC,no,N,62,,63966,17236,HEC
63,,SING,CBC,HBC1,no,N,63,,63966,17236,HEC
64,,SING,CBC,HBC2,no,N,64,,63966,17236,HEC
65,,SING,CBC,HBC3,no,N,65,,63966,17236,HEC
66,,SING,ND,C1D,yes,N,66,,63966,17236,HEC
67,,SING,ND,C4D,yes,N,67,,63966,17236,HEC
68,,DOUB,C1D,C2D,yes,N,68,,63966,17236,HEC
69,,SING,C2D,C3D,yes,N,69,,63966,17236,HEC
70,,SING,C2D,CMD,no,N,70,,63966,17236,HEC
71,,DOUB,C3D,C4D,yes,N,71,,63966,17236,HEC
72,,SING,C3D,CAD,no,N,72,,63966,17236,HEC
73,,SING,CMD,HMD1,no,N,73,,63966,17236,HEC
74,,SING,CMD,HMD2,no,N,74,,63966,17236,HEC
75,,SING,CMD,HMD3,no,N,75,,63966,17236,HEC
76,,SING,CAD,CBD,no,N,76,,63966,17236,HEC
77,,SING,CAD,HAD1,no,N,77,,63966,17236,HEC
78,,SING,CAD,HAD2,no,N,78,,63966,17236,HEC
79,,SING,CBD,CGD,no,N,79,,63966,17236,HEC
80,,SING,CBD,HBD1,no,N,80,,63966,17236,HEC
81,,SING,CBD,HBD2,no,N,81,,63966,17236,HEC
82,,DOUB,CGD,O1D,no,N,82,,63966,17236,HEC
83,,SING,CGD,O2D,no,N,83,,63966,17236,HEC
84,,SING,O2D,H2D,no,N,84,,63966,17236,HEC
1,,SING,O1,C2,,,,,64118,17243,EGC
2,,SING,O1,H1,,,,,64118,17243,EGC
3,,SING,C2,C3,,,,,64118,17243,EGC
4,,SING,C2,H21,,,,,64118,17243,EGC
5,,SING,C2,H22,,,,,64118,17243,EGC
6,,SING,C3,O4,,,,,64118,17243,EGC
7,,SING,C3,H31A,,,,,64118,17243,EGC
8,,SING,C3,H32,,,,,64118,17243,EGC
9,,SING,O4,C5,,,,,64118,17243,EGC
10,,SING,C5,C6,,,,,64118,17243,EGC
11,,SING,C5,H51,,,,,64118,17243,EGC
12,,SING,C5,H52,,,,,64118,17243,EGC
13,,SING,C6,O7,,,,,64118,17243,EGC
14,,SING,C6,H61,,,,,64118,17243,EGC
15,,SING,C6,H62,,,,,64118,17243,EGC
16,,SING,O7,C8,,,,,64118,17243,EGC
18,,SING,C8,H81,,,,,64118,17243,EGC
19,,SING,C8,H82,,,,,64118,17243,EGC
20,,SING,C9,O10,,,,,64118,17243,EGC
21,,SING,C9,H91,,,,,64118,17243,EGC
22,,SING,C9,H92,,,,,64118,17243,EGC
23,,SING,O10,C11,,,,,64118,17243,EGC
24,,SING,C11,C12,,,,,64118,17243,EGC
25,,SING,C11,H111,,,,,64118,17243,EGC
26,,SING,C11,H112,,,,,64118,17243,EGC
27,,SING,C12,O13,,,,,64118,17243,EGC
28,,SING,C12,H121,,,,,64118,17243,EGC
29,,SING,C12,H122,,,,,64118,17243,EGC
30,,SING,C14,C15,,,,,64118,17243,EGC
31,,SING,C14,O13,,,,,64118,17243,EGC
32,,SING,C14,H141,,,,,64118,17243,EGC
33,,SING,C14,H142,,,,,64118,17243,EGC
34,,SING,C15,O16,,,,,64118,17243,EGC
35,,SING,C15,H151,,,,,64118,17243,EGC
36,,SING,C15,H152,,,,,64118,17243,EGC
37,,SING,C17,C18,,,,,64118,17243,EGC
38,,SING,C17,O16,,,,,64118,17243,EGC
39,,SING,C17,H171,,,,,64118,17243,EGC
40,,SING,C17,H172,,,,,64118,17243,EGC
41,,SING,C18,O19,,,,,64118,17243,EGC
42,,SING,C18,H181,,,,,64118,17243,EGC
43,,SING,C18,H182,,,,,64118,17243,EGC
44,,SING,C20,C21,,,,,64118,17243,EGC
45,,SING,C20,O19,,,,,64118,17243,EGC
46,,SING,C20,H201,,,,,64118,17243,EGC
47,,SING,C20,H202,,,,,64118,17243,EGC
48,,SING,C21,O22,,,,,64118,17243,EGC
49,,SING,C21,H211,,,,,64118,17243,EGC
50,,SING,C21,H212,,,,,64118,17243,EGC
51,,SING,C23,C24,,,,,64118,17243,EGC
52,,SING,C23,O22,,,,,64118,17243,EGC
53,,SING,C23,H231,,,,,64118,17243,EGC
54,,SING,C23,H232,,,,,64118,17243,EGC
55,,SING,C24,O25,,,,,64118,17243,EGC
56,,SING,C24,H241,,,,,64118,17243,EGC
57,,SING,C24,H242,,,,,64118,17243,EGC
58,,SING,C26,C27,,,,,64118,17243,EGC
59,,SING,C26,O25,,,,,64118,17243,EGC
60,,SING,C26,H261,,,,,64118,17243,EGC
61,,SING,C26,H262,,,,,64118,17243,EGC
62,,SING,C27,O28,,,,,64118,17243,EGC
63,,SING,C27,H271,,,,,64118,17243,EGC
64,,SING,C27,H272,,,,,64118,17243,EGC
65,,DOUB,C29,C30,,,,,64118,17243,EGC
66,,SING,C29,C34,,,,,64118,17243,EGC
67,,SING,C29,O28,,,,,64118,17243,EGC
68,,SING,C30,C31,,,,,64118,17243,EGC
69,,SING,C30,H30,,,,,64118,17243,EGC
70,,DOUB,C31,C32,,,,,64118,17243,EGC
71,,SING,C31,H31,,,,,64118,17243,EGC
72,,SING,C32,C33,,,,,64118,17243,EGC
73,,SING,C32,C35,,,,,64118,17243,EGC
74,,DOUB,C33,C34,,,,,64118,17243,EGC
75,,SING,C33,H33,,,,,64118,17243,EGC
76,,SING,C34,H34,,,,,64118,17243,EGC
77,,SING,C35,C36,,,,,64118,17243,EGC
78,,SING,C35,C37,,,,,64118,17243,EGC
79,,SING,C35,C38,,,,,64118,17243,EGC
80,,SING,C36,H361,,,,,64118,17243,EGC
81,,SING,C36,H362,,,,,64118,17243,EGC
82,,SING,C36,H363,,,,,64118,17243,EGC
83,,SING,C37,H371,,,,,64118,17243,EGC
84,,SING,C37,H372,,,,,64118,17243,EGC
85,,SING,C37,H373,,,,,64118,17243,EGC
86,,SING,C38,C39,,,,,64118,17243,EGC
87,,SING,C38,H381,,,,,64118,17243,EGC
88,,SING,C38,H382,,,,,64118,17243,EGC
89,,SING,C39,C40,,,,,64118,17243,EGC
90,,SING,C39,C41,,,,,64118,17243,EGC
91,,SING,C39,C42,,,,,64118,17243,EGC
92,,SING,C40,H401,,,,,64118,17243,EGC
93,,SING,C40,H402,,,,,64118,17243,EGC
94,,SING,C40,H403,,,,,64118,17243,EGC
95,,SING,C41,H411,,,,,64118,17243,EGC
96,,SING,C41,H412,,,,,64118,17243,EGC
97,,SING,C41,H413,,,,,64118,17243,EGC
98,,SING,C42,H421,,,,,64118,17243,EGC
99,,SING,C42,H422,,,,,64118,17243,EGC
100,,SING,C42,H423,,,,,64118,17243,EGC
1,,SING,N,CA,no,N,1,,64283,17252,CY1
2,,SING,N,H,no,N,2,,64283,17252,CY1
3,,SING,N,H2,no,N,3,,64283,17252,CY1
4,,SING,CA,CB,no,N,4,,64283,17252,CY1
5,,SING,CA,C,no,N,5,,64283,17252,CY1
6,,SING,CA,HA,no,N,6,,64283,17252,CY1
7,,SING,CB,SG,no,N,7,,64283,17252,CY1
8,,SING,CB,HB2,no,N,8,,64283,17252,CY1
9,,SING,CB,HB3,no,N,9,,64283,17252,CY1
10,,SING,SG,CD,no,N,10,,64283,17252,CY1
11,,SING,CD,NE,no,N,11,,64283,17252,CY1
12,,SING,CD,HD2,no,N,12,,64283,17252,CY1
13,,SING,CD,HD3,no,N,13,,64283,17252,CY1
14,,SING,NE,CZ,no,N,14,,64283,17252,CY1
15,,SING,NE,HE,no,N,15,,64283,17252,CY1
16,,DOUB,CZ,OAC,no,N,16,,64283,17252,CY1
17,,SING,CZ,CM,no,N,17,,64283,17252,CY1
18,,SING,CM,HM1,no,N,18,,64283,17252,CY1
19,,SING,CM,HM2,no,N,19,,64283,17252,CY1
20,,SING,CM,HM3,no,N,20,,64283,17252,CY1
21,,DOUB,C,O,no,N,21,,64283,17252,CY1
22,,SING,C,OXT,no,N,22,,64283,17252,CY1
23,,SING,OXT,HXT,no,N,23,,64283,17252,CY1
1,,DOUB,OH,CH,no,N,1,,64641,17270,ALY
2,,SING,CH,CH3,no,N,2,,64641,17270,ALY
3,,SING,CH,NZ,no,N,3,,64641,17270,ALY
4,,SING,CH3,HH31,no,N,4,,64641,17270,ALY
5,,SING,CH3,HH32,no,N,5,,64641,17270,ALY
19,,SING,CE,HE1,,,,,117112,20092,NLE
6,,SING,CH3,HH33,no,N,6,,64641,17270,ALY
7,,SING,NZ,CE,no,N,7,,64641,17270,ALY
8,,SING,NZ,HZ,no,N,8,,64641,17270,ALY
9,,SING,CE,CD,no,N,9,,64641,17270,ALY
10,,SING,CE,HE3,no,N,10,,64641,17270,ALY
11,,SING,CE,HE2,no,N,11,,64641,17270,ALY
12,,SING,CD,CG,no,N,12,,64641,17270,ALY
13,,SING,CD,HD3,no,N,13,,64641,17270,ALY
14,,SING,CD,HD2,no,N,14,,64641,17270,ALY
15,,SING,CG,CB,no,N,15,,64641,17270,ALY
16,,SING,CG,HG3,no,N,16,,64641,17270,ALY
17,,SING,CG,HG2,no,N,17,,64641,17270,ALY
18,,SING,CB,CA,no,N,18,,64641,17270,ALY
19,,SING,CB,HB3,no,N,19,,64641,17270,ALY
20,,SING,CB,HB2,no,N,20,,64641,17270,ALY
21,,SING,CA,N,no,N,21,,64641,17270,ALY
22,,SING,CA,C,no,N,22,,64641,17270,ALY
23,,SING,CA,HCA,no,N,23,,64641,17270,ALY
24,,SING,N,H,no,N,24,,64641,17270,ALY
25,,SING,N,H2,no,N,25,,64641,17270,ALY
26,,DOUB,C,O,no,N,26,,64641,17270,ALY
27,,SING,C,OXT,no,N,27,,64641,17270,ALY
28,,SING,OXT,HXT,no,N,28,,64641,17270,ALY
1,,SING,N3,C4,,,,,64703,17273,CYT
2,,SING,N3,C2,,,,,64703,17273,CYT
3,,SING,N3,HN3,,,,,64703,17273,CYT
4,,SING,C4,N4,,,,,64703,17273,CYT
5,,DOUB,C4,C5,,,,,64703,17273,CYT
6,,SING,N1,C2,,,,,64703,17273,CYT
7,,DOUB,N1,C6,,,,,64703,17273,CYT
8,,DOUB,C2,O2,,,,,64703,17273,CYT
9,,SING,N4,HN41,,,,,64703,17273,CYT
10,,SING,N4,HN42,,,,,64703,17273,CYT
11,,SING,C5,C6,,,,,64703,17273,CYT
12,,SING,C5,H5,,,,,64703,17273,CYT
13,,SING,C6,H6,,,,,64703,17273,CYT
1,,SING,C1,N,,,,,65390,17307,MK8
2,,SING,C1,HC1,,,,,65390,17307,MK8
3,,SING,C1,HC2,,,,,65390,17307,MK8
4,,SING,C1,HC3,,,,,65390,17307,MK8
5,,SING,N,CA,,,,,65390,17307,MK8
6,,SING,N,H,,,,,65390,17307,MK8
7,,SING,CA,C,,,,,65390,17307,MK8
8,,SING,CA,CB,,,,,65390,17307,MK8
9,,SING,CA,HA,,,,,65390,17307,MK8
10,,DOUB,C,O,,,,,65390,17307,MK8
11,,SING,C,OXT,,,,,65390,17307,MK8
12,,SING,CB,CG,,,,,65390,17307,MK8
13,,SING,CB,HB2,,,,,65390,17307,MK8
14,,SING,CB,HB3,,,,,65390,17307,MK8
15,,SING,CG,CD,,,,,65390,17307,MK8
16,,SING,CG,HG2,,,,,65390,17307,MK8
17,,SING,CG,HG3,,,,,65390,17307,MK8
18,,SING,CD,CE,,,,,65390,17307,MK8
19,,SING,CD,HD2,,,,,65390,17307,MK8
20,,SING,CD,HD3,,,,,65390,17307,MK8
21,,SING,CE,HE1,,,,,65390,17307,MK8
22,,SING,CE,HE2,,,,,65390,17307,MK8
23,,SING,CE,HE3,,,,,65390,17307,MK8
24,,SING,OXT,HO1,,,,,65390,17307,MK8
1,,DOUB,N1,C2,yes,N,1,,65454,17310,TRR
2,,SING,N1,C6,yes,N,2,,65454,17310,TRR
3,,SING,N1,H1,no,N,3,,65454,17310,TRR
4,,SING,C2,N2,no,N,4,,65454,17310,TRR
5,,SING,C2,N3,yes,N,5,,65454,17310,TRR
6,,SING,N2,H21,no,N,6,,65454,17310,TRR
7,,SING,N2,H22,no,N,7,,65454,17310,TRR
8,,DOUB,N3,C4,yes,N,8,,65454,17310,TRR
9,,SING,C4,N4,no,N,9,,65454,17310,TRR
10,,SING,C4,C5,yes,N,10,,65454,17310,TRR
11,,SING,N4,H41,no,N,11,,65454,17310,TRR
12,,SING,N4,H42,no,N,12,,65454,17310,TRR
13,,DOUB,C5,C6,yes,N,13,,65454,17310,TRR
14,,SING,C5,C7,no,N,14,,65454,17310,TRR
15,,SING,C6,H6,no,N,15,,65454,17310,TRR
16,,SING,C7,C11,no,N,16,,65454,17310,TRR
17,,SING,C7,H71,no,N,17,,65454,17310,TRR
18,,SING,C7,H72,no,N,18,,65454,17310,TRR
19,,DOUB,C11,C12,yes,N,19,,65454,17310,TRR
20,,SING,C11,C16,yes,N,20,,65454,17310,TRR
21,,SING,C12,C13,yes,N,21,,65454,17310,TRR
22,,SING,C12,H12,no,N,22,,65454,17310,TRR
23,,DOUB,C13,C14,yes,N,23,,65454,17310,TRR
24,,SING,C13,O13,no,N,24,,65454,17310,TRR
25,,SING,C14,C15,yes,N,25,,65454,17310,TRR
26,,SING,C14,O14,no,N,26,,65454,17310,TRR
27,,DOUB,C15,C16,yes,N,27,,65454,17310,TRR
28,,SING,C15,O15,no,N,28,,65454,17310,TRR
29,,SING,C16,H16,no,N,29,,65454,17310,TRR
30,,SING,O13,C17,no,N,30,,65454,17310,TRR
31,,SING,O14,C18,no,N,31,,65454,17310,TRR
32,,SING,O15,C19,no,N,32,,65454,17310,TRR
33,,SING,C17,H171,no,N,33,,65454,17310,TRR
34,,SING,C17,H172,no,N,34,,65454,17310,TRR
35,,SING,C17,H173,no,N,35,,65454,17310,TRR
36,,SING,C18,H181,no,N,36,,65454,17310,TRR
37,,SING,C18,H182,no,N,37,,65454,17310,TRR
38,,SING,C18,H183,no,N,38,,65454,17310,TRR
39,,SING,C19,H191,no,N,39,,65454,17310,TRR
40,,SING,C19,H192,no,N,40,,65454,17310,TRR
41,,SING,C19,H193,no,N,41,,65454,17310,TRR
1,,DOUB,PA,O1A,no,N,1,,65478,17311,NDP
2,,SING,PA,O2A,no,N,2,,65478,17311,NDP
3,,SING,PA,O5B,no,N,3,,65478,17311,NDP
4,,SING,PA,O3,no,N,4,,65478,17311,NDP
5,,SING,O2A,HOA2,no,N,5,,65478,17311,NDP
6,,SING,O5B,C5B,no,N,6,,65478,17311,NDP
7,,SING,C5B,C4B,no,N,7,,65478,17311,NDP
8,,SING,C5B,H51A,no,N,8,,65478,17311,NDP
9,,SING,C5B,H52A,no,N,9,,65478,17311,NDP
10,,SING,C4B,O4B,no,N,10,,65478,17311,NDP
11,,SING,C4B,C3B,no,N,11,,65478,17311,NDP
12,,SING,C4B,H4B,no,N,12,,65478,17311,NDP
13,,SING,O4B,C1B,no,N,13,,65478,17311,NDP
14,,SING,C3B,O3B,no,N,14,,65478,17311,NDP
15,,SING,C3B,C2B,no,N,15,,65478,17311,NDP
16,,SING,C3B,H3B,no,N,16,,65478,17311,NDP
17,,SING,O3B,HO3A,no,N,17,,65478,17311,NDP
18,,SING,C2B,O2B,no,N,18,,65478,17311,NDP
19,,SING,C2B,C1B,no,N,19,,65478,17311,NDP
20,,SING,C2B,H2B,no,N,20,,65478,17311,NDP
21,,SING,O2B,P2B,no,N,21,,65478,17311,NDP
22,,SING,C1B,N9A,no,N,22,,65478,17311,NDP
23,,SING,C1B,H1B,no,N,23,,65478,17311,NDP
24,,SING,N9A,C8A,yes,N,24,,65478,17311,NDP
25,,SING,N9A,C4A,yes,N,25,,65478,17311,NDP
26,,DOUB,C8A,N7A,yes,N,26,,65478,17311,NDP
27,,SING,C8A,H8A,no,N,27,,65478,17311,NDP
28,,SING,N7A,C5A,yes,N,28,,65478,17311,NDP
29,,SING,C5A,C6A,yes,N,29,,65478,17311,NDP
30,,DOUB,C5A,C4A,yes,N,30,,65478,17311,NDP
31,,SING,C6A,N6A,no,N,31,,65478,17311,NDP
32,,DOUB,C6A,N1A,yes,N,32,,65478,17311,NDP
33,,SING,N6A,H61A,no,N,33,,65478,17311,NDP
34,,SING,N6A,H62A,no,N,34,,65478,17311,NDP
35,,SING,N1A,C2A,yes,N,35,,65478,17311,NDP
36,,DOUB,C2A,N3A,yes,N,36,,65478,17311,NDP
37,,SING,C2A,H2A,no,N,37,,65478,17311,NDP
38,,SING,N3A,C4A,yes,N,38,,65478,17311,NDP
39,,SING,O3,PN,no,N,39,,65478,17311,NDP
40,,DOUB,PN,O1N,no,N,40,,65478,17311,NDP
41,,SING,PN,O2N,no,N,41,,65478,17311,NDP
42,,SING,PN,O5D,no,N,42,,65478,17311,NDP
43,,SING,O2N,H21N,no,N,43,,65478,17311,NDP
44,,SING,O5D,C5D,no,N,44,,65478,17311,NDP
45,,SING,C5D,C4D,no,N,45,,65478,17311,NDP
46,,SING,C5D,H51N,no,N,46,,65478,17311,NDP
47,,SING,C5D,H52N,no,N,47,,65478,17311,NDP
48,,SING,C4D,O4D,no,N,48,,65478,17311,NDP
49,,SING,C4D,C3D,no,N,49,,65478,17311,NDP
50,,SING,C4D,H4D,no,N,50,,65478,17311,NDP
51,,SING,O4D,C1D,no,N,51,,65478,17311,NDP
52,,SING,C3D,O3D,no,N,52,,65478,17311,NDP
53,,SING,C3D,C2D,no,N,53,,65478,17311,NDP
54,,SING,C3D,H3D,no,N,54,,65478,17311,NDP
55,,SING,O3D,HO3N,no,N,55,,65478,17311,NDP
56,,SING,C2D,O2D,no,N,56,,65478,17311,NDP
57,,SING,C2D,C1D,no,N,57,,65478,17311,NDP
58,,SING,C2D,H2D,no,N,58,,65478,17311,NDP
59,,SING,O2D,HO2N,no,N,59,,65478,17311,NDP
60,,SING,C1D,N1N,no,N,60,,65478,17311,NDP
61,,SING,C1D,H1D,no,N,61,,65478,17311,NDP
62,,SING,N1N,C2N,no,N,62,,65478,17311,NDP
63,,SING,N1N,C6N,no,N,63,,65478,17311,NDP
64,,DOUB,C2N,C3N,no,N,64,,65478,17311,NDP
65,,SING,C2N,H2N,no,N,65,,65478,17311,NDP
66,,SING,C3N,C7N,no,N,66,,65478,17311,NDP
67,,SING,C3N,C4N,no,N,67,,65478,17311,NDP
68,,DOUB,C7N,O7N,no,N,68,,65478,17311,NDP
69,,SING,C7N,N7N,no,N,69,,65478,17311,NDP
70,,SING,N7N,H71N,no,N,70,,65478,17311,NDP
71,,SING,N7N,H72N,no,N,71,,65478,17311,NDP
72,,SING,C4N,C5N,no,N,72,,65478,17311,NDP
73,,SING,C4N,H41N,no,N,73,,65478,17311,NDP
74,,SING,C4N,H42N,no,N,74,,65478,17311,NDP
75,,DOUB,C5N,C6N,no,N,75,,65478,17311,NDP
76,,SING,C5N,H5N,no,N,76,,65478,17311,NDP
77,,SING,C6N,H6N,no,N,77,,65478,17311,NDP
78,,DOUB,P2B,O1X,no,N,78,,65478,17311,NDP
79,,SING,P2B,O2X,no,N,79,,65478,17311,NDP
80,,SING,P2B,O3X,no,N,80,,65478,17311,NDP
81,,SING,O2X,HOP2,no,N,81,,65478,17311,NDP
82,,SING,O3X,HOP3,no,N,82,,65478,17311,NDP
1,,SING,N,CA,no,N,1,,65770,17327,LYR
2,,SING,N,H,no,N,2,,65770,17327,LYR
3,,SING,N,H2,no,N,3,,65770,17327,LYR
4,,SING,CA,C,no,N,4,,65770,17327,LYR
5,,SING,CA,CB,no,N,5,,65770,17327,LYR
6,,SING,CA,HA,no,N,6,,65770,17327,LYR
7,,DOUB,C,O,no,N,7,,65770,17327,LYR
8,,SING,C,OXT,no,N,8,,65770,17327,LYR
9,,SING,OXT,HXT,no,N,9,,65770,17327,LYR
10,,SING,CB,CG,no,N,10,,65770,17327,LYR
11,,SING,CB,HB2,no,N,11,,65770,17327,LYR
12,,SING,CB,HB3,no,N,12,,65770,17327,LYR
13,,SING,CG,CD,no,N,13,,65770,17327,LYR
14,,SING,CG,HG2,no,N,14,,65770,17327,LYR
15,,SING,CG,HG3,no,N,15,,65770,17327,LYR
16,,SING,CD,CE,no,N,16,,65770,17327,LYR
17,,SING,CD,HD2,no,N,17,,65770,17327,LYR
18,,SING,CD,HD3,no,N,18,,65770,17327,LYR
19,,SING,CE,NZ,no,N,19,,65770,17327,LYR
20,,SING,CE,HE2,no,N,20,,65770,17327,LYR
21,,SING,CE,HE3,no,N,21,,65770,17327,LYR
22,,SING,NZ,C1,no,N,22,,65770,17327,LYR
23,,SING,NZ,HZ,no,N,23,,65770,17327,LYR
24,,SING,C1,C2,no,N,24,,65770,17327,LYR
25,,SING,C1,H1,no,N,25,,65770,17327,LYR
26,,SING,C1,H11,no,N,26,,65770,17327,LYR
27,,DOUB,C2,C3,no,E,27,,65770,17327,LYR
28,,SING,C2,HC2,no,N,28,,65770,17327,LYR
29,,SING,C3,C4,no,N,29,,65770,17327,LYR
30,,SING,C3,C5,no,N,30,,65770,17327,LYR
20,,SING,CE,HE2,,,,,117112,20092,NLE
31,,SING,C4,H41,no,N,31,,65770,17327,LYR
32,,SING,C4,H42,no,N,32,,65770,17327,LYR
33,,SING,C4,H43,no,N,33,,65770,17327,LYR
34,,DOUB,C5,C6,no,Z,34,,65770,17327,LYR
35,,SING,C5,H5,no,N,35,,65770,17327,LYR
36,,SING,C6,C7,no,N,36,,65770,17327,LYR
37,,SING,C6,H6,no,N,37,,65770,17327,LYR
38,,DOUB,C7,C80,no,E,38,,65770,17327,LYR
39,,SING,C7,H7,no,N,39,,65770,17327,LYR
40,,SING,C80,C8,no,N,40,,65770,17327,LYR
41,,SING,C80,C9,no,N,41,,65770,17327,LYR
42,,SING,C8,H81,no,N,42,,65770,17327,LYR
43,,SING,C8,H82,no,N,43,,65770,17327,LYR
44,,SING,C8,H83,no,N,44,,65770,17327,LYR
45,,DOUB,C9,C10,no,E,45,,65770,17327,LYR
46,,SING,C9,H9,no,N,46,,65770,17327,LYR
47,,SING,C10,C11,no,N,47,,65770,17327,LYR
48,,SING,C10,H10,no,N,48,,65770,17327,LYR
49,,DOUB,C11,C12,no,N,49,,65770,17327,LYR
50,,SING,C11,C17,no,N,50,,65770,17327,LYR
51,,SING,C12,C13,no,N,51,,65770,17327,LYR
52,,SING,C12,C14,no,N,52,,65770,17327,LYR
53,,SING,C13,H131,no,N,53,,65770,17327,LYR
54,,SING,C13,H132,no,N,54,,65770,17327,LYR
55,,SING,C13,H133,no,N,55,,65770,17327,LYR
56,,SING,C14,C15,no,N,56,,65770,17327,LYR
57,,SING,C14,H141,no,N,57,,65770,17327,LYR
58,,SING,C14,H142,no,N,58,,65770,17327,LYR
59,,SING,C15,C16,no,N,59,,65770,17327,LYR
60,,SING,C15,H151,no,N,60,,65770,17327,LYR
61,,SING,C15,H152,no,N,61,,65770,17327,LYR
62,,SING,C16,C17,no,N,62,,65770,17327,LYR
63,,SING,C16,H161,no,N,63,,65770,17327,LYR
64,,SING,C16,H162,no,N,64,,65770,17327,LYR
65,,SING,C17,C18,no,N,65,,65770,17327,LYR
66,,SING,C17,C19,no,N,66,,65770,17327,LYR
67,,SING,C18,H181,no,N,67,,65770,17327,LYR
68,,SING,C18,H182,no,N,68,,65770,17327,LYR
69,,SING,C18,H183,no,N,69,,65770,17327,LYR
70,,SING,C19,H191,no,N,70,,65770,17327,LYR
71,,SING,C19,H192,no,N,71,,65770,17327,LYR
72,,SING,C19,H193,no,N,72,,65770,17327,LYR
1,,SING,FE,NA,no,N,1,,65955,1734,HEC
2,,SING,FE,NB,no,N,2,,65955,1734,HEC
3,,SING,FE,NC,no,N,3,,65955,1734,HEC
4,,SING,FE,ND,no,N,4,,65955,1734,HEC
5,,DOUB,CHA,C1A,no,N,5,,65955,1734,HEC
6,,SING,CHA,C4D,no,N,6,,65955,1734,HEC
7,,SING,CHA,HHA,no,N,7,,65955,1734,HEC
8,,DOUB,CHB,C4A,no,N,8,,65955,1734,HEC
9,,SING,CHB,C1B,no,N,9,,65955,1734,HEC
10,,SING,CHB,HHB,no,N,10,,65955,1734,HEC
11,,DOUB,CHC,C4B,no,N,11,,65955,1734,HEC
12,,SING,CHC,C1C,no,N,12,,65955,1734,HEC
13,,SING,CHC,HHC,no,N,13,,65955,1734,HEC
14,,DOUB,CHD,C4C,no,N,14,,65955,1734,HEC
15,,SING,CHD,C1D,no,N,15,,65955,1734,HEC
16,,SING,CHD,HHD,no,N,16,,65955,1734,HEC
17,,SING,NA,C1A,yes,N,17,,65955,1734,HEC
18,,SING,NA,C4A,yes,N,18,,65955,1734,HEC
19,,SING,C1A,C2A,yes,N,19,,65955,1734,HEC
20,,DOUB,C2A,C3A,yes,N,20,,65955,1734,HEC
21,,SING,C2A,CAA,no,N,21,,65955,1734,HEC
22,,SING,C3A,C4A,yes,N,22,,65955,1734,HEC
23,,SING,C3A,CMA,no,N,23,,65955,1734,HEC
24,,SING,CMA,HMA1,no,N,24,,65955,1734,HEC
25,,SING,CMA,HMA2,no,N,25,,65955,1734,HEC
26,,SING,CMA,HMA3,no,N,26,,65955,1734,HEC
27,,SING,CAA,CBA,no,N,27,,65955,1734,HEC
28,,SING,CAA,HAA1,no,N,28,,65955,1734,HEC
29,,SING,CAA,HAA2,no,N,29,,65955,1734,HEC
30,,SING,CBA,CGA,no,N,30,,65955,1734,HEC
31,,SING,CBA,HBA1,no,N,31,,65955,1734,HEC
32,,SING,CBA,HBA2,no,N,32,,65955,1734,HEC
33,,DOUB,CGA,O1A,no,N,33,,65955,1734,HEC
34,,SING,CGA,O2A,no,N,34,,65955,1734,HEC
35,,SING,O2A,H2A,no,N,35,,65955,1734,HEC
36,,SING,NB,C1B,yes,N,36,,65955,1734,HEC
37,,SING,NB,C4B,yes,N,37,,65955,1734,HEC
38,,DOUB,C1B,C2B,yes,N,38,,65955,1734,HEC
39,,SING,C2B,C3B,yes,N,39,,65955,1734,HEC
40,,SING,C2B,CMB,no,N,40,,65955,1734,HEC
41,,SING,C3B,C4B,yes,N,41,,65955,1734,HEC
42,,DOUB,C3B,CAB,no,E,42,,65955,1734,HEC
43,,SING,CMB,HMB1,no,N,43,,65955,1734,HEC
44,,SING,CMB,HMB2,no,N,44,,65955,1734,HEC
45,,SING,CMB,HMB3,no,N,45,,65955,1734,HEC
46,,SING,CAB,CBB,no,N,46,,65955,1734,HEC
47,,SING,CAB,HAB,no,N,47,,65955,1734,HEC
48,,SING,CBB,HBB1,no,N,48,,65955,1734,HEC
49,,SING,CBB,HBB2,no,N,49,,65955,1734,HEC
50,,SING,CBB,HBB3,no,N,50,,65955,1734,HEC
51,,SING,NC,C1C,yes,N,51,,65955,1734,HEC
52,,SING,NC,C4C,yes,N,52,,65955,1734,HEC
53,,DOUB,C1C,C2C,yes,N,53,,65955,1734,HEC
54,,SING,C2C,C3C,yes,N,54,,65955,1734,HEC
55,,SING,C2C,CMC,no,N,55,,65955,1734,HEC
56,,SING,C3C,C4C,yes,N,56,,65955,1734,HEC
57,,DOUB,C3C,CAC,no,E,57,,65955,1734,HEC
58,,SING,CMC,HMC1,no,N,58,,65955,1734,HEC
59,,SING,CMC,HMC2,no,N,59,,65955,1734,HEC
60,,SING,CMC,HMC3,no,N,60,,65955,1734,HEC
61,,SING,CAC,CBC,no,N,61,,65955,1734,HEC
62,,SING,CAC,HAC,no,N,62,,65955,1734,HEC
63,,SING,CBC,HBC1,no,N,63,,65955,1734,HEC
21,,SING,CE,HE3,,,,,117112,20092,NLE
64,,SING,CBC,HBC2,no,N,64,,65955,1734,HEC
65,,SING,CBC,HBC3,no,N,65,,65955,1734,HEC
66,,SING,ND,C1D,yes,N,66,,65955,1734,HEC
67,,SING,ND,C4D,yes,N,67,,65955,1734,HEC
68,,DOUB,C1D,C2D,yes,N,68,,65955,1734,HEC
69,,SING,C2D,C3D,yes,N,69,,65955,1734,HEC
70,,SING,C2D,CMD,no,N,70,,65955,1734,HEC
71,,DOUB,C3D,C4D,yes,N,71,,65955,1734,HEC
72,,SING,C3D,CAD,no,N,72,,65955,1734,HEC
73,,SING,CMD,HMD1,no,N,73,,65955,1734,HEC
74,,SING,CMD,HMD2,no,N,74,,65955,1734,HEC
75,,SING,CMD,HMD3,no,N,75,,65955,1734,HEC
76,,SING,CAD,CBD,no,N,76,,65955,1734,HEC
77,,SING,CAD,HAD1,no,N,77,,65955,1734,HEC
78,,SING,CAD,HAD2,no,N,78,,65955,1734,HEC
79,,SING,CBD,CGD,no,N,79,,65955,1734,HEC
80,,SING,CBD,HBD1,no,N,80,,65955,1734,HEC
81,,SING,CBD,HBD2,no,N,81,,65955,1734,HEC
82,,DOUB,CGD,O1D,no,N,82,,65955,1734,HEC
83,,SING,CGD,O2D,no,N,83,,65955,1734,HEC
84,,SING,O2D,H2D,no,N,84,,65955,1734,HEC
1,,SING,N,CA,,,,,66018,17344,M3L
2,,SING,N,H,,,,,66018,17344,M3L
3,,SING,N,H2,,,,,66018,17344,M3L
4,,SING,CA,CB,,,,,66018,17344,M3L
5,,SING,CA,C,,,,,66018,17344,M3L
6,,SING,CA,HA,,,,,66018,17344,M3L
7,,SING,CB,CG,,,,,66018,17344,M3L
8,,SING,CB,HB2,,,,,66018,17344,M3L
9,,SING,CB,HB3,,,,,66018,17344,M3L
10,,SING,CG,CD,,,,,66018,17344,M3L
11,,SING,CG,HG2,,,,,66018,17344,M3L
12,,SING,CG,HG3,,,,,66018,17344,M3L
13,,SING,CD,CE,,,,,66018,17344,M3L
14,,SING,CD,HD2,,,,,66018,17344,M3L
15,,SING,CD,HD3,,,,,66018,17344,M3L
16,,SING,CE,NZ,,,,,66018,17344,M3L
17,,SING,CE,HE2,,,,,66018,17344,M3L
18,,SING,CE,HE3,,,,,66018,17344,M3L
19,,SING,NZ,CM1,,,,,66018,17344,M3L
20,,SING,NZ,CM2,,,,,66018,17344,M3L
21,,SING,NZ,CM3,,,,,66018,17344,M3L
22,,DOUB,C,O,,,,,66018,17344,M3L
23,,SING,C,OXT,,,,,66018,17344,M3L
24,,SING,OXT,HXT,,,,,66018,17344,M3L
25,,SING,CM1,HM11,,,,,66018,17344,M3L
26,,SING,CM1,HM12,,,,,66018,17344,M3L
27,,SING,CM1,HM13,,,,,66018,17344,M3L
28,,SING,CM2,HM21,,,,,66018,17344,M3L
29,,SING,CM2,HM22,,,,,66018,17344,M3L
30,,SING,CM2,HM23,,,,,66018,17344,M3L
31,,SING,CM3,HM31,,,,,66018,17344,M3L
32,,SING,CM3,HM32,,,,,66018,17344,M3L
33,,SING,CM3,HM33,,,,,66018,17344,M3L
1,,SING,C1,C2,no,N,1,,66298,1736,AAC
2,,SING,C1,O1,no,N,2,,66298,1736,AAC
3,,DOUB,C1,O2,no,N,3,,66298,1736,AAC
4,,SING,C2,N1,no,N,4,,66298,1736,AAC
5,,SING,C2,HC21,no,N,5,,66298,1736,AAC
6,,SING,C2,HC22,no,N,6,,66298,1736,AAC
7,,SING,C3,C4,no,N,7,,66298,1736,AAC
8,,SING,C3,N1,no,N,8,,66298,1736,AAC
9,,DOUB,C3,O3,no,N,9,,66298,1736,AAC
10,,SING,C4,HC41,no,N,10,,66298,1736,AAC
11,,SING,C4,HC42,no,N,11,,66298,1736,AAC
12,,SING,C4,HC43,no,N,12,,66298,1736,AAC
13,,SING,N1,HN1,no,N,13,,66298,1736,AAC
14,,SING,O1,HO1,no,N,14,,66298,1736,AAC
1,,SING,FE,NA,no,N,1,,66299,1736,HEC
2,,SING,FE,NB,no,N,2,,66299,1736,HEC
3,,SING,FE,NC,no,N,3,,66299,1736,HEC
4,,SING,FE,ND,no,N,4,,66299,1736,HEC
5,,DOUB,CHA,C1A,no,N,5,,66299,1736,HEC
6,,SING,CHA,C4D,no,N,6,,66299,1736,HEC
7,,SING,CHA,HHA,no,N,7,,66299,1736,HEC
8,,DOUB,CHB,C4A,no,N,8,,66299,1736,HEC
9,,SING,CHB,C1B,no,N,9,,66299,1736,HEC
10,,SING,CHB,HHB,no,N,10,,66299,1736,HEC
11,,DOUB,CHC,C4B,no,N,11,,66299,1736,HEC
12,,SING,CHC,C1C,no,N,12,,66299,1736,HEC
13,,SING,CHC,HHC,no,N,13,,66299,1736,HEC
14,,DOUB,CHD,C4C,no,N,14,,66299,1736,HEC
15,,SING,CHD,C1D,no,N,15,,66299,1736,HEC
16,,SING,CHD,HHD,no,N,16,,66299,1736,HEC
17,,SING,NA,C1A,yes,N,17,,66299,1736,HEC
18,,SING,NA,C4A,yes,N,18,,66299,1736,HEC
19,,SING,C1A,C2A,yes,N,19,,66299,1736,HEC
20,,DOUB,C2A,C3A,yes,N,20,,66299,1736,HEC
21,,SING,C2A,CAA,no,N,21,,66299,1736,HEC
22,,SING,C3A,C4A,yes,N,22,,66299,1736,HEC
23,,SING,C3A,CMA,no,N,23,,66299,1736,HEC
24,,SING,CMA,HMA1,no,N,24,,66299,1736,HEC
25,,SING,CMA,HMA2,no,N,25,,66299,1736,HEC
26,,SING,CMA,HMA3,no,N,26,,66299,1736,HEC
27,,SING,CAA,CBA,no,N,27,,66299,1736,HEC
28,,SING,CAA,HAA1,no,N,28,,66299,1736,HEC
29,,SING,CAA,HAA2,no,N,29,,66299,1736,HEC
30,,SING,CBA,CGA,no,N,30,,66299,1736,HEC
31,,SING,CBA,HBA1,no,N,31,,66299,1736,HEC
32,,SING,CBA,HBA2,no,N,32,,66299,1736,HEC
33,,DOUB,CGA,O1A,no,N,33,,66299,1736,HEC
34,,SING,CGA,O2A,no,N,34,,66299,1736,HEC
35,,SING,O2A,H2A,no,N,35,,66299,1736,HEC
36,,SING,NB,C1B,yes,N,36,,66299,1736,HEC
37,,SING,NB,C4B,yes,N,37,,66299,1736,HEC
38,,DOUB,C1B,C2B,yes,N,38,,66299,1736,HEC
39,,SING,C2B,C3B,yes,N,39,,66299,1736,HEC
40,,SING,C2B,CMB,no,N,40,,66299,1736,HEC
41,,SING,C3B,C4B,yes,N,41,,66299,1736,HEC
42,,DOUB,C3B,CAB,no,E,42,,66299,1736,HEC
43,,SING,CMB,HMB1,no,N,43,,66299,1736,HEC
44,,SING,CMB,HMB2,no,N,44,,66299,1736,HEC
45,,SING,CMB,HMB3,no,N,45,,66299,1736,HEC
46,,SING,CAB,CBB,no,N,46,,66299,1736,HEC
47,,SING,CAB,HAB,no,N,47,,66299,1736,HEC
48,,SING,CBB,HBB1,no,N,48,,66299,1736,HEC
49,,SING,CBB,HBB2,no,N,49,,66299,1736,HEC
50,,SING,CBB,HBB3,no,N,50,,66299,1736,HEC
51,,SING,NC,C1C,yes,N,51,,66299,1736,HEC
52,,SING,NC,C4C,yes,N,52,,66299,1736,HEC
53,,DOUB,C1C,C2C,yes,N,53,,66299,1736,HEC
54,,SING,C2C,C3C,yes,N,54,,66299,1736,HEC
55,,SING,C2C,CMC,no,N,55,,66299,1736,HEC
56,,SING,C3C,C4C,yes,N,56,,66299,1736,HEC
57,,DOUB,C3C,CAC,no,E,57,,66299,1736,HEC
58,,SING,CMC,HMC1,no,N,58,,66299,1736,HEC
59,,SING,CMC,HMC2,no,N,59,,66299,1736,HEC
60,,SING,CMC,HMC3,no,N,60,,66299,1736,HEC
61,,SING,CAC,CBC,no,N,61,,66299,1736,HEC
62,,SING,CAC,HAC,no,N,62,,66299,1736,HEC
63,,SING,CBC,HBC1,no,N,63,,66299,1736,HEC
64,,SING,CBC,HBC2,no,N,64,,66299,1736,HEC
65,,SING,CBC,HBC3,no,N,65,,66299,1736,HEC
66,,SING,ND,C1D,yes,N,66,,66299,1736,HEC
67,,SING,ND,C4D,yes,N,67,,66299,1736,HEC
68,,DOUB,C1D,C2D,yes,N,68,,66299,1736,HEC
69,,SING,C2D,C3D,yes,N,69,,66299,1736,HEC
70,,SING,C2D,CMD,no,N,70,,66299,1736,HEC
71,,DOUB,C3D,C4D,yes,N,71,,66299,1736,HEC
72,,SING,C3D,CAD,no,N,72,,66299,1736,HEC
73,,SING,CMD,HMD1,no,N,73,,66299,1736,HEC
74,,SING,CMD,HMD2,no,N,74,,66299,1736,HEC
75,,SING,CMD,HMD3,no,N,75,,66299,1736,HEC
76,,SING,CAD,CBD,no,N,76,,66299,1736,HEC
77,,SING,CAD,HAD1,no,N,77,,66299,1736,HEC
78,,SING,CAD,HAD2,no,N,78,,66299,1736,HEC
79,,SING,CBD,CGD,no,N,79,,66299,1736,HEC
80,,SING,CBD,HBD1,no,N,80,,66299,1736,HEC
81,,SING,CBD,HBD2,no,N,81,,66299,1736,HEC
82,,DOUB,CGD,O1D,no,N,82,,66299,1736,HEC
83,,SING,CGD,O2D,no,N,83,,66299,1736,HEC
84,,SING,O2D,H2D,no,N,84,,66299,1736,HEC
1,,DOUB,C,O,,,1,,66472,17369,ACE
2,,SING,C,CH3,,,2,,66472,17369,ACE
3,,SING,C,H,,,3,,66472,17369,ACE
4,,SING,CH3,H1,,,4,,66472,17369,ACE
5,,SING,CH3,H2,,,5,,66472,17369,ACE
6,,SING,CH3,H3,,,6,,66472,17369,ACE
1,,SING,N,CA,,,1,,66473,17369,PTR
2,,SING,N,H,,,2,,66473,17369,PTR
3,,SING,N,HN2,,,3,,66473,17369,PTR
4,,SING,CA,C,,,4,,66473,17369,PTR
5,,SING,CA,CB,,,5,,66473,17369,PTR
6,,SING,CA,HA,,,6,,66473,17369,PTR
7,,DOUB,C,O,,,7,,66473,17369,PTR
8,,SING,C,OXT,,,8,,66473,17369,PTR
9,,SING,OXT,HXT,,,9,,66473,17369,PTR
10,,SING,CB,CG,,,10,,66473,17369,PTR
11,,SING,CB,HB2,,,11,,66473,17369,PTR
12,,SING,CB,HB3,,,12,,66473,17369,PTR
13,,DOUB,CG,CD1,,,13,,66473,17369,PTR
14,,SING,CG,CD2,,,14,,66473,17369,PTR
15,,SING,CD1,CE1,,,15,,66473,17369,PTR
16,,SING,CD1,HD1,,,16,,66473,17369,PTR
17,,DOUB,CD2,CE2,,,17,,66473,17369,PTR
18,,SING,CD2,HD2,,,18,,66473,17369,PTR
19,,DOUB,CE1,CZ,,,19,,66473,17369,PTR
20,,SING,CE1,HE1,,,20,,66473,17369,PTR
21,,SING,CE2,CZ,,,21,,66473,17369,PTR
22,,SING,CE2,HE2,,,22,,66473,17369,PTR
23,,SING,CZ,OH,,,23,,66473,17369,PTR
24,,SING,OH,P,,,24,,66473,17369,PTR
25,,DOUB,P,O1P,,,25,,66473,17369,PTR
26,,SING,P,O2P,,,26,,66473,17369,PTR
27,,SING,P,O3P,,,27,,66473,17369,PTR
28,,SING,O2P,HO2P,,,28,,66473,17369,PTR
29,,SING,O3P,HO3P,,,29,,66473,17369,PTR
1,,SING,N,HN1,,,1,,66474,17369,NH2
2,,SING,N,HN2,,,2,,66474,17369,NH2
1,,SING,N,CA,no,N,1,,66655,17378,MCL
2,,SING,N,H,no,N,2,,66655,17378,MCL
3,,SING,N,H2,no,N,3,,66655,17378,MCL
4,,SING,CA,CB,no,N,4,,66655,17378,MCL
5,,SING,CA,C,no,N,5,,66655,17378,MCL
6,,SING,CA,HA,no,N,6,,66655,17378,MCL
7,,SING,CB,CG,no,N,7,,66655,17378,MCL
8,,SING,CB,HB2,no,N,8,,66655,17378,MCL
9,,SING,CB,HB3,no,N,9,,66655,17378,MCL
10,,SING,CG,CD,no,N,10,,66655,17378,MCL
11,,SING,CG,HG2,no,N,11,,66655,17378,MCL
12,,SING,CG,HG3,no,N,12,,66655,17378,MCL
13,,SING,CD,CE,no,N,13,,66655,17378,MCL
14,,SING,CD,HD2,no,N,14,,66655,17378,MCL
15,,SING,CD,HD3,no,N,15,,66655,17378,MCL
16,,SING,CE,NZ,no,N,16,,66655,17378,MCL
17,,SING,CE,HE2,no,N,17,,66655,17378,MCL
18,,SING,CE,HE3,no,N,18,,66655,17378,MCL
19,,SING,NZ,CX1,no,N,19,,66655,17378,MCL
20,,SING,NZ,HZ,no,N,20,,66655,17378,MCL
21,,SING,CX1,C1,no,N,21,,66655,17378,MCL
22,,SING,CX1,CX2,no,N,22,,66655,17378,MCL
23,,SING,CX1,HX1,no,N,23,,66655,17378,MCL
24,,SING,C1,H11,no,N,24,,66655,17378,MCL
25,,SING,C1,H12,no,N,25,,66655,17378,MCL
26,,SING,C1,H13,no,N,26,,66655,17378,MCL
27,,SING,CX2,O1,no,N,27,,66655,17378,MCL
28,,DOUB,CX2,O2,no,N,28,,66655,17378,MCL
29,,SING,O1,HO1,no,N,29,,66655,17378,MCL
30,,DOUB,C,O,no,N,30,,66655,17378,MCL
31,,SING,C,OXT,no,N,31,,66655,17378,MCL
32,,SING,OXT,HXT,no,N,32,,66655,17378,MCL
1,,SING,S1,C15,no,N,1,,66656,17378,CEL
2,,SING,S1,N3,no,N,2,,66656,17378,CEL
3,,DOUB,S1,O2,no,N,3,,66656,17378,CEL
4,,DOUB,S1,O1,no,N,4,,66656,17378,CEL
5,,DOUB,C15,C14,yes,N,5,,66656,17378,CEL
6,,SING,C15,C16,yes,N,6,,66656,17378,CEL
7,,SING,C14,C13,yes,N,7,,66656,17378,CEL
8,,SING,C14,H14C,no,N,8,,66656,17378,CEL
9,,DOUB,C13,C12,yes,N,9,,66656,17378,CEL
10,,SING,C13,H13C,no,N,10,,66656,17378,CEL
11,,SING,C12,C17,yes,N,11,,66656,17378,CEL
12,,SING,C12,N2,yes,N,12,,66656,17378,CEL
13,,DOUB,C17,C16,yes,N,13,,66656,17378,CEL
14,,SING,C17,H17C,no,N,14,,66656,17378,CEL
15,,SING,C16,H16C,no,N,15,,66656,17378,CEL
16,,SING,N2,C3,yes,N,16,,66656,17378,CEL
17,,SING,N2,N1,yes,N,17,,66656,17378,CEL
18,,SING,C3,C5,yes,N,18,,66656,17378,CEL
19,,DOUB,C3,C2,yes,N,19,,66656,17378,CEL
20,,DOUB,C5,C10,yes,N,20,,66656,17378,CEL
21,,SING,C5,C6,yes,N,21,,66656,17378,CEL
22,,SING,C10,C9,yes,N,22,,66656,17378,CEL
23,,SING,C10,H10C,no,N,23,,66656,17378,CEL
24,,DOUB,C9,C8,yes,N,24,,66656,17378,CEL
25,,SING,C9,HC9,no,N,25,,66656,17378,CEL
26,,SING,C8,C11,no,N,26,,66656,17378,CEL
27,,SING,C8,C7,yes,N,27,,66656,17378,CEL
28,,SING,C11,H111,no,N,28,,66656,17378,CEL
29,,SING,C11,H112,no,N,29,,66656,17378,CEL
30,,SING,C11,H113,no,N,30,,66656,17378,CEL
31,,DOUB,C7,C6,yes,N,31,,66656,17378,CEL
32,,SING,C7,HC7,no,N,32,,66656,17378,CEL
33,,SING,C6,HC6,no,N,33,,66656,17378,CEL
34,,SING,C2,C1,yes,N,34,,66656,17378,CEL
35,,SING,C2,HC2,no,N,35,,66656,17378,CEL
36,,SING,C1,C4,no,N,36,,66656,17378,CEL
37,,DOUB,C1,N1,yes,N,37,,66656,17378,CEL
38,,SING,C4,F3,no,N,38,,66656,17378,CEL
39,,SING,C4,F2,no,N,39,,66656,17378,CEL
40,,SING,C4,F1,no,N,40,,66656,17378,CEL
41,,SING,N3,HN31,no,N,41,,66656,17378,CEL
42,,SING,N3,HN32,no,N,42,,66656,17378,CEL
1,,DOUB,N1,C2,yes,N,1,,66676,17379,QUI
2,,SING,N1,C9,yes,N,2,,66676,17379,QUI
3,,SING,C2,C3,yes,N,3,,66676,17379,QUI
4,,SING,C2,C,no,N,4,,66676,17379,QUI
5,,DOUB,C3,N4,yes,N,5,,66676,17379,QUI
6,,SING,C3,H3,no,N,6,,66676,17379,QUI
7,,SING,N4,C10,yes,N,7,,66676,17379,QUI
8,,DOUB,C5,C6,yes,N,8,,66676,17379,QUI
9,,SING,C5,C10,yes,N,9,,66676,17379,QUI
10,,SING,C5,H5,no,N,10,,66676,17379,QUI
11,,SING,C6,C7,yes,N,11,,66676,17379,QUI
12,,SING,C6,H6,no,N,12,,66676,17379,QUI
13,,DOUB,C7,C8,yes,N,13,,66676,17379,QUI
14,,SING,C7,H7,no,N,14,,66676,17379,QUI
15,,SING,C8,C9,yes,N,15,,66676,17379,QUI
16,,SING,C8,H8,no,N,16,,66676,17379,QUI
17,,DOUB,C9,C10,yes,N,17,,66676,17379,QUI
18,,DOUB,C,O1,no,N,18,,66676,17379,QUI
19,,SING,C,O2,no,N,19,,66676,17379,QUI
20,,SING,O2,HO2,no,N,20,,66676,17379,QUI
1,,DOUB,C1,C6,,,,,66765,17384,STI
2,,SING,C1,C2,,,,,66765,17384,STI
3,,SING,C1,H11,,,,,66765,17384,STI
4,,SING,C6,C5,,,,,66765,17384,STI
5,,SING,C6,H61,,,,,66765,17384,STI
6,,DOUB,C5,C4,,,,,66765,17384,STI
7,,SING,C5,C7,,,,,66765,17384,STI
8,,SING,C4,N3,,,,,66765,17384,STI
9,,SING,C4,H41,,,,,66765,17384,STI
10,,DOUB,N3,C2,,,,,66765,17384,STI
11,,SING,C2,H21,,,,,66765,17384,STI
12,,DOUB,C7,C12,,,,,66765,17384,STI
13,,SING,C7,N8,,,,,66765,17384,STI
14,,SING,C12,C11,,,,,66765,17384,STI
15,,SING,C12,H121,,,,,66765,17384,STI
16,,DOUB,C11,N10,,,,,66765,17384,STI
17,,SING,C11,H111,,,,,66765,17384,STI
18,,SING,N10,C9,,,,,66765,17384,STI
19,,DOUB,C9,N8,,,,,66765,17384,STI
20,,SING,C9,N13,,,,,66765,17384,STI
21,,SING,N13,C14,,,,,66765,17384,STI
22,,SING,N13,H131,,,,,66765,17384,STI
23,,DOUB,C14,C19,,,,,66765,17384,STI
24,,SING,C14,C15,,,,,66765,17384,STI
25,,SING,C19,C18,,,,,66765,17384,STI
26,,SING,C19,C20,,,,,66765,17384,STI
27,,DOUB,C18,C17,,,,,66765,17384,STI
28,,SING,C18,H181,,,,,66765,17384,STI
29,,SING,C17,C16,,,,,66765,17384,STI
30,,SING,C17,H171,,,,,66765,17384,STI
31,,DOUB,C16,C15,,,,,66765,17384,STI
32,,SING,C16,N21,,,,,66765,17384,STI
33,,SING,C15,H151,,,,,66765,17384,STI
34,,SING,N21,C22,,,,,66765,17384,STI
35,,SING,N21,H211,,,,,66765,17384,STI
36,,SING,C22,C23,,,,,66765,17384,STI
37,,DOUB,C22,O29,,,,,66765,17384,STI
38,,DOUB,C23,C25,,,,,66765,17384,STI
39,,SING,C23,C29,,,,,66765,17384,STI
40,,SING,C25,C26,,,,,66765,17384,STI
41,,SING,C25,H251,,,,,66765,17384,STI
42,,DOUB,C26,C27,,,,,66765,17384,STI
43,,SING,C26,H261,,,,,66765,17384,STI
44,,SING,C27,C28,,,,,66765,17384,STI
45,,SING,C27,C46,,,,,66765,17384,STI
46,,DOUB,C28,C29,,,,,66765,17384,STI
47,,SING,C28,H281,,,,,66765,17384,STI
48,,SING,C29,H291,,,,,66765,17384,STI
49,,SING,C46,N48,,,,,66765,17384,STI
50,,SING,C46,H461,,,,,66765,17384,STI
51,,SING,C46,H462,,,,,66765,17384,STI
52,,SING,N48,C53,,,,,66765,17384,STI
53,,SING,N48,C49,,,,,66765,17384,STI
54,,SING,C53,C52,,,,,66765,17384,STI
55,,SING,C53,H531,,,,,66765,17384,STI
56,,SING,C53,H532,,,,,66765,17384,STI
57,,SING,C52,N51,,,,,66765,17384,STI
58,,SING,C52,H521,,,,,66765,17384,STI
59,,SING,C52,H522,,,,,66765,17384,STI
60,,SING,N51,C54,,,,,66765,17384,STI
61,,SING,N51,C50,,,,,66765,17384,STI
62,,SING,C54,H541,,,,,66765,17384,STI
63,,SING,C54,H542,,,,,66765,17384,STI
64,,SING,C54,H543,,,,,66765,17384,STI
65,,SING,C50,C49,,,,,66765,17384,STI
66,,SING,C50,H501,,,,,66765,17384,STI
67,,SING,C50,H502,,,,,66765,17384,STI
68,,SING,C49,H491,,,,,66765,17384,STI
69,,SING,C49,H492,,,,,66765,17384,STI
70,,SING,C20,H201,,,,,66765,17384,STI
71,,SING,C20,H202,,,,,66765,17384,STI
72,,SING,C20,H203,,,,,66765,17384,STI
1,,SING,FE,NA,no,N,1,,66910,1739,HEC
2,,SING,FE,NB,no,N,2,,66910,1739,HEC
3,,SING,FE,NC,no,N,3,,66910,1739,HEC
4,,SING,FE,ND,no,N,4,,66910,1739,HEC
5,,DOUB,CHA,C1A,no,N,5,,66910,1739,HEC
6,,SING,CHA,C4D,no,N,6,,66910,1739,HEC
7,,SING,CHA,HHA,no,N,7,,66910,1739,HEC
8,,DOUB,CHB,C4A,no,N,8,,66910,1739,HEC
9,,SING,CHB,C1B,no,N,9,,66910,1739,HEC
10,,SING,CHB,HHB,no,N,10,,66910,1739,HEC
11,,DOUB,CHC,C4B,no,N,11,,66910,1739,HEC
12,,SING,CHC,C1C,no,N,12,,66910,1739,HEC
13,,SING,CHC,HHC,no,N,13,,66910,1739,HEC
14,,DOUB,CHD,C4C,no,N,14,,66910,1739,HEC
15,,SING,CHD,C1D,no,N,15,,66910,1739,HEC
16,,SING,CHD,HHD,no,N,16,,66910,1739,HEC
17,,SING,NA,C1A,yes,N,17,,66910,1739,HEC
18,,SING,NA,C4A,yes,N,18,,66910,1739,HEC
19,,SING,C1A,C2A,yes,N,19,,66910,1739,HEC
20,,DOUB,C2A,C3A,yes,N,20,,66910,1739,HEC
21,,SING,C2A,CAA,no,N,21,,66910,1739,HEC
22,,SING,C3A,C4A,yes,N,22,,66910,1739,HEC
23,,SING,C3A,CMA,no,N,23,,66910,1739,HEC
24,,SING,CMA,HMA1,no,N,24,,66910,1739,HEC
25,,SING,CMA,HMA2,no,N,25,,66910,1739,HEC
26,,SING,CMA,HMA3,no,N,26,,66910,1739,HEC
27,,SING,CAA,CBA,no,N,27,,66910,1739,HEC
28,,SING,CAA,HAA1,no,N,28,,66910,1739,HEC
29,,SING,CAA,HAA2,no,N,29,,66910,1739,HEC
30,,SING,CBA,CGA,no,N,30,,66910,1739,HEC
31,,SING,CBA,HBA1,no,N,31,,66910,1739,HEC
32,,SING,CBA,HBA2,no,N,32,,66910,1739,HEC
33,,DOUB,CGA,O1A,no,N,33,,66910,1739,HEC
34,,SING,CGA,O2A,no,N,34,,66910,1739,HEC
35,,SING,O2A,H2A,no,N,35,,66910,1739,HEC
36,,SING,NB,C1B,yes,N,36,,66910,1739,HEC
37,,SING,NB,C4B,yes,N,37,,66910,1739,HEC
38,,DOUB,C1B,C2B,yes,N,38,,66910,1739,HEC
39,,SING,C2B,C3B,yes,N,39,,66910,1739,HEC
40,,SING,C2B,CMB,no,N,40,,66910,1739,HEC
41,,SING,C3B,C4B,yes,N,41,,66910,1739,HEC
42,,DOUB,C3B,CAB,no,E,42,,66910,1739,HEC
43,,SING,CMB,HMB1,no,N,43,,66910,1739,HEC
44,,SING,CMB,HMB2,no,N,44,,66910,1739,HEC
45,,SING,CMB,HMB3,no,N,45,,66910,1739,HEC
46,,SING,CAB,CBB,no,N,46,,66910,1739,HEC
47,,SING,CAB,HAB,no,N,47,,66910,1739,HEC
48,,SING,CBB,HBB1,no,N,48,,66910,1739,HEC
49,,SING,CBB,HBB2,no,N,49,,66910,1739,HEC
50,,SING,CBB,HBB3,no,N,50,,66910,1739,HEC
51,,SING,NC,C1C,yes,N,51,,66910,1739,HEC
52,,SING,NC,C4C,yes,N,52,,66910,1739,HEC
53,,DOUB,C1C,C2C,yes,N,53,,66910,1739,HEC
54,,SING,C2C,C3C,yes,N,54,,66910,1739,HEC
55,,SING,C2C,CMC,no,N,55,,66910,1739,HEC
56,,SING,C3C,C4C,yes,N,56,,66910,1739,HEC
57,,DOUB,C3C,CAC,no,E,57,,66910,1739,HEC
58,,SING,CMC,HMC1,no,N,58,,66910,1739,HEC
59,,SING,CMC,HMC2,no,N,59,,66910,1739,HEC
60,,SING,CMC,HMC3,no,N,60,,66910,1739,HEC
61,,SING,CAC,CBC,no,N,61,,66910,1739,HEC
62,,SING,CAC,HAC,no,N,62,,66910,1739,HEC
63,,SING,CBC,HBC1,no,N,63,,66910,1739,HEC
64,,SING,CBC,HBC2,no,N,64,,66910,1739,HEC
65,,SING,CBC,HBC3,no,N,65,,66910,1739,HEC
66,,SING,ND,C1D,yes,N,66,,66910,1739,HEC
67,,SING,ND,C4D,yes,N,67,,66910,1739,HEC
68,,DOUB,C1D,C2D,yes,N,68,,66910,1739,HEC
69,,SING,C2D,C3D,yes,N,69,,66910,1739,HEC
70,,SING,C2D,CMD,no,N,70,,66910,1739,HEC
71,,DOUB,C3D,C4D,yes,N,71,,66910,1739,HEC
72,,SING,C3D,CAD,no,N,72,,66910,1739,HEC
73,,SING,CMD,HMD1,no,N,73,,66910,1739,HEC
74,,SING,CMD,HMD2,no,N,74,,66910,1739,HEC
75,,SING,CMD,HMD3,no,N,75,,66910,1739,HEC
76,,SING,CAD,CBD,no,N,76,,66910,1739,HEC
77,,SING,CAD,HAD1,no,N,77,,66910,1739,HEC
78,,SING,CAD,HAD2,no,N,78,,66910,1739,HEC
79,,SING,CBD,CGD,no,N,79,,66910,1739,HEC
80,,SING,CBD,HBD1,no,N,80,,66910,1739,HEC
81,,SING,CBD,HBD2,no,N,81,,66910,1739,HEC
82,,DOUB,CGD,O1D,no,N,82,,66910,1739,HEC
83,,SING,CGD,O2D,no,N,83,,66910,1739,HEC
84,,SING,O2D,H2D,no,N,84,,66910,1739,HEC
1,,SING,S,OT,no,N,1,,66978,17392,J28
2,,DOUB,S,OC1,no,N,2,,66978,17392,J28
3,,DOUB,S,OC2,no,N,3,,66978,17392,J28
4,,SING,S,CJ1,no,N,4,,66978,17392,J28
5,,DOUB,NA,NB,no,N,5,,66978,17392,J28
6,,SING,NA,CH,no,N,6,,66978,17392,J28
7,,SING,NB,CG,no,N,7,,66978,17392,J28
8,,DOUB,CG,CD1,yes,N,8,,66978,17392,J28
9,,SING,CG,CD2,yes,N,9,,66978,17392,J28
10,,DOUB,CH,CI1,yes,N,10,,66978,17392,J28
11,,SING,CH,CI2,yes,N,11,,66978,17392,J28
12,,SING,OH,CZ,no,N,12,,66978,17392,J28
13,,SING,OH,HOH,no,N,13,,66978,17392,J28
14,,SING,CK,CN,no,N,14,,66978,17392,J28
15,,DOUB,CK,CJ1,yes,N,15,,66978,17392,J28
16,,SING,CK,CJ2,yes,N,16,,66978,17392,J28
17,,SING,NL,CD1,no,N,17,,66978,17392,J28
18,,SING,NL,HNL,no,N,18,,66978,17392,J28
19,,SING,NL,HNLA,no,N,19,,66978,17392,J28
20,,SING,CM,CE2,no,N,20,,66978,17392,J28
21,,SING,CM,HM,no,N,21,,66978,17392,J28
22,,SING,CM,HMA,no,N,22,,66978,17392,J28
23,,SING,CM,HMB,no,N,23,,66978,17392,J28
24,,SING,CN,HN,no,N,24,,66978,17392,J28
25,,SING,CN,HNA,no,N,25,,66978,17392,J28
26,,SING,CN,HNB,no,N,26,,66978,17392,J28
27,,SING,CP,CI2,no,N,27,,66978,17392,J28
28,,SING,CP,HP,no,N,28,,66978,17392,J28
29,,SING,CP,HPA,no,N,29,,66978,17392,J28
30,,SING,CP,HPB,no,N,30,,66978,17392,J28
31,,SING,OT,HOT,no,N,31,,66978,17392,J28
32,,DOUB,CZ,CE1,yes,N,32,,66978,17392,J28
33,,SING,CZ,CE2,yes,N,33,,66978,17392,J28
34,,SING,CD1,CE1,yes,N,34,,66978,17392,J28
35,,DOUB,CD2,CE2,yes,N,35,,66978,17392,J28
36,,SING,CD2,HD2,no,N,36,,66978,17392,J28
37,,SING,CE1,HE1,no,N,37,,66978,17392,J28
38,,SING,CI1,CJ1,yes,N,38,,66978,17392,J28
39,,SING,CI1,HI1,no,N,39,,66978,17392,J28
40,,DOUB,CI2,CJ2,yes,N,40,,66978,17392,J28
41,,SING,CJ2,HJ2,no,N,41,,66978,17392,J28
1,,DOUB,NA,NB,no,N,1,,67006,17393,L85
2,,SING,NA,CH,no,N,2,,67006,17393,L85
3,,SING,NB,CG,no,N,3,,67006,17393,L85
4,,DOUB,CG,CD1,yes,N,4,,67006,17393,L85
5,,SING,CG,CD2,yes,N,5,,67006,17393,L85
6,,DOUB,CH,CI1,yes,N,6,,67006,17393,L85
7,,SING,CH,CI2,yes,N,7,,67006,17393,L85
8,,SING,OH,CZ,no,N,8,,67006,17393,L85
9,,SING,OH,HOH,no,N,9,,67006,17393,L85
10,,DOUB,CK,CJ1,yes,N,10,,67006,17393,L85
11,,SING,CK,CJ2,yes,N,11,,67006,17393,L85
12,,SING,CK,SO4,no,N,12,,67006,17393,L85
13,,SING,OT,SO4,no,N,13,,67006,17393,L85
14,,SING,OT,HOT,no,N,14,,67006,17393,L85
15,,DOUB,CZ,CE1,yes,N,15,,67006,17393,L85
16,,SING,CZ,CE2,yes,N,16,,67006,17393,L85
17,,DOUB,OC1,SO4,no,N,17,,67006,17393,L85
18,,DOUB,OC2,SO4,no,N,18,,67006,17393,L85
19,,SING,CD1,CE1,yes,N,19,,67006,17393,L85
20,,SING,CD1,HD1,no,N,20,,67006,17393,L85
21,,DOUB,CD2,CE2,yes,N,21,,67006,17393,L85
22,,SING,CD2,HD2,no,N,22,,67006,17393,L85
23,,SING,CE1,HE1,no,N,23,,67006,17393,L85
24,,SING,CE2,HE2,no,N,24,,67006,17393,L85
25,,SING,CI1,CJ1,yes,N,25,,67006,17393,L85
26,,SING,CI1,HI1,no,N,26,,67006,17393,L85
27,,DOUB,CI2,CJ2,yes,N,27,,67006,17393,L85
28,,SING,CI2,HI2,no,N,28,,67006,17393,L85
29,,SING,CJ1,HJ1,no,N,29,,67006,17393,L85
30,,SING,CJ2,HJ2,no,N,30,,67006,17393,L85
1,,SING,N,CA,no,N,1,,67052,17395,TYS
2,,SING,N,H,no,N,2,,67052,17395,TYS
3,,SING,N,HN2,no,N,3,,67052,17395,TYS
4,,SING,CA,CB,no,N,4,,67052,17395,TYS
5,,SING,CA,C,no,N,5,,67052,17395,TYS
6,,SING,CA,HA,no,N,6,,67052,17395,TYS
7,,SING,CB,CG,no,N,7,,67052,17395,TYS
8,,SING,CB,HB2,no,N,8,,67052,17395,TYS
9,,SING,CB,HB3,no,N,9,,67052,17395,TYS
10,,DOUB,CG,CD1,yes,N,10,,67052,17395,TYS
11,,SING,CG,CD2,yes,N,11,,67052,17395,TYS
12,,SING,CD1,CE1,yes,N,12,,67052,17395,TYS
13,,SING,CD1,HD1,no,N,13,,67052,17395,TYS
14,,DOUB,CD2,CE2,yes,N,14,,67052,17395,TYS
15,,SING,CD2,HD2,no,N,15,,67052,17395,TYS
16,,DOUB,CE1,CZ,yes,N,16,,67052,17395,TYS
17,,SING,CE1,HE1,no,N,17,,67052,17395,TYS
18,,SING,CE2,CZ,yes,N,18,,67052,17395,TYS
19,,SING,CE2,HE2,no,N,19,,67052,17395,TYS
20,,SING,CZ,OH,no,N,20,,67052,17395,TYS
21,,SING,OH,S,no,N,21,,67052,17395,TYS
22,,DOUB,S,O1,no,N,22,,67052,17395,TYS
23,,DOUB,S,O2,no,N,23,,67052,17395,TYS
24,,SING,S,O3,no,N,24,,67052,17395,TYS
25,,SING,O3,HO3,no,N,25,,67052,17395,TYS
26,,DOUB,C,O,no,N,26,,67052,17395,TYS
27,,SING,C,OXT,no,N,27,,67052,17395,TYS
28,,SING,OXT,HXT,no,N,28,,67052,17395,TYS
1,,SING,N,CA,no,N,1,,67301,17408,ARG
2,,SING,N,H,no,N,2,,67301,17408,ARG
3,,SING,N,H2,no,N,3,,67301,17408,ARG
4,,SING,CA,C,no,N,4,,67301,17408,ARG
5,,SING,CA,CB,no,N,5,,67301,17408,ARG
6,,SING,CA,HA,no,N,6,,67301,17408,ARG
7,,DOUB,C,O,no,N,7,,67301,17408,ARG
8,,SING,C,OXT,no,N,8,,67301,17408,ARG
9,,SING,CB,CG,no,N,9,,67301,17408,ARG
10,,SING,CB,HB2,no,N,10,,67301,17408,ARG
11,,SING,CB,HB3,no,N,11,,67301,17408,ARG
12,,SING,CG,CD,no,N,12,,67301,17408,ARG
13,,SING,CG,HG2,no,N,13,,67301,17408,ARG
14,,SING,CG,HG3,no,N,14,,67301,17408,ARG
15,,SING,CD,NE,no,N,15,,67301,17408,ARG
16,,SING,CD,HD2,no,N,16,,67301,17408,ARG
17,,SING,CD,HD3,no,N,17,,67301,17408,ARG
18,,SING,NE,CZ,no,N,18,,67301,17408,ARG
19,,SING,NE,HE,no,N,19,,67301,17408,ARG
20,,SING,CZ,NH1,no,N,20,,67301,17408,ARG
21,,DOUB,CZ,NH2,no,N,21,,67301,17408,ARG
22,,SING,NH1,HH11,no,N,22,,67301,17408,ARG
23,,SING,NH1,HH12,no,N,23,,67301,17408,ARG
24,,SING,NH2,HH21,no,N,24,,67301,17408,ARG
25,,SING,NH2,HH22,no,N,25,,67301,17408,ARG
26,,SING,OXT,HXT,no,N,26,,67301,17408,ARG
1,,SING,N,CAT,no,N,1,,67302,17408,L8H
2,,SING,N,HN,no,N,2,,67302,17408,L8H
3,,SING,CAA,OAQ,no,N,3,,67302,17408,L8H
4,,SING,CAA,HAA,no,N,4,,67302,17408,L8H
5,,SING,CAA,HAAA,no,N,5,,67302,17408,L8H
6,,SING,CAA,HAAB,no,N,6,,67302,17408,L8H
7,,DOUB,CAF,CAG,no,N,7,,67302,17408,L8H
8,,SING,CAF,CAH,yes,N,8,,67302,17408,L8H
9,,SING,CAF,HAF,yes,N,9,,67302,17408,L8H
10,,SING,CAG,CAI,no,N,10,,67302,17408,L8H
11,,SING,CAG,HAG,yes,N,11,,67302,17408,L8H
12,,DOUB,CAH,CAV,no,N,12,,67302,17408,L8H
13,,SING,CAH,HAH,yes,N,13,,67302,17408,L8H
14,,DOUB,CAI,CAW,no,N,14,,67302,17408,L8H
15,,SING,CAI,HAI,yes,N,15,,67302,17408,L8H
16,,SING,CAJ,CAT,no,N,16,,67302,17408,L8H
17,,DOUB,CAJ,CAU,yes,N,17,,67302,17408,L8H
18,,SING,CAJ,HAJ,yes,N,18,,67302,17408,L8H
19,,DOUB,CAK,CAT,no,N,19,,67302,17408,L8H
20,,SING,CAK,CAV,yes,N,20,,67302,17408,L8H
21,,SING,CAK,HAK,yes,N,21,,67302,17408,L8H
22,,SING,OAQ,CAU,no,N,22,,67302,17408,L8H
23,,SING,CAU,CAW,no,N,23,,67302,17408,L8H
24,,SING,CAV,CAW,yes,N,24,,67302,17408,L8H
25,,SING,N,H11,yes,N,25,,67302,17408,L8H
1,,SING,O5',C5',no,N,1,,67322,17409,TAL
2,,SING,O5',H5',no,N,2,,67322,17409,TAL
3,,SING,C5',C6',no,N,3,,67322,17409,TAL
4,,SING,C5',C4',no,N,4,,67322,17409,TAL
5,,SING,C5',H1,no,N,5,,67322,17409,TAL
6,,SING,C6',H6'1,no,N,6,,67322,17409,TAL
7,,SING,C6',H6'2,no,N,7,,67322,17409,TAL
8,,SING,C6',H6'3,no,N,8,,67322,17409,TAL
9,,SING,C4',O4',no,N,9,,67322,17409,TAL
10,,SING,C4',C3',no,N,10,,67322,17409,TAL
11,,SING,C4',H4',no,N,11,,67322,17409,TAL
12,,SING,O4',C1',no,N,12,,67322,17409,TAL
13,,SING,C1',N9,no,N,13,,67322,17409,TAL
14,,SING,C1',C2',no,N,14,,67322,17409,TAL
15,,SING,C1',H1',no,N,15,,67322,17409,TAL
16,,SING,N9,C8,yes,N,16,,67322,17409,TAL
17,,SING,N9,C4,yes,N,17,,67322,17409,TAL
18,,DOUB,C8,N7,yes,N,18,,67322,17409,TAL
19,,SING,C8,H8,no,N,19,,67322,17409,TAL
20,,SING,N7,C5,yes,N,20,,67322,17409,TAL
21,,DOUB,C5,C4,yes,N,21,,67322,17409,TAL
22,,SING,C5,C6,yes,N,22,,67322,17409,TAL
23,,SING,C4,N3,yes,N,23,,67322,17409,TAL
24,,DOUB,N3,C2,yes,N,24,,67322,17409,TAL
25,,SING,C2,N1,yes,N,25,,67322,17409,TAL
26,,SING,C2,H2,no,N,26,,67322,17409,TAL
27,,DOUB,N1,C6,yes,N,27,,67322,17409,TAL
28,,SING,C6,C7,no,N,28,,67322,17409,TAL
29,,SING,C7,H71,no,N,29,,67322,17409,TAL
30,,SING,C7,H72,no,N,30,,67322,17409,TAL
31,,SING,C7,H73,no,N,31,,67322,17409,TAL
32,,SING,C2',O2',no,N,32,,67322,17409,TAL
33,,SING,C2',C3',no,N,33,,67322,17409,TAL
34,,SING,C2',H2',no,N,34,,67322,17409,TAL
35,,SING,O2',H3,no,N,35,,67322,17409,TAL
36,,SING,C3',O3',no,N,36,,67322,17409,TAL
37,,SING,C3',H3',no,N,37,,67322,17409,TAL
38,,SING,O3',H4,no,N,38,,67322,17409,TAL
1,,SING,N,CA,no,N,1,,67403,17413,TRP
2,,SING,N,H,no,N,2,,67403,17413,TRP
3,,SING,N,H2,no,N,3,,67403,17413,TRP
4,,SING,CA,C,no,N,4,,67403,17413,TRP
5,,SING,CA,CB,no,N,5,,67403,17413,TRP
6,,SING,CA,HA,no,N,6,,67403,17413,TRP
7,,DOUB,C,O,no,N,7,,67403,17413,TRP
8,,SING,C,OXT,no,N,8,,67403,17413,TRP
9,,SING,CB,CG,no,N,9,,67403,17413,TRP
10,,SING,CB,HB2,no,N,10,,67403,17413,TRP
11,,SING,CB,HB3,no,N,11,,67403,17413,TRP
12,,DOUB,CG,CD1,yes,N,12,,67403,17413,TRP
13,,SING,CG,CD2,yes,N,13,,67403,17413,TRP
14,,SING,CD1,NE1,yes,N,14,,67403,17413,TRP
15,,SING,CD1,HD1,no,N,15,,67403,17413,TRP
16,,DOUB,CD2,CE2,yes,N,16,,67403,17413,TRP
17,,SING,CD2,CE3,yes,N,17,,67403,17413,TRP
18,,SING,NE1,CE2,yes,N,18,,67403,17413,TRP
19,,SING,NE1,HE1,no,N,19,,67403,17413,TRP
20,,SING,CE2,CZ2,yes,N,20,,67403,17413,TRP
21,,DOUB,CE3,CZ3,yes,N,21,,67403,17413,TRP
22,,SING,CE3,HE3,no,N,22,,67403,17413,TRP
23,,DOUB,CZ2,CH2,yes,N,23,,67403,17413,TRP
24,,SING,CZ2,HZ2,no,N,24,,67403,17413,TRP
25,,SING,CZ3,CH2,yes,N,25,,67403,17413,TRP
26,,SING,CZ3,HZ3,no,N,26,,67403,17413,TRP
27,,SING,CH2,HH2,no,N,27,,67403,17413,TRP
28,,SING,OXT,HXT,no,N,28,,67403,17413,TRP
1,,SING,CHA,C1A,yes,N,1,,67436,17415,HEM
2,,DOUB,CHA,C4D,yes,N,2,,67436,17415,HEM
3,,SING,CHA,HHA,no,N,3,,67436,17415,HEM
4,,SING,CHB,C4A,yes,N,4,,67436,17415,HEM
5,,DOUB,CHB,C1B,yes,N,5,,67436,17415,HEM
6,,SING,CHB,HHB,no,N,6,,67436,17415,HEM
7,,SING,CHC,C4B,yes,N,7,,67436,17415,HEM
8,,DOUB,CHC,C1C,yes,N,8,,67436,17415,HEM
9,,SING,CHC,HHC,no,N,9,,67436,17415,HEM
10,,DOUB,CHD,C4C,yes,N,10,,67436,17415,HEM
11,,SING,CHD,C1D,yes,N,11,,67436,17415,HEM
12,,SING,CHD,HHD,no,N,12,,67436,17415,HEM
13,,DOUB,C1A,C2A,yes,N,13,,67436,17415,HEM
14,,SING,C1A,NA,yes,N,14,,67436,17415,HEM
15,,SING,C2A,C3A,yes,N,15,,67436,17415,HEM
16,,SING,C2A,CAA,no,N,16,,67436,17415,HEM
17,,DOUB,C3A,C4A,yes,N,17,,67436,17415,HEM
18,,SING,C3A,CMA,no,N,18,,67436,17415,HEM
19,,SING,C4A,NA,yes,N,19,,67436,17415,HEM
20,,SING,CMA,HMA,no,N,20,,67436,17415,HEM
21,,SING,CMA,HMAA,no,N,21,,67436,17415,HEM
22,,SING,CMA,HMAB,no,N,22,,67436,17415,HEM
23,,SING,CAA,CBA,no,N,23,,67436,17415,HEM
24,,SING,CAA,HAA,no,N,24,,67436,17415,HEM
25,,SING,CAA,HAAA,no,N,25,,67436,17415,HEM
26,,SING,CBA,CGA,no,N,26,,67436,17415,HEM
27,,SING,CBA,HBA,no,N,27,,67436,17415,HEM
28,,SING,CBA,HBAA,no,N,28,,67436,17415,HEM
29,,DOUB,CGA,O1A,no,N,29,,67436,17415,HEM
30,,SING,CGA,O2A,no,N,30,,67436,17415,HEM
31,,SING,C1B,C2B,no,N,31,,67436,17415,HEM
32,,SING,C1B,NB,yes,N,32,,67436,17415,HEM
33,,DOUB,C2B,C3B,yes,N,33,,67436,17415,HEM
34,,SING,C2B,CMB,yes,N,34,,67436,17415,HEM
35,,SING,C3B,C4B,no,N,35,,67436,17415,HEM
36,,SING,C3B,CAB,yes,N,36,,67436,17415,HEM
37,,DOUB,C4B,NB,no,N,37,,67436,17415,HEM
38,,SING,CMB,HMB,yes,N,38,,67436,17415,HEM
39,,SING,CMB,HMBA,no,N,39,,67436,17415,HEM
40,,SING,CMB,HMBB,no,N,40,,67436,17415,HEM
41,,DOUB,CAB,CBB,no,N,41,,67436,17415,HEM
42,,SING,CAB,HAB,no,N,42,,67436,17415,HEM
43,,SING,CBB,HBB,no,N,43,,67436,17415,HEM
44,,SING,CBB,HBBA,no,N,44,,67436,17415,HEM
45,,SING,C1C,C2C,no,N,45,,67436,17415,HEM
46,,SING,C1C,NC,yes,N,46,,67436,17415,HEM
47,,DOUB,C2C,C3C,yes,N,47,,67436,17415,HEM
48,,SING,C2C,CMC,yes,N,48,,67436,17415,HEM
49,,SING,C3C,C4C,no,N,49,,67436,17415,HEM
50,,SING,C3C,CAC,yes,N,50,,67436,17415,HEM
51,,SING,C4C,NC,no,N,51,,67436,17415,HEM
52,,SING,CMC,HMC,yes,N,52,,67436,17415,HEM
53,,SING,CMC,HMCA,no,N,53,,67436,17415,HEM
54,,SING,CMC,HMCB,no,N,54,,67436,17415,HEM
55,,DOUB,CAC,CBC,no,N,55,,67436,17415,HEM
56,,SING,CAC,HAC,no,N,56,,67436,17415,HEM
57,,SING,CBC,HBC,no,N,57,,67436,17415,HEM
58,,SING,CBC,HBCA,no,N,58,,67436,17415,HEM
59,,SING,C1D,C2D,no,N,59,,67436,17415,HEM
60,,DOUB,C1D,ND,yes,N,60,,67436,17415,HEM
61,,DOUB,C2D,C3D,yes,N,61,,67436,17415,HEM
62,,SING,C2D,CMD,yes,N,62,,67436,17415,HEM
63,,SING,C3D,C4D,no,N,63,,67436,17415,HEM
64,,SING,C3D,CAD,yes,N,64,,67436,17415,HEM
65,,SING,C4D,ND,no,N,65,,67436,17415,HEM
66,,SING,CMD,HMD,yes,N,66,,67436,17415,HEM
67,,SING,CMD,HMDA,no,N,67,,67436,17415,HEM
68,,SING,CMD,HMDB,no,N,68,,67436,17415,HEM
69,,SING,CAD,CBD,no,N,69,,67436,17415,HEM
70,,SING,CAD,HAD,no,N,70,,67436,17415,HEM
71,,SING,CAD,HADA,no,N,71,,67436,17415,HEM
72,,SING,CBD,CGD,no,N,72,,67436,17415,HEM
73,,SING,CBD,HBD,no,N,73,,67436,17415,HEM
74,,SING,CBD,HBDA,no,N,74,,67436,17415,HEM
75,,DOUB,CGD,O1D,no,N,75,,67436,17415,HEM
76,,SING,CGD,O2D,no,N,76,,67436,17415,HEM
77,,SING,O2A,H2A,no,N,77,,67436,17415,HEM
78,,SING,O2D,H2D,no,N,78,,67436,17415,HEM
79,,SING,FE,NA,no,N,79,,67436,17415,HEM
80,,SING,FE,NB,no,N,80,,67436,17415,HEM
81,,SING,FE,NC,no,N,81,,67436,17415,HEM
82,,SING,FE,ND,no,N,82,,67436,17415,HEM
1,,SING,C1,C2,no,N,1,,67437,17415,CAM
2,,SING,C1,C6,no,N,2,,67437,17415,CAM
3,,SING,C1,C7,no,N,3,,67437,17415,CAM
4,,SING,C1,C10,no,N,4,,67437,17415,CAM
5,,DOUB,C2,O,no,N,5,,67437,17415,CAM
6,,SING,C2,C3,no,N,6,,67437,17415,CAM
7,,SING,C3,C4,no,N,7,,67437,17415,CAM
8,,SING,C3,H31,no,N,8,,67437,17415,CAM
9,,SING,C3,H32,no,N,9,,67437,17415,CAM
10,,SING,C4,C5,no,N,10,,67437,17415,CAM
11,,SING,C4,C7,no,N,11,,67437,17415,CAM
12,,SING,C4,H4,no,N,12,,67437,17415,CAM
13,,SING,C5,C6,no,N,13,,67437,17415,CAM
14,,SING,C5,H51,no,N,14,,67437,17415,CAM
15,,SING,C5,H52,no,N,15,,67437,17415,CAM
16,,SING,C6,H61,no,N,16,,67437,17415,CAM
17,,SING,C6,H62,no,N,17,,67437,17415,CAM
18,,SING,C7,C8,no,N,18,,67437,17415,CAM
19,,SING,C7,C9,no,N,19,,67437,17415,CAM
20,,SING,C8,H81,no,N,20,,67437,17415,CAM
21,,SING,C8,H82,no,N,21,,67437,17415,CAM
22,,SING,C8,H83,no,N,22,,67437,17415,CAM
23,,SING,C9,H91,no,N,23,,67437,17415,CAM
24,,SING,C9,H92,no,N,24,,67437,17415,CAM
25,,SING,C9,H93,no,N,25,,67437,17415,CAM
26,,SING,C10,H101,no,N,26,,67437,17415,CAM
27,,SING,C10,H102,no,N,27,,67437,17415,CAM
28,,SING,C10,H103,no,N,28,,67437,17415,CAM
1,,SING,CB2,CA2,no,N,1,,67457,17416,C90
2,,SING,CB2,N4,no,N,2,,67457,17416,C90
3,,DOUB,CC2,CD2,no,N,3,,67457,17416,C90
4,,SING,CC2,C6,no,N,4,,67457,17416,C90
5,,SING,CA2,O1,yes,N,5,,67457,17416,C90
6,,SING,C5,N4,no,N,6,,67457,17416,C90
7,,SING,C5,C6,yes,N,7,,67457,17416,C90
8,,SING,CD2,C9,no,N,8,,67457,17416,C90
9,,SING,N4,CB1,no,N,9,,67457,17416,C90
10,,DOUB,C6,CC1,no,N,10,,67457,17416,C90
11,,SING,O1,CA1,yes,N,11,,67457,17416,C90
12,,SING,C9,C10,no,N,12,,67457,17416,C90
13,,DOUB,C9,CD1,no,N,13,,67457,17416,C90
14,,SING,CB1,CA1,no,N,14,,67457,17416,C90
15,,DOUB,O22,C22,yes,N,15,,67457,17416,C90
16,,SING,CC1,CD1,no,N,16,,67457,17416,C90
17,,TRIP,C10,C11,no,N,17,,67457,17416,C90
18,,DOUB,CE1,CF1,no,N,18,,67457,17416,C90
19,,SING,CE1,C12,no,N,19,,67457,17416,C90
20,,SING,C11,C12,no,N,20,,67457,17416,C90
21,,SING,C21,C19,no,N,21,,67457,17416,C90
22,,SING,CF1,C15,no,N,22,,67457,17416,C90
23,,DOUB,C12,CE2,no,N,23,,67457,17416,C90
24,,SING,O24,N23,no,N,24,,67457,17416,C90
25,,SING,C22,N23,no,N,25,,67457,17416,C90
26,,SING,C22,C18,no,N,26,,67457,17416,C90
27,,SING,N17,C18,no,N,27,,67457,17416,C90
28,,SING,N17,C16,no,N,28,,67457,17416,C90
29,,SING,C15,C16,no,N,29,,67457,17416,C90
30,,DOUB,C15,CF,no,N,30,,67457,17416,C90
31,,SING,CE2,CF,no,N,31,,67457,17416,C90
32,,SING,C18,C19,no,N,32,,67457,17416,C90
33,,SING,C19,O20,no,N,33,,67457,17416,C90
34,,DOUB,C16,O16,no,N,34,,67457,17416,C90
35,,SING,C5,H51,no,N,35,,67457,17416,C90
36,,SING,C5,H52,no,N,36,,67457,17416,C90
37,,SING,C19,H19,no,N,37,,67457,17416,C90
38,,SING,C18,H18,yes,N,38,,67457,17416,C90
39,,SING,C21,H211,no,N,39,,67457,17416,C90
40,,SING,C21,H212,yes,N,40,,67457,17416,C90
41,,SING,C21,H213,yes,N,41,,67457,17416,C90
42,,SING,CA1,HA11,no,N,42,,67457,17416,C90
43,,SING,CA1,HA12,no,N,43,,67457,17416,C90
44,,SING,CA2,HA21,yes,N,44,,67457,17416,C90
45,,SING,CA2,HA22,no,N,45,,67457,17416,C90
46,,SING,CB1,HB11,yes,N,46,,67457,17416,C90
47,,SING,CB1,HB12,yes,N,47,,67457,17416,C90
48,,SING,CB2,HB21,no,N,48,,67457,17416,C90
49,,SING,CB2,HB22,yes,N,49,,67457,17416,C90
50,,SING,CC1,HC1,no,N,50,,67457,17416,C90
51,,SING,CC2,HC2,yes,N,51,,67457,17416,C90
52,,SING,CD1,HD1,no,N,52,,67457,17416,C90
53,,SING,CD2,HD2,no,N,53,,67457,17416,C90
54,,SING,CE1,HE1,no,N,54,,67457,17416,C90
55,,SING,CE2,HE2,no,N,55,,67457,17416,C90
56,,SING,CF1,HF1,no,N,56,,67457,17416,C90
57,,SING,CF,HF,no,N,57,,67457,17416,C90
58,,SING,N17,HN17,no,N,58,,67457,17416,C90
59,,SING,O20,HO20,no,N,59,,67457,17416,C90
60,,SING,N23,HN23,no,N,60,,67457,17416,C90
61,,SING,O24,HO24,no,N,61,,67457,17416,C90
1,,SING,N1,C2,yes,N,1,,67548,17421,APR
2,,DOUB,N1,C6,yes,N,2,,67548,17421,APR
3,,DOUB,C2,N3,yes,N,3,,67548,17421,APR
4,,SING,C2,H2,no,N,4,,67548,17421,APR
5,,SING,N3,C4,yes,N,5,,67548,17421,APR
6,,DOUB,C4,C5,yes,N,6,,67548,17421,APR
7,,SING,C4,N9,yes,N,7,,67548,17421,APR
8,,SING,C5,C6,yes,N,8,,67548,17421,APR
9,,SING,C5,N7,yes,N,9,,67548,17421,APR
10,,SING,C6,N6,no,N,10,,67548,17421,APR
11,,SING,N6,H61,no,N,11,,67548,17421,APR
12,,SING,N6,H62,no,N,12,,67548,17421,APR
13,,DOUB,N7,C8,yes,N,13,,67548,17421,APR
14,,SING,C8,N9,yes,N,14,,67548,17421,APR
15,,SING,C8,H8,no,N,15,,67548,17421,APR
16,,SING,N9,C1',no,N,16,,67548,17421,APR
17,,SING,C1',C2',no,N,17,,67548,17421,APR
18,,SING,C1',O4',no,N,18,,67548,17421,APR
19,,SING,C1',H'1,no,N,19,,67548,17421,APR
20,,SING,C2',O2',no,N,20,,67548,17421,APR
21,,SING,C2',C3',no,N,21,,67548,17421,APR
22,,SING,C2',H'2,no,N,22,,67548,17421,APR
23,,SING,O2',HO'2,no,N,23,,67548,17421,APR
24,,SING,C3',O3',no,N,24,,67548,17421,APR
25,,SING,C3',C4',no,N,25,,67548,17421,APR
26,,SING,C3',H'3,no,N,26,,67548,17421,APR
27,,SING,O3',HO'3,no,N,27,,67548,17421,APR
28,,SING,O4',C4',no,N,28,,67548,17421,APR
29,,SING,C4',C5',no,N,29,,67548,17421,APR
30,,SING,C4',H'4,no,N,30,,67548,17421,APR
31,,SING,C5',O5',no,N,31,,67548,17421,APR
32,,SING,C5',H5'1,no,N,32,,67548,17421,APR
33,,SING,C5',H5'2,no,N,33,,67548,17421,APR
34,,SING,O5',PA,no,N,34,,67548,17421,APR
35,,DOUB,PA,O1A,no,N,35,,67548,17421,APR
36,,SING,PA,O2A,no,N,36,,67548,17421,APR
37,,SING,PA,O3A,no,N,37,,67548,17421,APR
38,,SING,O2A,HOA2,no,N,38,,67548,17421,APR
39,,SING,O3A,PB,no,N,39,,67548,17421,APR
40,,DOUB,PB,O1B,no,N,40,,67548,17421,APR
41,,SING,PB,O2B,no,N,41,,67548,17421,APR
42,,SING,PB,O5D,no,N,42,,67548,17421,APR
43,,SING,O2B,HOB2,no,N,43,,67548,17421,APR
44,,SING,O5D,C5D,no,N,44,,67548,17421,APR
45,,SING,C5D,C4D,no,N,45,,67548,17421,APR
46,,SING,C5D,H5R1,no,N,46,,67548,17421,APR
47,,SING,C5D,H5R2,no,N,47,,67548,17421,APR
48,,SING,O4D,C1D,no,N,48,,67548,17421,APR
49,,SING,O4D,C4D,no,N,49,,67548,17421,APR
50,,SING,O1D,C1D,no,N,50,,67548,17421,APR
51,,SING,O1D,HOR1,no,N,51,,67548,17421,APR
52,,SING,C1D,C2D,no,N,52,,67548,17421,APR
53,,SING,C1D,HR'1,no,N,53,,67548,17421,APR
54,,SING,O2D,C2D,no,N,54,,67548,17421,APR
55,,SING,O2D,HOR2,no,N,55,,67548,17421,APR
56,,SING,C2D,C3D,no,N,56,,67548,17421,APR
57,,SING,C2D,HR'2,no,N,57,,67548,17421,APR
58,,SING,O3D,C3D,no,N,58,,67548,17421,APR
59,,SING,O3D,HOR3,no,N,59,,67548,17421,APR
60,,SING,C3D,C4D,no,N,60,,67548,17421,APR
61,,SING,C3D,HR'3,no,N,61,,67548,17421,APR
62,,SING,C4D,HR'4,no,N,62,,67548,17421,APR
1,,SING,P,C4',no,N,1,,67569,17422,L8P
2,,SING,P,OP1,no,N,2,,67569,17422,L8P
3,,DOUB,P,OP2,no,N,3,,67569,17422,L8P
4,,SING,N1,C2,no,N,4,,67569,17422,L8P
5,,SING,N1,C6,no,N,5,,67569,17422,L8P
6,,SING,N1,C1',no,N,6,,67569,17422,L8P
7,,DOUB,C2,O2,no,N,7,,67569,17422,L8P
8,,SING,C2,N3,no,N,8,,67569,17422,L8P
9,,DOUB,N3,C4,no,N,9,,67569,17422,L8P
10,,SING,C4,N4,no,N,10,,67569,17422,L8P
11,,SING,C4,C5,no,N,11,,67569,17422,L8P
12,,SING,N4,HN4,no,N,12,,67569,17422,L8P
13,,SING,N4,HN4A,no,N,13,,67569,17422,L8P
14,,DOUB,C5,C6,no,N,14,,67569,17422,L8P
15,,SING,C5,H5,no,N,15,,67569,17422,L8P
16,,SING,C6,H6,no,N,16,,67569,17422,L8P
17,,SING,C1',C2',no,N,17,,67569,17422,L8P
18,,SING,C1',H1',no,N,18,,67569,17422,L8P
19,,SING,C1',H1'A,no,N,19,,67569,17422,L8P
20,,SING,C2',C3',no,N,20,,67569,17422,L8P
21,,SING,C2',O4',no,N,21,,67569,17422,L8P
22,,SING,C2',H2',no,N,22,,67569,17422,L8P
23,,SING,C3',O3',no,N,23,,67569,17422,L8P
24,,SING,C3',H3',no,N,24,,67569,17422,L8P
25,,SING,C3',H3'A,no,N,25,,67569,17422,L8P
26,,SING,C4',O4',no,N,26,,67569,17422,L8P
27,,SING,C4',H4',no,N,27,,67569,17422,L8P
28,,SING,C4',H4'A,no,N,28,,67569,17422,L8P
29,,SING,P,O6,no,N,29,,67569,17422,L8P
30,,SING,O3',H12,no,N,30,,67569,17422,L8P
31,,SING,OP1,H13,no,N,31,,67569,17422,L8P
32,,SING,O6,H14,no,N,32,,67569,17422,L8P
1,,DOUB,C1,O1,no,N,1,,67778,17432,MYR
2,,SING,C1,O2,no,N,2,,67778,17432,MYR
3,,SING,C1,C2,no,N,3,,67778,17432,MYR
4,,SING,O2,HO2,no,N,4,,67778,17432,MYR
5,,SING,C2,C3,no,N,5,,67778,17432,MYR
6,,SING,C2,H21,no,N,6,,67778,17432,MYR
7,,SING,C2,H22,no,N,7,,67778,17432,MYR
8,,SING,C3,C4,no,N,8,,67778,17432,MYR
9,,SING,C3,H31,no,N,9,,67778,17432,MYR
10,,SING,C3,H32,no,N,10,,67778,17432,MYR
11,,SING,C4,C5,no,N,11,,67778,17432,MYR
12,,SING,C4,H41,no,N,12,,67778,17432,MYR
13,,SING,C4,H42,no,N,13,,67778,17432,MYR
14,,SING,C5,C6,no,N,14,,67778,17432,MYR
15,,SING,C5,H51,no,N,15,,67778,17432,MYR
16,,SING,C5,H52,no,N,16,,67778,17432,MYR
17,,SING,C6,C7,no,N,17,,67778,17432,MYR
18,,SING,C6,H61,no,N,18,,67778,17432,MYR
19,,SING,C6,H62,no,N,19,,67778,17432,MYR
20,,SING,C7,C8,no,N,20,,67778,17432,MYR
21,,SING,C7,H71,no,N,21,,67778,17432,MYR
22,,SING,C7,H72,no,N,22,,67778,17432,MYR
23,,SING,C8,C9,no,N,23,,67778,17432,MYR
24,,SING,C8,H81,no,N,24,,67778,17432,MYR
25,,SING,C8,H82,no,N,25,,67778,17432,MYR
26,,SING,C9,C10,no,N,26,,67778,17432,MYR
27,,SING,C9,H91,no,N,27,,67778,17432,MYR
28,,SING,C9,H92,no,N,28,,67778,17432,MYR
29,,SING,C10,C11,no,N,29,,67778,17432,MYR
30,,SING,C10,H101,no,N,30,,67778,17432,MYR
31,,SING,C10,H102,no,N,31,,67778,17432,MYR
32,,SING,C11,C12,no,N,32,,67778,17432,MYR
33,,SING,C11,H111,no,N,33,,67778,17432,MYR
34,,SING,C11,H112,no,N,34,,67778,17432,MYR
35,,SING,C12,C13,no,N,35,,67778,17432,MYR
36,,SING,C12,H121,no,N,36,,67778,17432,MYR
37,,SING,C12,H122,no,N,37,,67778,17432,MYR
38,,SING,C13,C14,no,N,38,,67778,17432,MYR
39,,SING,C13,H131,no,N,39,,67778,17432,MYR
40,,SING,C13,H132,no,N,40,,67778,17432,MYR
41,,SING,C14,H141,no,N,41,,67778,17432,MYR
42,,SING,C14,H142,no,N,42,,67778,17432,MYR
43,,SING,C14,H143,no,N,43,,67778,17432,MYR
1,,DOUB,C1,C2,yes,N,1,,67836,17436,L94
2,,SING,C1,C6,yes,N,2,,67836,17436,L94
3,,SING,C1,C11,no,N,3,,67836,17436,L94
4,,SING,C2,C3,yes,N,4,,67836,17436,L94
5,,SING,C2,H2,no,N,5,,67836,17436,L94
6,,DOUB,C3,C4,yes,N,6,,67836,17436,L94
7,,SING,C3,H3,no,N,7,,67836,17436,L94
8,,SING,C4,C5,yes,N,8,,67836,17436,L94
9,,SING,C4,C14,no,N,9,,67836,17436,L94
10,,DOUB,C5,C6,yes,N,10,,67836,17436,L94
11,,SING,C5,H5,no,N,11,,67836,17436,L94
12,,SING,C6,H6,no,N,12,,67836,17436,L94
13,,SING,C11,N111,no,N,13,,67836,17436,L94
14,,DOUB,C11,N21,no,N,14,,67836,17436,L94
15,,SING,N111,H111,no,N,15,,67836,17436,L94
16,,SING,N111,H11A,no,N,16,,67836,17436,L94
17,,SING,N114,C14,no,N,17,,67836,17436,L94
18,,SING,N114,H411,no,N,18,,67836,17436,L94
19,,SING,N114,H41A,no,N,19,,67836,17436,L94
20,,DOUB,C14,N24,no,N,20,,67836,17436,L94
21,,SING,N21,C31,no,N,21,,67836,17436,L94
22,,SING,N21,H121,no,N,22,,67836,17436,L94
23,,SING,N24,C34,no,N,23,,67836,17436,L94
24,,SING,N24,H424,no,N,24,,67836,17436,L94
25,,SING,C31,C41,no,N,25,,67836,17436,L94
26,,SING,C31,H131,no,N,26,,67836,17436,L94
27,,SING,C31,H13A,no,N,27,,67836,17436,L94
28,,SING,C34,C44,no,N,28,,67836,17436,L94
29,,SING,C34,H434,no,N,29,,67836,17436,L94
30,,SING,C34,H43A,no,N,30,,67836,17436,L94
31,,SING,C41,C51,no,N,31,,67836,17436,L94
32,,SING,C41,H141,no,N,32,,67836,17436,L94
33,,SING,C41,H14A,no,N,33,,67836,17436,L94
34,,SING,C44,C54,no,N,34,,67836,17436,L94
35,,SING,C44,H444,no,N,35,,67836,17436,L94
36,,SING,C44,H44A,no,N,36,,67836,17436,L94
37,,SING,C51,N61,no,N,37,,67836,17436,L94
38,,SING,C51,H151,no,N,38,,67836,17436,L94
39,,SING,C51,H15A,no,N,39,,67836,17436,L94
40,,SING,C54,N64,no,N,40,,67836,17436,L94
41,,SING,C54,H454,no,N,41,,67836,17436,L94
42,,SING,C54,H45A,no,N,42,,67836,17436,L94
43,,SING,N61,C71,no,N,43,,67836,17436,L94
44,,SING,N61,C81,no,N,44,,67836,17436,L94
45,,SING,N61,H161,no,N,45,,67836,17436,L94
46,,SING,N64,C74,no,N,46,,67836,17436,L94
47,,SING,N64,C84,no,N,47,,67836,17436,L94
48,,SING,N64,H464,no,N,48,,67836,17436,L94
49,,SING,C71,H171,no,N,49,,67836,17436,L94
50,,SING,C71,H17A,no,N,50,,67836,17436,L94
51,,SING,C71,H17B,no,N,51,,67836,17436,L94
52,,SING,C74,H474,no,N,52,,67836,17436,L94
53,,SING,C74,H47A,no,N,53,,67836,17436,L94
54,,SING,C74,H47B,no,N,54,,67836,17436,L94
55,,SING,C81,H181,no,N,55,,67836,17436,L94
56,,SING,C81,H18A,no,N,56,,67836,17436,L94
57,,SING,C81,H18B,no,N,57,,67836,17436,L94
58,,SING,C84,H484,no,N,58,,67836,17436,L94
59,,SING,C84,H48A,no,N,59,,67836,17436,L94
60,,SING,C84,H48B,no,N,60,,67836,17436,L94
1,,DOUB,C1,C2,yes,N,1,,67935,17440,STL
2,,SING,C1,C6,yes,N,2,,67935,17440,STL
3,,SING,C1,O3,no,N,3,,67935,17440,STL
4,,SING,C2,C3,yes,N,4,,67935,17440,STL
5,,SING,C2,H2,no,N,5,,67935,17440,STL
6,,DOUB,C3,C4,yes,N,6,,67935,17440,STL
7,,SING,C3,O2,no,N,7,,67935,17440,STL
8,,SING,C4,C5,yes,N,8,,67935,17440,STL
9,,SING,C4,H4,no,N,9,,67935,17440,STL
10,,DOUB,C5,C6,yes,N,10,,67935,17440,STL
11,,SING,C5,C7,no,N,11,,67935,17440,STL
12,,SING,C6,H6,no,N,12,,67935,17440,STL
13,,DOUB,C7,C8,no,E,13,,67935,17440,STL
14,,SING,C7,H7,no,N,14,,67935,17440,STL
15,,SING,C8,C9,no,N,15,,67935,17440,STL
16,,SING,C8,H8,no,N,16,,67935,17440,STL
17,,DOUB,C9,C10,yes,N,17,,67935,17440,STL
18,,SING,C9,C14,yes,N,18,,67935,17440,STL
19,,SING,C10,C11,yes,N,19,,67935,17440,STL
20,,SING,C10,H10,no,N,20,,67935,17440,STL
21,,DOUB,C11,C12,yes,N,21,,67935,17440,STL
22,,SING,C11,H11,no,N,22,,67935,17440,STL
23,,SING,C12,C13,yes,N,23,,67935,17440,STL
24,,SING,C12,O1,no,N,24,,67935,17440,STL
25,,DOUB,C13,C14,yes,N,25,,67935,17440,STL
26,,SING,C13,H13,no,N,26,,67935,17440,STL
27,,SING,C14,H14,no,N,27,,67935,17440,STL
28,,SING,O1,HO1,no,N,28,,67935,17440,STL
29,,SING,O2,HO2,no,N,29,,67935,17440,STL
30,,SING,O3,HO3,no,N,30,,67935,17440,STL
1,,SING,N1,C2,no,N,1,,68099,17449,70U
2,,SING,N1,C6,no,N,2,,68099,17449,70U
3,,SING,N1,C1',no,N,3,,68099,17449,70U
4,,DOUB,C2,S2,no,N,4,,68099,17449,70U
5,,SING,C2,N3,no,N,5,,68099,17449,70U
6,,SING,N3,C4,no,N,6,,68099,17449,70U
7,,SING,N3,HN3,no,N,7,,68099,17449,70U
8,,DOUB,C4,O4,no,N,8,,68099,17449,70U
9,,SING,C4,C5,no,N,9,,68099,17449,70U
10,,DOUB,C5,C6,no,N,10,,68099,17449,70U
11,,SING,C5,C5M,no,N,11,,68099,17449,70U
12,,SING,C6,H6,no,N,12,,68099,17449,70U
13,,SING,C5M,C8,no,N,13,,68099,17449,70U
14,,SING,C5M,H71,no,N,14,,68099,17449,70U
15,,SING,C5M,H72,no,N,15,,68099,17449,70U
16,,DOUB,C8,O8,no,N,16,,68099,17449,70U
17,,SING,C8,O9,no,N,17,,68099,17449,70U
18,,SING,O9,C9,no,N,18,,68099,17449,70U
19,,SING,C9,H91,no,N,19,,68099,17449,70U
20,,SING,C9,H92,no,N,20,,68099,17449,70U
21,,SING,C9,H93,no,N,21,,68099,17449,70U
22,,SING,C1',C2',no,N,22,,68099,17449,70U
23,,SING,C1',O4',no,N,23,,68099,17449,70U
24,,SING,C1',H1',no,N,24,,68099,17449,70U
25,,SING,O2',C2',no,N,25,,68099,17449,70U
26,,SING,O2',HO2',no,N,26,,68099,17449,70U
27,,SING,C2',C3',no,N,27,,68099,17449,70U
28,,SING,C2',H2',no,N,28,,68099,17449,70U
29,,SING,O3',C3',no,N,29,,68099,17449,70U
30,,SING,O3',HO3',no,N,30,,68099,17449,70U
31,,SING,C3',C4',no,N,31,,68099,17449,70U
32,,SING,C3',H3',no,N,32,,68099,17449,70U
33,,SING,C4',O4',no,N,33,,68099,17449,70U
34,,SING,C4',C5',no,N,34,,68099,17449,70U
35,,SING,C4',H4',no,N,35,,68099,17449,70U
36,,SING,C5',O5',no,N,36,,68099,17449,70U
37,,SING,C5',H5',no,N,37,,68099,17449,70U
38,,SING,C5',H5'',no,N,38,,68099,17449,70U
39,,SING,O5',P,no,N,39,,68099,17449,70U
40,,DOUB,P,OP1,no,N,40,,68099,17449,70U
41,,SING,P,OP2,no,N,41,,68099,17449,70U
42,,SING,P,OP3,no,N,42,,68099,17449,70U
43,,SING,OP2,HOP2,no,N,43,,68099,17449,70U
44,,SING,OP3,HOP3,no,N,44,,68099,17449,70U
1,,SING,OP3,P,no,N,1,,68100,17449,12A
2,,SING,OP3,HOP3,no,N,2,,68100,17449,12A
3,,DOUB,P,OP1,no,N,3,,68100,17449,12A
4,,SING,P,OP2,no,N,4,,68100,17449,12A
5,,SING,P,O5',no,N,5,,68100,17449,12A
6,,SING,OP2,HOP2,no,N,6,,68100,17449,12A
7,,SING,O5',C5',no,N,7,,68100,17449,12A
8,,SING,C5',C4',no,N,8,,68100,17449,12A
9,,SING,C5',H5',no,N,9,,68100,17449,12A
10,,SING,C5',H5'',no,N,10,,68100,17449,12A
11,,SING,C4',O4',no,N,11,,68100,17449,12A
12,,SING,C4',C3',no,N,12,,68100,17449,12A
13,,SING,C4',H4',no,N,13,,68100,17449,12A
14,,SING,O4',C1',no,N,14,,68100,17449,12A
15,,SING,C3',O3',no,N,15,,68100,17449,12A
16,,SING,C3',C2',no,N,16,,68100,17449,12A
17,,SING,C3',H3',no,N,17,,68100,17449,12A
18,,SING,O3',HO3',no,N,18,,68100,17449,12A
19,,SING,C2',O2',no,N,19,,68100,17449,12A
20,,SING,C2',C1',no,N,20,,68100,17449,12A
21,,SING,C2',H2',no,N,21,,68100,17449,12A
22,,SING,O2',HO2',no,N,22,,68100,17449,12A
23,,SING,C1',N9,no,N,23,,68100,17449,12A
24,,SING,C1',H1',no,N,24,,68100,17449,12A
25,,SING,N9,C8,yes,N,25,,68100,17449,12A
26,,SING,N9,C4,yes,N,26,,68100,17449,12A
27,,DOUB,C8,N7,yes,N,27,,68100,17449,12A
28,,SING,C8,H8,no,N,28,,68100,17449,12A
29,,SING,N7,C5,yes,N,29,,68100,17449,12A
30,,SING,C5,C6,yes,N,30,,68100,17449,12A
31,,DOUB,C5,C4,yes,N,31,,68100,17449,12A
32,,SING,C6,N6,no,N,32,,68100,17449,12A
33,,DOUB,C6,N1,yes,N,33,,68100,17449,12A
34,,SING,N6,CC,no,N,34,,68100,17449,12A
35,,SING,N6,HN6,no,N,35,,68100,17449,12A
36,,SING,N1,C2,yes,N,36,,68100,17449,12A
37,,DOUB,C2,N3,yes,N,37,,68100,17449,12A
38,,SING,C2,S2,no,N,38,,68100,17449,12A
39,,SING,N3,C4,yes,N,39,,68100,17449,12A
40,,SING,S2,C2M,no,N,40,,68100,17449,12A
41,,SING,C2M,H2M1,no,N,41,,68100,17449,12A
42,,SING,C2M,H2M2,no,N,42,,68100,17449,12A
43,,SING,C2M,H2M3,no,N,43,,68100,17449,12A
44,,DOUB,CC,OO,no,N,44,,68100,17449,12A
45,,SING,CC,N,no,N,45,,68100,17449,12A
46,,SING,N,CA,no,N,46,,68100,17449,12A
47,,SING,N,H,no,N,47,,68100,17449,12A
48,,SING,CA,C,no,N,48,,68100,17449,12A
49,,SING,CA,CB,no,N,49,,68100,17449,12A
50,,SING,CA,HA,no,N,50,,68100,17449,12A
51,,DOUB,C,O,no,N,51,,68100,17449,12A
52,,SING,C,OXT,no,N,52,,68100,17449,12A
53,,SING,OXT,HXT,no,N,53,,68100,17449,12A
54,,SING,CB,OG1,no,N,54,,68100,17449,12A
55,,SING,CB,CG2,no,N,55,,68100,17449,12A
56,,SING,CB,HB,no,N,56,,68100,17449,12A
57,,SING,OG1,HG1,no,N,57,,68100,17449,12A
58,,SING,CG2,HG21,no,N,58,,68100,17449,12A
59,,SING,CG2,HG22,no,N,59,,68100,17449,12A
60,,SING,CG2,HG23,no,N,60,,68100,17449,12A
1,,SING,CHA,C1A,yes,N,1,,68265,17457,HEM
2,,DOUB,CHA,C4D,yes,N,2,,68265,17457,HEM
3,,SING,CHA,HHA,no,N,3,,68265,17457,HEM
4,,SING,CHB,C4A,yes,N,4,,68265,17457,HEM
5,,DOUB,CHB,C1B,yes,N,5,,68265,17457,HEM
6,,SING,CHB,HHB,no,N,6,,68265,17457,HEM
7,,SING,CHC,C4B,yes,N,7,,68265,17457,HEM
8,,DOUB,CHC,C1C,yes,N,8,,68265,17457,HEM
9,,SING,CHC,HHC,no,N,9,,68265,17457,HEM
10,,DOUB,CHD,C4C,yes,N,10,,68265,17457,HEM
11,,SING,CHD,C1D,yes,N,11,,68265,17457,HEM
12,,SING,CHD,HHD,no,N,12,,68265,17457,HEM
13,,DOUB,C1A,C2A,yes,N,13,,68265,17457,HEM
14,,SING,C1A,NA,yes,N,14,,68265,17457,HEM
15,,SING,C2A,C3A,yes,N,15,,68265,17457,HEM
16,,SING,C2A,CAA,no,N,16,,68265,17457,HEM
17,,DOUB,C3A,C4A,yes,N,17,,68265,17457,HEM
18,,SING,C3A,CMA,no,N,18,,68265,17457,HEM
19,,SING,C4A,NA,yes,N,19,,68265,17457,HEM
20,,SING,CMA,HMA,no,N,20,,68265,17457,HEM
21,,SING,CMA,HMAA,no,N,21,,68265,17457,HEM
22,,SING,CMA,HMAB,no,N,22,,68265,17457,HEM
23,,SING,CAA,CBA,no,N,23,,68265,17457,HEM
24,,SING,CAA,HAA,no,N,24,,68265,17457,HEM
25,,SING,CAA,HAAA,no,N,25,,68265,17457,HEM
26,,SING,CBA,CGA,no,N,26,,68265,17457,HEM
27,,SING,CBA,HBA,no,N,27,,68265,17457,HEM
28,,SING,CBA,HBAA,no,N,28,,68265,17457,HEM
29,,DOUB,CGA,O1A,no,N,29,,68265,17457,HEM
30,,SING,CGA,O2A,no,N,30,,68265,17457,HEM
31,,SING,C1B,C2B,no,N,31,,68265,17457,HEM
32,,SING,C1B,NB,yes,N,32,,68265,17457,HEM
33,,DOUB,C2B,C3B,yes,N,33,,68265,17457,HEM
34,,SING,C2B,CMB,yes,N,34,,68265,17457,HEM
35,,SING,C3B,C4B,no,N,35,,68265,17457,HEM
36,,SING,C3B,CAB,yes,N,36,,68265,17457,HEM
37,,DOUB,C4B,NB,no,N,37,,68265,17457,HEM
38,,SING,CMB,HMB,yes,N,38,,68265,17457,HEM
39,,SING,CMB,HMBA,no,N,39,,68265,17457,HEM
40,,SING,CMB,HMBB,no,N,40,,68265,17457,HEM
41,,DOUB,CAB,CBB,no,N,41,,68265,17457,HEM
42,,SING,CAB,HAB,no,N,42,,68265,17457,HEM
43,,SING,CBB,HBB,no,N,43,,68265,17457,HEM
44,,SING,CBB,HBBA,no,N,44,,68265,17457,HEM
45,,SING,C1C,C2C,no,N,45,,68265,17457,HEM
46,,SING,C1C,NC,yes,N,46,,68265,17457,HEM
47,,DOUB,C2C,C3C,yes,N,47,,68265,17457,HEM
48,,SING,C2C,CMC,yes,N,48,,68265,17457,HEM
49,,SING,C3C,C4C,no,N,49,,68265,17457,HEM
50,,SING,C3C,CAC,yes,N,50,,68265,17457,HEM
51,,SING,C4C,NC,no,N,51,,68265,17457,HEM
52,,SING,CMC,HMC,yes,N,52,,68265,17457,HEM
53,,SING,CMC,HMCA,no,N,53,,68265,17457,HEM
54,,SING,CMC,HMCB,no,N,54,,68265,17457,HEM
55,,DOUB,CAC,CBC,no,N,55,,68265,17457,HEM
56,,SING,CAC,HAC,no,N,56,,68265,17457,HEM
57,,SING,CBC,HBC,no,N,57,,68265,17457,HEM
58,,SING,CBC,HBCA,no,N,58,,68265,17457,HEM
59,,SING,C1D,C2D,no,N,59,,68265,17457,HEM
60,,DOUB,C1D,ND,yes,N,60,,68265,17457,HEM
61,,DOUB,C2D,C3D,yes,N,61,,68265,17457,HEM
62,,SING,C2D,CMD,yes,N,62,,68265,17457,HEM
63,,SING,C3D,C4D,no,N,63,,68265,17457,HEM
64,,SING,C3D,CAD,yes,N,64,,68265,17457,HEM
65,,SING,C4D,ND,no,N,65,,68265,17457,HEM
66,,SING,CMD,HMD,yes,N,66,,68265,17457,HEM
67,,SING,CMD,HMDA,no,N,67,,68265,17457,HEM
68,,SING,CMD,HMDB,no,N,68,,68265,17457,HEM
69,,SING,CAD,CBD,no,N,69,,68265,17457,HEM
70,,SING,CAD,HAD,no,N,70,,68265,17457,HEM
71,,SING,CAD,HADA,no,N,71,,68265,17457,HEM
72,,SING,CBD,CGD,no,N,72,,68265,17457,HEM
73,,SING,CBD,HBD,no,N,73,,68265,17457,HEM
74,,SING,CBD,HBDA,no,N,74,,68265,17457,HEM
75,,DOUB,CGD,O1D,no,N,75,,68265,17457,HEM
76,,SING,CGD,O2D,no,N,76,,68265,17457,HEM
77,,SING,O2A,H2A,no,N,77,,68265,17457,HEM
78,,SING,O2D,H2D,no,N,78,,68265,17457,HEM
79,,SING,FE,NA,no,N,79,,68265,17457,HEM
80,,SING,FE,NB,no,N,80,,68265,17457,HEM
81,,SING,FE,NC,no,N,81,,68265,17457,HEM
82,,SING,FE,ND,no,N,82,,68265,17457,HEM
1,,DOUB,C,O,no,N,1,,68281,17458,ACE
2,,SING,C,CH3,no,N,2,,68281,17458,ACE
3,,SING,C,H,no,N,3,,68281,17458,ACE
4,,SING,CH3,H1,no,N,4,,68281,17458,ACE
5,,SING,CH3,H2,no,N,5,,68281,17458,ACE
6,,SING,CH3,H3,no,N,6,,68281,17458,ACE
1,,SING,C1,C2,no,N,1,,68297,17459,IBS
2,,SING,C1,C6,no,N,2,,68297,17459,IBS
3,,SING,C1,O1,no,N,3,,68297,17459,IBS
4,,SING,C1,H1,no,N,4,,68297,17459,IBS
5,,SING,C2,C3,no,N,5,,68297,17459,IBS
6,,SING,C2,O2,no,N,6,,68297,17459,IBS
7,,SING,C2,H2,no,N,7,,68297,17459,IBS
8,,SING,C3,C4,no,N,8,,68297,17459,IBS
9,,SING,C3,O3,no,N,9,,68297,17459,IBS
10,,SING,C3,H3,no,N,10,,68297,17459,IBS
11,,SING,C4,C5,no,N,11,,68297,17459,IBS
12,,SING,C4,O4,no,N,12,,68297,17459,IBS
13,,SING,C4,H4,no,N,13,,68297,17459,IBS
14,,SING,C5,C6,no,N,14,,68297,17459,IBS
15,,SING,C5,O5,no,N,15,,68297,17459,IBS
16,,SING,C5,H5,no,N,16,,68297,17459,IBS
17,,SING,C6,O6,no,N,17,,68297,17459,IBS
18,,SING,C6,H6,no,N,18,,68297,17459,IBS
19,,SING,O1,P1,no,N,19,,68297,17459,IBS
20,,SING,O2,HO2,no,N,20,,68297,17459,IBS
21,,SING,O3,HO3,no,N,21,,68297,17459,IBS
22,,SING,O4,P4,no,N,22,,68297,17459,IBS
23,,SING,O5,P5,no,N,23,,68297,17459,IBS
24,,SING,O6,HO6,no,N,24,,68297,17459,IBS
25,,DOUB,P1,O11,no,N,25,,68297,17459,IBS
26,,SING,P1,O12,no,N,26,,68297,17459,IBS
27,,SING,P1,O13,no,N,27,,68297,17459,IBS
28,,SING,O12,C21,no,N,28,,68297,17459,IBS
29,,SING,C21,C24,no,N,29,,68297,17459,IBS
30,,SING,C21,H211,no,N,30,,68297,17459,IBS
31,,SING,C21,H212,no,N,31,,68297,17459,IBS
32,,DOUB,C24,O29,no,N,32,,68297,17459,IBS
33,,SING,C24,C25,no,N,33,,68297,17459,IBS
34,,SING,C25,O26,no,N,34,,68297,17459,IBS
35,,SING,C25,H25,no,N,35,,68297,17459,IBS
36,,SING,C25,H251,no,N,36,,68297,17459,IBS
37,,SING,O26,H26,no,N,37,,68297,17459,IBS
38,,SING,O13,HO13,no,N,38,,68297,17459,IBS
39,,DOUB,P4,O41,no,N,39,,68297,17459,IBS
40,,SING,P4,O42,no,N,40,,68297,17459,IBS
41,,SING,P4,O43,no,N,41,,68297,17459,IBS
42,,SING,O42,HO42,no,N,42,,68297,17459,IBS
43,,SING,O43,HO43,no,N,43,,68297,17459,IBS
44,,DOUB,P5,O51,no,N,44,,68297,17459,IBS
45,,SING,P5,O52,no,N,45,,68297,17459,IBS
46,,SING,P5,O53,no,N,46,,68297,17459,IBS
47,,SING,O52,HO52,no,N,47,,68297,17459,IBS
48,,SING,O53,HO53,no,N,48,,68297,17459,IBS
1,,DOUB,C1,C2,yes,N,1,,68391,17464,NTS
2,,SING,C1,C9,yes,N,2,,68391,17464,NTS
3,,SING,C1,S1,no,N,3,,68391,17464,NTS
4,,SING,C2,C3,yes,N,4,,68391,17464,NTS
5,,SING,C2,H2,no,N,5,,68391,17464,NTS
6,,DOUB,C3,C4,yes,N,6,,68391,17464,NTS
7,,SING,C3,S3,no,N,7,,68391,17464,NTS
8,,SING,C4,C10,yes,N,8,,68391,17464,NTS
9,,SING,C4,H4,no,N,9,,68391,17464,NTS
10,,DOUB,C5,C6,yes,N,10,,68391,17464,NTS
11,,SING,C5,C10,yes,N,11,,68391,17464,NTS
12,,SING,C5,H5,no,N,12,,68391,17464,NTS
13,,SING,C6,C7,yes,N,13,,68391,17464,NTS
14,,SING,C6,S6,no,N,14,,68391,17464,NTS
15,,DOUB,C7,C8,yes,N,15,,68391,17464,NTS
16,,SING,C7,H7,no,N,16,,68391,17464,NTS
17,,SING,C8,C9,yes,N,17,,68391,17464,NTS
18,,SING,C8,H8,no,N,18,,68391,17464,NTS
19,,DOUB,C9,C10,yes,N,19,,68391,17464,NTS
20,,DOUB,O11,S1,no,N,20,,68391,17464,NTS
21,,DOUB,O12,S1,no,N,21,,68391,17464,NTS
22,,SING,O13,S1,no,N,22,,68391,17464,NTS
23,,DOUB,O31,S3,no,N,23,,68391,17464,NTS
24,,DOUB,O32,S3,no,N,24,,68391,17464,NTS
25,,SING,O33,S3,no,N,25,,68391,17464,NTS
26,,DOUB,O61,S6,no,N,26,,68391,17464,NTS
27,,DOUB,O62,S6,no,N,27,,68391,17464,NTS
28,,SING,O63,S6,no,N,28,,68391,17464,NTS
1,,SING,N,CA,no,N,1,,68489,17470,HYP
2,,SING,N,CD,no,N,2,,68489,17470,HYP
3,,SING,N,H,no,N,3,,68489,17470,HYP
4,,SING,CA,C,no,N,4,,68489,17470,HYP
5,,SING,CA,CB,no,N,5,,68489,17470,HYP
6,,SING,CA,HA,no,N,6,,68489,17470,HYP
7,,DOUB,C,O,no,N,7,,68489,17470,HYP
8,,SING,C,OXT,no,N,8,,68489,17470,HYP
9,,SING,CB,CG,no,N,9,,68489,17470,HYP
10,,SING,CB,HB2,no,N,10,,68489,17470,HYP
11,,SING,CB,HB3,no,N,11,,68489,17470,HYP
12,,SING,CG,CD,no,N,12,,68489,17470,HYP
13,,SING,CG,OD1,no,N,13,,68489,17470,HYP
14,,SING,CG,HG,no,N,14,,68489,17470,HYP
15,,SING,CD,HD22,no,N,15,,68489,17470,HYP
16,,SING,CD,HD23,no,N,16,,68489,17470,HYP
17,,SING,OD1,HD1,no,N,17,,68489,17470,HYP
18,,SING,OXT,HXT,no,N,18,,68489,17470,HYP
1,,SING,N,CA,no,N,1,,68879,17492,DTH
2,,SING,N,H,no,N,2,,68879,17492,DTH
3,,SING,N,HN2,no,N,3,,68879,17492,DTH
4,,SING,CA,CB,no,N,4,,68879,17492,DTH
5,,SING,CA,C,no,N,5,,68879,17492,DTH
6,,SING,CA,HA,no,N,6,,68879,17492,DTH
7,,SING,CB,CG2,no,N,7,,68879,17492,DTH
8,,SING,CB,OG1,no,N,8,,68879,17492,DTH
9,,SING,CB,HB,no,N,9,,68879,17492,DTH
10,,SING,CG2,HG21,no,N,10,,68879,17492,DTH
11,,SING,CG2,HG22,no,N,11,,68879,17492,DTH
12,,SING,CG2,HG23,no,N,12,,68879,17492,DTH
13,,SING,OG1,HG1,no,N,13,,68879,17492,DTH
14,,DOUB,C,O,no,N,14,,68879,17492,DTH
15,,SING,C,OXT,no,N,15,,68879,17492,DTH
16,,SING,OXT,HXT,no,N,16,,68879,17492,DTH
1,,SING,N,CA,no,N,1,,68939,17495,DTY
2,,SING,N,H,no,N,2,,68939,17495,DTY
3,,SING,N,H2,no,N,3,,68939,17495,DTY
4,,SING,CA,C,no,N,4,,68939,17495,DTY
5,,SING,CA,CB,no,N,5,,68939,17495,DTY
6,,SING,CA,HA,no,N,6,,68939,17495,DTY
7,,DOUB,C,O,no,N,7,,68939,17495,DTY
8,,SING,C,OXT,no,N,8,,68939,17495,DTY
9,,SING,CB,CG,no,N,9,,68939,17495,DTY
10,,SING,CB,HB2,no,N,10,,68939,17495,DTY
11,,SING,CB,HB3,no,N,11,,68939,17495,DTY
12,,DOUB,CG,CD1,yes,N,12,,68939,17495,DTY
13,,SING,CG,CD2,yes,N,13,,68939,17495,DTY
14,,SING,CD1,CE1,yes,N,14,,68939,17495,DTY
15,,SING,CD1,HD1,no,N,15,,68939,17495,DTY
16,,DOUB,CD2,CE2,yes,N,16,,68939,17495,DTY
17,,SING,CD2,HD2,no,N,17,,68939,17495,DTY
18,,DOUB,CE1,CZ,yes,N,18,,68939,17495,DTY
19,,SING,CE1,HE1,no,N,19,,68939,17495,DTY
20,,SING,CE2,CZ,yes,N,20,,68939,17495,DTY
21,,SING,CE2,HE2,no,N,21,,68939,17495,DTY
22,,SING,CZ,OH,no,N,22,,68939,17495,DTY
23,,SING,OH,HH,no,N,23,,68939,17495,DTY
24,,SING,OXT,HXT,no,N,24,,68939,17495,DTY
1,,SING,P1,O2P,no,N,1,,68957,17496,C2E
2,,DOUB,O1P,P1,no,N,2,,68957,17496,C2E
3,,SING,O5',P1,no,N,3,,68957,17496,C2E
4,,SING,C5',O5',no,N,4,,68957,17496,C2E
5,,SING,C4',O4',no,N,5,,68957,17496,C2E
6,,SING,C4',C5',no,N,6,,68957,17496,C2E
7,,SING,C3',C4',no,N,7,,68957,17496,C2E
8,,SING,O3',P11,no,N,8,,68957,17496,C2E
9,,SING,O3',C3',no,N,9,,68957,17496,C2E
10,,SING,C2',C3',no,N,10,,68957,17496,C2E
11,,SING,C2',C1',no,N,11,,68957,17496,C2E
12,,SING,O2',C2',no,N,12,,68957,17496,C2E
13,,SING,C1',O4',no,N,13,,68957,17496,C2E
14,,SING,C1',N9,no,N,14,,68957,17496,C2E
15,,SING,N9,C4,no,N,15,,68957,17496,C2E
16,,SING,N9,C8,no,N,16,,68957,17496,C2E
17,,DOUB,C8,N7,no,N,17,,68957,17496,C2E
18,,SING,C5,N7,no,N,18,,68957,17496,C2E
19,,SING,C5,C6,no,N,19,,68957,17496,C2E
20,,DOUB,C6,O6,no,N,20,,68957,17496,C2E
21,,SING,N1,C6,no,N,21,,68957,17496,C2E
22,,SING,C2,N1,no,N,22,,68957,17496,C2E
23,,SING,N2,C2,yes,N,23,,68957,17496,C2E
24,,DOUB,N3,C2,yes,N,24,,68957,17496,C2E
25,,SING,N3,C4,yes,N,25,,68957,17496,C2E
26,,DOUB,C4,C5,no,N,26,,68957,17496,C2E
27,,SING,P11,O21,yes,N,27,,68957,17496,C2E
28,,SING,P11,O5A,no,N,28,,68957,17496,C2E
29,,DOUB,O11,P11,no,N,29,,68957,17496,C2E
30,,SING,C5A,O5A,no,N,30,,68957,17496,C2E
31,,SING,C5A,C4A,no,N,31,,68957,17496,C2E
32,,SING,C4A,O4A,no,N,32,,68957,17496,C2E
33,,SING,C4A,C3A,no,N,33,,68957,17496,C2E
34,,SING,O4A,C1A,no,N,34,,68957,17496,C2E
35,,SING,C3A,C2A,no,N,35,,68957,17496,C2E
36,,SING,O3A,C3A,no,N,36,,68957,17496,C2E
37,,SING,O3A,P1,no,N,37,,68957,17496,C2E
38,,SING,C2A,O2A,yes,N,38,,68957,17496,C2E
39,,SING,C1A,C2A,no,N,39,,68957,17496,C2E
40,,SING,C1A,N91,no,N,40,,68957,17496,C2E
41,,SING,N91,C41,no,N,41,,68957,17496,C2E
42,,DOUB,C81,N71,no,N,42,,68957,17496,C2E
43,,SING,C81,N91,no,N,43,,68957,17496,C2E
44,,SING,N71,C51,no,N,44,,68957,17496,C2E
45,,DOUB,C51,C41,no,N,45,,68957,17496,C2E
46,,SING,C51,C61,no,N,46,,68957,17496,C2E
47,,DOUB,C61,O61,no,N,47,,68957,17496,C2E
48,,SING,C61,N11,no,N,48,,68957,17496,C2E
49,,SING,C21,N11,no,N,49,,68957,17496,C2E
50,,SING,C21,N21,no,N,50,,68957,17496,C2E
51,,DOUB,N31,C21,no,N,51,,68957,17496,C2E
52,,SING,C41,N31,no,N,52,,68957,17496,C2E
53,,SING,O2P,HO2P,no,N,53,,68957,17496,C2E
54,,SING,C5',H5'1,no,N,54,,68957,17496,C2E
55,,SING,C5',H5'2,no,N,55,,68957,17496,C2E
56,,SING,C4',H4',no,N,56,,68957,17496,C2E
57,,SING,C3',H3',no,N,57,,68957,17496,C2E
58,,SING,C2',H2',no,N,58,,68957,17496,C2E
59,,SING,O2',HO2',no,N,59,,68957,17496,C2E
60,,SING,C1',H1',no,N,60,,68957,17496,C2E
61,,SING,C8,H8,yes,N,61,,68957,17496,C2E
62,,SING,N1,HN1,yes,N,62,,68957,17496,C2E
63,,SING,N2,HN21,yes,N,63,,68957,17496,C2E
64,,SING,N2,HN22,no,N,64,,68957,17496,C2E
65,,SING,O21,HO21,yes,N,65,,68957,17496,C2E
66,,SING,C5A,H511,yes,N,66,,68957,17496,C2E
67,,SING,C5A,H512,no,N,67,,68957,17496,C2E
68,,SING,C4A,H4A,no,N,68,,68957,17496,C2E
69,,SING,C3A,H3A,no,N,69,,68957,17496,C2E
70,,SING,C2A,H2A,no,N,70,,68957,17496,C2E
71,,SING,O2A,HO2A,no,N,71,,68957,17496,C2E
72,,SING,C1A,H1A,no,N,72,,68957,17496,C2E
73,,SING,C81,H81,no,N,73,,68957,17496,C2E
74,,SING,N11,HN11,no,N,74,,68957,17496,C2E
75,,SING,N21,HN24,no,N,75,,68957,17496,C2E
76,,SING,N21,HN23,no,N,76,,68957,17496,C2E
1,,SING,N,HN1,no,N,1,,69031,17500,NH2
2,,SING,N,HN2,no,N,2,,69031,17500,NH2
1,,SING,N,CA,no,N,1,,69238,1751,AYA
2,,SING,N,CT,no,N,2,,69238,1751,AYA
3,,SING,N,H,no,N,3,,69238,1751,AYA
4,,SING,CA,CB,no,N,4,,69238,1751,AYA
5,,SING,CA,C,no,N,5,,69238,1751,AYA
6,,SING,CA,HA,no,N,6,,69238,1751,AYA
7,,SING,CB,HB1,no,N,7,,69238,1751,AYA
8,,SING,CB,HB2,no,N,8,,69238,1751,AYA
9,,SING,CB,HB3,no,N,9,,69238,1751,AYA
10,,DOUB,C,O,no,N,10,,69238,1751,AYA
11,,SING,C,OXT,no,N,11,,69238,1751,AYA
12,,SING,OXT,HXT,no,N,12,,69238,1751,AYA
13,,DOUB,CT,OT,no,N,13,,69238,1751,AYA
14,,SING,CT,CM,no,N,14,,69238,1751,AYA
15,,SING,CM,HM1,no,N,15,,69238,1751,AYA
16,,SING,CM,HM2,no,N,16,,69238,1751,AYA
17,,SING,CM,HM3,no,N,17,,69238,1751,AYA
1,,DOUB,P,O1,no,N,1,,69253,17510,PO4
2,,SING,P,O2,no,N,2,,69253,17510,PO4
3,,SING,P,O3,no,N,3,,69253,17510,PO4
4,,SING,P,O4,no,N,4,,69253,17510,PO4
1,,SING,N1,C2,no,N,1,,69369,17517,PSU
2,,SING,N1,C6,no,N,2,,69369,17517,PSU
3,,SING,N1,HN1,no,N,3,,69369,17517,PSU
4,,SING,C2,N3,no,N,4,,69369,17517,PSU
5,,DOUB,C2,O2,no,N,5,,69369,17517,PSU
6,,SING,N3,C4,no,N,6,,69369,17517,PSU
7,,SING,N3,HN3,no,N,7,,69369,17517,PSU
8,,SING,C4,C5,no,N,8,,69369,17517,PSU
9,,DOUB,C4,O4,no,N,9,,69369,17517,PSU
10,,DOUB,C5,C6,no,N,10,,69369,17517,PSU
11,,SING,C5,C1',no,N,11,,69369,17517,PSU
12,,SING,C6,H6,no,N,12,,69369,17517,PSU
13,,SING,C1',C2',no,N,13,,69369,17517,PSU
14,,SING,C1',O4',no,N,14,,69369,17517,PSU
15,,SING,C1',H1',no,N,15,,69369,17517,PSU
16,,SING,C2',O2',no,N,16,,69369,17517,PSU
17,,SING,C2',C3',no,N,17,,69369,17517,PSU
18,,SING,C2',H2',no,N,18,,69369,17517,PSU
19,,SING,O2',HO2',no,N,19,,69369,17517,PSU
20,,SING,C3',C4',no,N,20,,69369,17517,PSU
21,,SING,C3',O3',no,N,21,,69369,17517,PSU
22,,SING,C3',H3',no,N,22,,69369,17517,PSU
23,,SING,C4',O4',no,N,23,,69369,17517,PSU
24,,SING,C4',C5',no,N,24,,69369,17517,PSU
25,,SING,C4',H4',no,N,25,,69369,17517,PSU
26,,SING,O3',HO3',no,N,26,,69369,17517,PSU
27,,SING,C5',O5',no,N,27,,69369,17517,PSU
28,,SING,C5',H5',no,N,28,,69369,17517,PSU
29,,SING,C5',H5'',no,N,29,,69369,17517,PSU
30,,SING,O5',P,no,N,30,,69369,17517,PSU
31,,DOUB,P,OP1,no,N,31,,69369,17517,PSU
32,,SING,P,OP2,no,N,32,,69369,17517,PSU
33,,SING,P,OP3,no,N,33,,69369,17517,PSU
34,,SING,OP2,HOP2,no,N,34,,69369,17517,PSU
35,,SING,OP3,HOP3,no,N,35,,69369,17517,PSU
1,,SING,C1,C2,no,N,1,,69566,17527,FUC
2,,SING,C1,O1,no,N,2,,69566,17527,FUC
3,,SING,C1,O5,no,N,3,,69566,17527,FUC
4,,SING,C1,H1,no,N,4,,69566,17527,FUC
5,,SING,C2,C3,no,N,5,,69566,17527,FUC
6,,SING,C2,O2,no,N,6,,69566,17527,FUC
7,,SING,C2,H2,no,N,7,,69566,17527,FUC
8,,SING,C3,C4,no,N,8,,69566,17527,FUC
9,,SING,C3,O3,no,N,9,,69566,17527,FUC
10,,SING,C3,H3,no,N,10,,69566,17527,FUC
11,,SING,C4,C5,no,N,11,,69566,17527,FUC
12,,SING,C4,O4,no,N,12,,69566,17527,FUC
13,,SING,C4,H4,no,N,13,,69566,17527,FUC
14,,SING,C5,C6,no,N,14,,69566,17527,FUC
15,,SING,C5,O5,no,N,15,,69566,17527,FUC
16,,SING,C5,H5,no,N,16,,69566,17527,FUC
17,,SING,C6,H61,no,N,17,,69566,17527,FUC
18,,SING,C6,H62,no,N,18,,69566,17527,FUC
19,,SING,C6,H63,no,N,19,,69566,17527,FUC
20,,SING,O1,HO1,no,N,20,,69566,17527,FUC
21,,SING,O2,HO2,no,N,21,,69566,17527,FUC
22,,SING,O3,HO3,no,N,22,,69566,17527,FUC
23,,SING,O4,HO4,no,N,23,,69566,17527,FUC
1,,SING,N,CA,no,N,1,,69600,17529,SEP
2,,SING,N,H,no,N,2,,69600,17529,SEP
3,,SING,N,H2,no,N,3,,69600,17529,SEP
4,,SING,CA,CB,no,N,4,,69600,17529,SEP
5,,SING,CA,C,no,N,5,,69600,17529,SEP
6,,SING,CA,HA,no,N,6,,69600,17529,SEP
7,,SING,CB,OG,no,N,7,,69600,17529,SEP
8,,SING,CB,HB2,no,N,8,,69600,17529,SEP
9,,SING,CB,HB3,no,N,9,,69600,17529,SEP
10,,SING,OG,P,no,N,10,,69600,17529,SEP
11,,DOUB,C,O,no,N,11,,69600,17529,SEP
12,,SING,C,OXT,no,N,12,,69600,17529,SEP
13,,SING,OXT,HXT,no,N,13,,69600,17529,SEP
14,,DOUB,P,O1P,no,N,14,,69600,17529,SEP
15,,SING,P,O2P,no,N,15,,69600,17529,SEP
16,,SING,P,O3P,no,N,16,,69600,17529,SEP
17,,SING,O2P,HOP2,no,N,17,,69600,17529,SEP
18,,SING,O3P,HOP3,no,N,18,,69600,17529,SEP
1,,SING,N,CA,no,N,1,,69685,17533,HYP
2,,SING,N,CD,no,N,2,,69685,17533,HYP
3,,SING,N,H,no,N,3,,69685,17533,HYP
4,,SING,CA,C,no,N,4,,69685,17533,HYP
5,,SING,CA,CB,no,N,5,,69685,17533,HYP
6,,SING,CA,HA,no,N,6,,69685,17533,HYP
7,,DOUB,C,O,no,N,7,,69685,17533,HYP
8,,SING,C,OXT,no,N,8,,69685,17533,HYP
9,,SING,CB,CG,no,N,9,,69685,17533,HYP
10,,SING,CB,HB2,no,N,10,,69685,17533,HYP
11,,SING,CB,HB3,no,N,11,,69685,17533,HYP
12,,SING,CG,CD,no,N,12,,69685,17533,HYP
13,,SING,CG,OD1,no,N,13,,69685,17533,HYP
14,,SING,CG,HG,no,N,14,,69685,17533,HYP
15,,SING,CD,HD22,no,N,15,,69685,17533,HYP
16,,SING,CD,HD23,no,N,16,,69685,17533,HYP
17,,SING,OD1,HD1,no,N,17,,69685,17533,HYP
18,,SING,OXT,HXT,no,N,18,,69685,17533,HYP
1,,SING,P,BP,no,N,1,,69729,17535,BGR
2,,SING,P,O5',no,N,2,,69729,17535,BGR
3,,DOUB,P,OP1,no,N,3,,69729,17535,BGR
4,,SING,P,OP2,no,N,4,,69729,17535,BGR
5,,SING,N1,C2,no,N,5,,69729,17535,BGR
6,,SING,N1,C6,no,N,6,,69729,17535,BGR
7,,SING,N1,HN1,no,N,7,,69729,17535,BGR
8,,SING,C2,N2,no,N,8,,69729,17535,BGR
9,,DOUB,C2,N3,no,N,9,,69729,17535,BGR
10,,SING,N2,HN2,no,N,10,,69729,17535,BGR
11,,SING,N2,HN2A,no,N,11,,69729,17535,BGR
12,,SING,N3,C4,no,N,12,,69729,17535,BGR
13,,DOUB,C4,C5,yes,N,13,,69729,17535,BGR
14,,SING,C4,N9,yes,N,14,,69729,17535,BGR
15,,SING,C5,C6,no,N,15,,69729,17535,BGR
16,,SING,C5,N7,yes,N,16,,69729,17535,BGR
17,,DOUB,C6,O6,no,N,17,,69729,17535,BGR
18,,DOUB,N7,C8,yes,N,18,,69729,17535,BGR
19,,SING,C8,N9,yes,N,19,,69729,17535,BGR
20,,SING,C8,H8,no,N,20,,69729,17535,BGR
21,,SING,N9,C1',no,N,21,,69729,17535,BGR
22,,SING,BP,H1BP,no,N,22,,69729,17535,BGR
23,,SING,BP,H2BP,no,N,23,,69729,17535,BGR
24,,SING,BP,H3BP,no,N,24,,69729,17535,BGR
25,,SING,C1',C2',no,N,25,,69729,17535,BGR
26,,SING,C1',O4',no,N,26,,69729,17535,BGR
27,,SING,C1',H1',no,N,27,,69729,17535,BGR
28,,SING,C2',C3',no,N,28,,69729,17535,BGR
29,,SING,C2',H2',no,N,29,,69729,17535,BGR
30,,SING,C2',H2'A,no,N,30,,69729,17535,BGR
31,,SING,C3',O3',no,N,31,,69729,17535,BGR
32,,SING,C3',C4',no,N,32,,69729,17535,BGR
33,,SING,C3',H3',no,N,33,,69729,17535,BGR
34,,SING,C4',O4',no,N,34,,69729,17535,BGR
35,,SING,C4',C5',no,N,35,,69729,17535,BGR
36,,SING,C4',H4',no,N,36,,69729,17535,BGR
37,,SING,C5',O5',no,N,37,,69729,17535,BGR
38,,SING,C5',H5',no,N,38,,69729,17535,BGR
39,,SING,C5',H5'A,no,N,39,,69729,17535,BGR
40,,SING,O3',H15,no,N,40,,69729,17535,BGR
41,,SING,OP2,H16,no,N,41,,69729,17535,BGR
1,,SING,N,CA,no,N,1,,69808,17539,TPO
2,,SING,N,H,no,N,2,,69808,17539,TPO
3,,SING,N,H2,no,N,3,,69808,17539,TPO
4,,SING,CA,CB,no,N,4,,69808,17539,TPO
5,,SING,CA,C,no,N,5,,69808,17539,TPO
6,,SING,CA,HA,no,N,6,,69808,17539,TPO
7,,SING,CB,CG2,no,N,7,,69808,17539,TPO
8,,SING,CB,OG1,no,N,8,,69808,17539,TPO
9,,SING,CB,HB,no,N,9,,69808,17539,TPO
10,,SING,CG2,HG21,no,N,10,,69808,17539,TPO
11,,SING,CG2,HG22,no,N,11,,69808,17539,TPO
12,,SING,CG2,HG23,no,N,12,,69808,17539,TPO
13,,SING,OG1,P,no,N,13,,69808,17539,TPO
14,,DOUB,P,O1P,no,N,14,,69808,17539,TPO
15,,SING,P,O2P,no,N,15,,69808,17539,TPO
16,,SING,P,O3P,no,N,16,,69808,17539,TPO
17,,SING,O2P,HOP2,no,N,17,,69808,17539,TPO
18,,SING,O3P,HOP3,no,N,18,,69808,17539,TPO
19,,DOUB,C,O,no,N,19,,69808,17539,TPO
20,,SING,C,OXT,no,N,20,,69808,17539,TPO
21,,SING,OXT,HXT,no,N,21,,69808,17539,TPO
1,,SING,N,CA,no,N,1,,69809,17539,SEP
2,,SING,N,H,no,N,2,,69809,17539,SEP
3,,SING,N,H2,no,N,3,,69809,17539,SEP
4,,SING,CA,CB,no,N,4,,69809,17539,SEP
5,,SING,CA,C,no,N,5,,69809,17539,SEP
6,,SING,CA,HA,no,N,6,,69809,17539,SEP
7,,SING,CB,OG,no,N,7,,69809,17539,SEP
8,,SING,CB,HB2,no,N,8,,69809,17539,SEP
9,,SING,CB,HB3,no,N,9,,69809,17539,SEP
10,,SING,OG,P,no,N,10,,69809,17539,SEP
11,,DOUB,C,O,no,N,11,,69809,17539,SEP
12,,SING,C,OXT,no,N,12,,69809,17539,SEP
13,,SING,OXT,HXT,no,N,13,,69809,17539,SEP
14,,DOUB,P,O1P,no,N,14,,69809,17539,SEP
15,,SING,P,O2P,no,N,15,,69809,17539,SEP
16,,SING,P,O3P,no,N,16,,69809,17539,SEP
17,,SING,O2P,HOP2,no,N,17,,69809,17539,SEP
18,,SING,O3P,HOP3,no,N,18,,69809,17539,SEP
1,,SING,N,CA,no,N,1,,69850,17541,SEP
2,,SING,N,H,no,N,2,,69850,17541,SEP
3,,SING,N,H2,no,N,3,,69850,17541,SEP
4,,SING,CA,CB,no,N,4,,69850,17541,SEP
5,,SING,CA,C,no,N,5,,69850,17541,SEP
6,,SING,CA,HA,no,N,6,,69850,17541,SEP
7,,SING,CB,OG,no,N,7,,69850,17541,SEP
8,,SING,CB,HB2,no,N,8,,69850,17541,SEP
9,,SING,CB,HB3,no,N,9,,69850,17541,SEP
10,,SING,OG,P,no,N,10,,69850,17541,SEP
11,,DOUB,C,O,no,N,11,,69850,17541,SEP
12,,SING,C,OXT,no,N,12,,69850,17541,SEP
13,,SING,OXT,HXT,no,N,13,,69850,17541,SEP
14,,DOUB,P,O1P,no,N,14,,69850,17541,SEP
15,,SING,P,O2P,no,N,15,,69850,17541,SEP
16,,SING,P,O3P,no,N,16,,69850,17541,SEP
17,,SING,O2P,HOP2,no,N,17,,69850,17541,SEP
18,,SING,O3P,HOP3,no,N,18,,69850,17541,SEP
1,,SING,N,CA,no,N,1,,69871,17542,SEP
2,,SING,N,H,no,N,2,,69871,17542,SEP
3,,SING,N,H2,no,N,3,,69871,17542,SEP
4,,SING,CA,CB,no,N,4,,69871,17542,SEP
5,,SING,CA,C,no,N,5,,69871,17542,SEP
6,,SING,CA,HA,no,N,6,,69871,17542,SEP
7,,SING,CB,OG,no,N,7,,69871,17542,SEP
8,,SING,CB,HB2,no,N,8,,69871,17542,SEP
9,,SING,CB,HB3,no,N,9,,69871,17542,SEP
10,,SING,OG,P,no,N,10,,69871,17542,SEP
11,,DOUB,C,O,no,N,11,,69871,17542,SEP
12,,SING,C,OXT,no,N,12,,69871,17542,SEP
13,,SING,OXT,HXT,no,N,13,,69871,17542,SEP
14,,DOUB,P,O1P,no,N,14,,69871,17542,SEP
15,,SING,P,O2P,no,N,15,,69871,17542,SEP
16,,SING,P,O3P,no,N,16,,69871,17542,SEP
17,,SING,O2P,HOP2,no,N,17,,69871,17542,SEP
18,,SING,O3P,HOP3,no,N,18,,69871,17542,SEP
1,,SING,N,CA,no,N,1,,69912,17544,TPO
2,,SING,N,H,no,N,2,,69912,17544,TPO
3,,SING,N,H2,no,N,3,,69912,17544,TPO
4,,SING,CA,CB,no,N,4,,69912,17544,TPO
5,,SING,CA,C,no,N,5,,69912,17544,TPO
6,,SING,CA,HA,no,N,6,,69912,17544,TPO
7,,SING,CB,CG2,no,N,7,,69912,17544,TPO
8,,SING,CB,OG1,no,N,8,,69912,17544,TPO
9,,SING,CB,HB,no,N,9,,69912,17544,TPO
10,,SING,CG2,HG21,no,N,10,,69912,17544,TPO
11,,SING,CG2,HG22,no,N,11,,69912,17544,TPO
12,,SING,CG2,HG23,no,N,12,,69912,17544,TPO
13,,SING,OG1,P,no,N,13,,69912,17544,TPO
14,,DOUB,P,O1P,no,N,14,,69912,17544,TPO
15,,SING,P,O2P,no,N,15,,69912,17544,TPO
16,,SING,P,O3P,no,N,16,,69912,17544,TPO
17,,SING,O2P,HOP2,no,N,17,,69912,17544,TPO
18,,SING,O3P,HOP3,no,N,18,,69912,17544,TPO
19,,DOUB,C,O,no,N,19,,69912,17544,TPO
20,,SING,C,OXT,no,N,20,,69912,17544,TPO
21,,SING,OXT,HXT,no,N,21,,69912,17544,TPO
1,,SING,N,CA,no,N,1,,69933,17545,TPO
2,,SING,N,H,no,N,2,,69933,17545,TPO
3,,SING,N,H2,no,N,3,,69933,17545,TPO
4,,SING,CA,CB,no,N,4,,69933,17545,TPO
5,,SING,CA,C,no,N,5,,69933,17545,TPO
6,,SING,CA,HA,no,N,6,,69933,17545,TPO
7,,SING,CB,CG2,no,N,7,,69933,17545,TPO
8,,SING,CB,OG1,no,N,8,,69933,17545,TPO
9,,SING,CB,HB,no,N,9,,69933,17545,TPO
10,,SING,CG2,HG21,no,N,10,,69933,17545,TPO
11,,SING,CG2,HG22,no,N,11,,69933,17545,TPO
12,,SING,CG2,HG23,no,N,12,,69933,17545,TPO
13,,SING,OG1,P,no,N,13,,69933,17545,TPO
14,,DOUB,P,O1P,no,N,14,,69933,17545,TPO
15,,SING,P,O2P,no,N,15,,69933,17545,TPO
16,,SING,P,O3P,no,N,16,,69933,17545,TPO
17,,SING,O2P,HOP2,no,N,17,,69933,17545,TPO
18,,SING,O3P,HOP3,no,N,18,,69933,17545,TPO
19,,DOUB,C,O,no,N,19,,69933,17545,TPO
20,,SING,C,OXT,no,N,20,,69933,17545,TPO
21,,SING,OXT,HXT,no,N,21,,69933,17545,TPO
1,,DOUB,CHA,C1A,no,Z,1,,69953,17546,CYC
2,,SING,CHA,C4D,no,N,2,,69953,17546,CYC
3,,SING,CHA,HHA,no,N,3,,69953,17546,CYC
4,,SING,NA,C1A,no,N,4,,69953,17546,CYC
5,,DOUB,NA,C4A,no,N,5,,69953,17546,CYC
6,,SING,C1A,C2A,no,N,6,,69953,17546,CYC
7,,DOUB,C2A,C3A,no,N,7,,69953,17546,CYC
8,,SING,C2A,CAA,no,N,8,,69953,17546,CYC
9,,SING,C3A,C4A,no,N,9,,69953,17546,CYC
10,,SING,C3A,CMA,no,N,10,,69953,17546,CYC
11,,SING,C4A,CHB,no,N,11,,69953,17546,CYC
12,,SING,CMA,HMA1,no,N,12,,69953,17546,CYC
13,,SING,CMA,HMA2,no,N,13,,69953,17546,CYC
14,,SING,CMA,HMA3,no,N,14,,69953,17546,CYC
15,,SING,CAA,CBA,no,N,15,,69953,17546,CYC
16,,SING,CAA,HAA1,no,N,16,,69953,17546,CYC
17,,SING,CAA,HAA2,no,N,17,,69953,17546,CYC
18,,SING,CBA,CGA,no,N,18,,69953,17546,CYC
19,,SING,CBA,HBA1,no,N,19,,69953,17546,CYC
20,,SING,CBA,HBA2,no,N,20,,69953,17546,CYC
21,,DOUB,CGA,O1A,no,N,21,,69953,17546,CYC
22,,SING,CGA,O2A,no,N,22,,69953,17546,CYC
23,,SING,O2A,H2A,no,N,23,,69953,17546,CYC
24,,DOUB,CHB,C1B,no,Z,24,,69953,17546,CYC
25,,SING,CHB,HHB,no,N,25,,69953,17546,CYC
26,,SING,NB,C1B,no,N,26,,69953,17546,CYC
27,,SING,NB,C4B,no,N,27,,69953,17546,CYC
28,,SING,NB,HB,no,N,28,,69953,17546,CYC
29,,SING,C1B,C2B,no,N,29,,69953,17546,CYC
30,,DOUB,C2B,C3B,no,N,30,,69953,17546,CYC
31,,SING,C2B,CMB,no,N,31,,69953,17546,CYC
32,,SING,C3B,C4B,no,N,32,,69953,17546,CYC
33,,SING,C3B,CAB,no,N,33,,69953,17546,CYC
34,,DOUB,C4B,OB,no,N,34,,69953,17546,CYC
35,,SING,CMB,HMB1,no,N,35,,69953,17546,CYC
36,,SING,CMB,HMB2,no,N,36,,69953,17546,CYC
37,,SING,CMB,HMB3,no,N,37,,69953,17546,CYC
38,,SING,CAB,CBB,no,N,38,,69953,17546,CYC
39,,SING,CAB,HAB1,no,N,39,,69953,17546,CYC
40,,SING,CAB,HAB2,no,N,40,,69953,17546,CYC
41,,SING,CBB,HBB1,no,N,41,,69953,17546,CYC
42,,SING,CBB,HBB2,no,N,42,,69953,17546,CYC
43,,SING,CBB,HBB3,no,N,43,,69953,17546,CYC
44,,SING,NC,C1C,no,N,44,,69953,17546,CYC
45,,SING,NC,C4C,no,N,45,,69953,17546,CYC
46,,SING,NC,HC,no,N,46,,69953,17546,CYC
47,,SING,C1C,C2C,no,N,47,,69953,17546,CYC
48,,DOUB,C1C,OC,no,N,48,,69953,17546,CYC
49,,SING,C2C,C3C,no,N,49,,69953,17546,CYC
50,,SING,C2C,CMC,no,N,50,,69953,17546,CYC
51,,SING,C2C,H2C,no,N,51,,69953,17546,CYC
52,,SING,C3C,C4C,no,N,52,,69953,17546,CYC
53,,SING,C3C,CAC,no,N,53,,69953,17546,CYC
54,,SING,C3C,H3C,no,N,54,,69953,17546,CYC
55,,DOUB,C4C,CHD,no,Z,55,,69953,17546,CYC
56,,SING,CMC,HMC1,no,N,56,,69953,17546,CYC
57,,SING,CMC,HMC2,no,N,57,,69953,17546,CYC
58,,SING,CMC,HMC3,no,N,58,,69953,17546,CYC
59,,SING,CAC,CBC,no,N,59,,69953,17546,CYC
60,,SING,CAC,HAC1,no,N,60,,69953,17546,CYC
61,,SING,CAC,HAC2,no,N,61,,69953,17546,CYC
62,,SING,CBC,HBC1,no,N,62,,69953,17546,CYC
63,,SING,CBC,HBC2,no,N,63,,69953,17546,CYC
64,,SING,CBC,HBC3,no,N,64,,69953,17546,CYC
65,,SING,CHD,C1D,no,N,65,,69953,17546,CYC
66,,SING,CHD,HHD,no,N,66,,69953,17546,CYC
67,,SING,ND,C1D,yes,N,67,,69953,17546,CYC
68,,SING,ND,C4D,yes,N,68,,69953,17546,CYC
69,,SING,ND,HD,no,N,69,,69953,17546,CYC
70,,DOUB,C1D,C2D,yes,N,70,,69953,17546,CYC
15,,SING,N3,C4,,,,,117537,20121,T23
71,,SING,C2D,C3D,yes,N,71,,69953,17546,CYC
72,,SING,C2D,CMD,no,N,72,,69953,17546,CYC
73,,DOUB,C3D,C4D,yes,N,73,,69953,17546,CYC
74,,SING,C3D,CAD,no,N,74,,69953,17546,CYC
75,,SING,CMD,HMD1,no,N,75,,69953,17546,CYC
76,,SING,CMD,HMD2,no,N,76,,69953,17546,CYC
77,,SING,CMD,HMD3,no,N,77,,69953,17546,CYC
78,,SING,CAD,CBD,no,N,78,,69953,17546,CYC
79,,SING,CAD,HAD1,no,N,79,,69953,17546,CYC
80,,SING,CAD,HAD2,no,N,80,,69953,17546,CYC
81,,SING,CBD,CGD,no,N,81,,69953,17546,CYC
82,,SING,CBD,HBD1,no,N,82,,69953,17546,CYC
83,,SING,CBD,HBD2,no,N,83,,69953,17546,CYC
84,,DOUB,CGD,O1D,no,N,84,,69953,17546,CYC
85,,SING,CGD,O2D,no,N,85,,69953,17546,CYC
86,,SING,O2D,H2D,no,N,86,,69953,17546,CYC
1,,SING,C1,C2,no,N,1,,70020,17551,CHO
2,,SING,C1,C10,no,N,2,,70020,17551,CHO
3,,SING,C1,H11,no,N,3,,70020,17551,CHO
4,,SING,C1,H12,no,N,4,,70020,17551,CHO
5,,SING,C2,C3,no,N,5,,70020,17551,CHO
6,,SING,C2,H21,no,N,6,,70020,17551,CHO
7,,SING,C2,H22,no,N,7,,70020,17551,CHO
8,,SING,C3,O3,no,N,8,,70020,17551,CHO
9,,SING,C3,C4,no,N,9,,70020,17551,CHO
10,,SING,C3,H3,no,N,10,,70020,17551,CHO
11,,SING,O3,HO3,no,N,11,,70020,17551,CHO
12,,SING,C4,C5,no,N,12,,70020,17551,CHO
13,,SING,C4,H41,no,N,13,,70020,17551,CHO
14,,SING,C4,H42,no,N,14,,70020,17551,CHO
15,,SING,C5,C6,no,N,15,,70020,17551,CHO
16,,SING,C5,C10,no,N,16,,70020,17551,CHO
17,,SING,C5,H5,no,N,17,,70020,17551,CHO
18,,SING,C6,C7,no,N,18,,70020,17551,CHO
19,,SING,C6,H61,no,N,19,,70020,17551,CHO
20,,SING,C6,H62,no,N,20,,70020,17551,CHO
21,,SING,C7,O7,no,N,21,,70020,17551,CHO
22,,SING,C7,C8,no,N,22,,70020,17551,CHO
23,,SING,C7,H7,no,N,23,,70020,17551,CHO
24,,SING,O7,HO7,no,N,24,,70020,17551,CHO
25,,SING,C8,C9,no,N,25,,70020,17551,CHO
26,,SING,C8,C14,no,N,26,,70020,17551,CHO
27,,SING,C8,H8,no,N,27,,70020,17551,CHO
28,,SING,C9,C10,no,N,28,,70020,17551,CHO
29,,SING,C9,C11,no,N,29,,70020,17551,CHO
30,,SING,C9,H9,no,N,30,,70020,17551,CHO
31,,SING,C10,C19,no,N,31,,70020,17551,CHO
32,,SING,C11,C12,no,N,32,,70020,17551,CHO
33,,SING,C11,H111,no,N,33,,70020,17551,CHO
34,,SING,C11,H112,no,N,34,,70020,17551,CHO
35,,SING,C12,C13,no,N,35,,70020,17551,CHO
36,,SING,C12,H121,no,N,36,,70020,17551,CHO
37,,SING,C12,H122,no,N,37,,70020,17551,CHO
38,,SING,C13,C14,no,N,38,,70020,17551,CHO
39,,SING,C13,C17,no,N,39,,70020,17551,CHO
40,,SING,C13,C18,no,N,40,,70020,17551,CHO
41,,SING,C14,C15,no,N,41,,70020,17551,CHO
42,,SING,C14,H14,no,N,42,,70020,17551,CHO
43,,SING,C15,C16,no,N,43,,70020,17551,CHO
44,,SING,C15,H151,no,N,44,,70020,17551,CHO
45,,SING,C15,H152,no,N,45,,70020,17551,CHO
46,,SING,C16,C17,no,N,46,,70020,17551,CHO
47,,SING,C16,H161,no,N,47,,70020,17551,CHO
48,,SING,C16,H162,no,N,48,,70020,17551,CHO
49,,SING,C17,C20,no,N,49,,70020,17551,CHO
50,,SING,C17,H17,no,N,50,,70020,17551,CHO
51,,SING,C18,H181,no,N,51,,70020,17551,CHO
52,,SING,C18,H182,no,N,52,,70020,17551,CHO
53,,SING,C18,H183,no,N,53,,70020,17551,CHO
54,,SING,C19,H191,no,N,54,,70020,17551,CHO
55,,SING,C19,H192,no,N,55,,70020,17551,CHO
56,,SING,C19,H193,no,N,56,,70020,17551,CHO
57,,SING,C20,C21,no,N,57,,70020,17551,CHO
58,,SING,C20,C22,no,N,58,,70020,17551,CHO
59,,SING,C20,H20,no,N,59,,70020,17551,CHO
60,,SING,C21,H211,no,N,60,,70020,17551,CHO
61,,SING,C21,H212,no,N,61,,70020,17551,CHO
62,,SING,C21,H213,no,N,62,,70020,17551,CHO
63,,SING,C22,C23,no,N,63,,70020,17551,CHO
64,,SING,C22,H221,no,N,64,,70020,17551,CHO
65,,SING,C22,H222,no,N,65,,70020,17551,CHO
66,,SING,C23,C24,no,N,66,,70020,17551,CHO
67,,SING,C23,H231,no,N,67,,70020,17551,CHO
68,,SING,C23,H232,no,N,68,,70020,17551,CHO
69,,DOUB,C24,O24,no,N,69,,70020,17551,CHO
70,,SING,C24,N25,no,N,70,,70020,17551,CHO
71,,SING,N25,C26,no,N,71,,70020,17551,CHO
72,,SING,N25,HN,no,N,72,,70020,17551,CHO
73,,SING,C26,C27,no,N,73,,70020,17551,CHO
74,,SING,C26,H261,no,N,74,,70020,17551,CHO
75,,SING,C26,H262,no,N,75,,70020,17551,CHO
76,,DOUB,C27,OT1,no,N,76,,70020,17551,CHO
77,,SING,C27,OT2,no,N,77,,70020,17551,CHO
78,,SING,OT2,HOT,no,N,78,,70020,17551,CHO
1,,SING,N,C5,no,N,1,,70148,17558,DPV
2,,SING,N,C6,no,N,2,,70148,17558,DPV
3,,SING,N,C7,no,N,3,,70148,17558,DPV
4,,SING,N,C8,no,N,4,,70148,17558,DPV
5,,SING,P,O1P,no,N,5,,70148,17558,DPV
6,,DOUB,P,O2P,no,N,6,,70148,17558,DPV
7,,SING,P,O3P,no,N,7,,70148,17558,DPV
8,,SING,P,O4P,no,N,8,,70148,17558,DPV
9,,SING,C1,C2,no,N,9,,70148,17558,DPV
10,,SING,C1,O3P,no,N,10,,70148,17558,DPV
11,,SING,C2,C3,no,N,11,,70148,17558,DPV
12,,SING,C3,C15,no,N,12,,70148,17558,DPV
13,,SING,C4,C5,no,N,13,,70148,17558,DPV
14,,SING,C4,O4P,no,N,14,,70148,17558,DPV
15,,SING,C15,C16,no,N,15,,70148,17558,DPV
16,,SING,C16,C17,no,N,16,,70148,17558,DPV
17,,SING,C17,C18,no,N,17,,70148,17558,DPV
18,,SING,C18,C19,no,N,18,,70148,17558,DPV
19,,SING,C19,C20,no,N,19,,70148,17558,DPV
20,,SING,C20,C21,no,N,20,,70148,17558,DPV
21,,SING,C21,C22,no,N,21,,70148,17558,DPV
22,,SING,C22,C23,no,N,22,,70148,17558,DPV
23,,SING,C1,H1,no,N,23,,70148,17558,DPV
24,,SING,C1,H1A,no,N,24,,70148,17558,DPV
25,,SING,C2,H2,no,N,25,,70148,17558,DPV
26,,SING,C2,H2A,no,N,26,,70148,17558,DPV
27,,SING,C3,H3,no,N,27,,70148,17558,DPV
28,,SING,C3,H3A,no,N,28,,70148,17558,DPV
29,,SING,C4,H4,no,N,29,,70148,17558,DPV
30,,SING,C4,H4A,no,N,30,,70148,17558,DPV
31,,SING,C5,H5,no,N,31,,70148,17558,DPV
32,,SING,C5,H5A,no,N,32,,70148,17558,DPV
33,,SING,C6,H6,no,N,33,,70148,17558,DPV
34,,SING,C6,H6A,no,N,34,,70148,17558,DPV
35,,SING,C6,H6B,no,N,35,,70148,17558,DPV
36,,SING,C7,H7,no,N,36,,70148,17558,DPV
37,,SING,C7,H7A,no,N,37,,70148,17558,DPV
38,,SING,C7,H7B,no,N,38,,70148,17558,DPV
39,,SING,C8,H8,no,N,39,,70148,17558,DPV
40,,SING,C8,H8A,no,N,40,,70148,17558,DPV
41,,SING,C8,H8B,no,N,41,,70148,17558,DPV
42,,SING,C15,H15,no,N,42,,70148,17558,DPV
43,,SING,C15,H15A,no,N,43,,70148,17558,DPV
44,,SING,C16,H16,no,N,44,,70148,17558,DPV
45,,SING,C16,H16A,no,N,45,,70148,17558,DPV
46,,SING,C17,H17,no,N,46,,70148,17558,DPV
47,,SING,C17,H17A,no,N,47,,70148,17558,DPV
48,,SING,C18,H18,no,N,48,,70148,17558,DPV
49,,SING,C18,H18A,no,N,49,,70148,17558,DPV
50,,SING,C19,H19,no,N,50,,70148,17558,DPV
51,,SING,C19,H19A,no,N,51,,70148,17558,DPV
52,,SING,C20,H20,no,N,52,,70148,17558,DPV
53,,SING,C20,H20A,no,N,53,,70148,17558,DPV
54,,SING,C21,H21,no,N,54,,70148,17558,DPV
55,,SING,C21,H21A,no,N,55,,70148,17558,DPV
56,,SING,C22,H22,no,N,56,,70148,17558,DPV
57,,SING,C22,H22A,no,N,57,,70148,17558,DPV
58,,SING,C23,H23,no,N,58,,70148,17558,DPV
59,,SING,C23,H23A,no,N,59,,70148,17558,DPV
60,,SING,C23,H23B,no,N,60,,70148,17558,DPV
1,,SING,C1,C2,no,N,1,,70241,17562,HNE
2,,DOUB,C1,O11,no,N,2,,70241,17562,HNE
3,,SING,C1,H1,no,N,3,,70241,17562,HNE
4,,DOUB,C2,C3,no,N,4,,70241,17562,HNE
5,,SING,C2,H2,no,N,5,,70241,17562,HNE
6,,SING,C3,C4,no,N,6,,70241,17562,HNE
7,,SING,C3,H3,no,N,7,,70241,17562,HNE
8,,SING,C4,C5,no,N,8,,70241,17562,HNE
9,,SING,C4,O10,no,N,9,,70241,17562,HNE
10,,SING,C4,H4,no,N,10,,70241,17562,HNE
11,,SING,C5,C6,no,N,11,,70241,17562,HNE
12,,SING,C5,H5C1,no,N,12,,70241,17562,HNE
13,,SING,C5,H5C2,no,N,13,,70241,17562,HNE
14,,SING,C6,C7,no,N,14,,70241,17562,HNE
15,,SING,C6,H6C1,no,N,15,,70241,17562,HNE
16,,SING,C6,H6C2,no,N,16,,70241,17562,HNE
17,,SING,C7,C8,no,N,17,,70241,17562,HNE
18,,SING,C7,H7C1,no,N,18,,70241,17562,HNE
19,,SING,C7,H7C2,no,N,19,,70241,17562,HNE
20,,SING,C8,C9,no,N,20,,70241,17562,HNE
21,,SING,C8,H8C1,no,N,21,,70241,17562,HNE
22,,SING,C8,H8C2,no,N,22,,70241,17562,HNE
23,,SING,C9,H9C1,no,N,23,,70241,17562,HNE
24,,SING,C9,H9C2,no,N,24,,70241,17562,HNE
25,,SING,C9,H9C3,no,N,25,,70241,17562,HNE
26,,SING,O10,H10,no,N,26,,70241,17562,HNE
1,,SING,N,CA,no,N,1,,70359,17569,M3L
2,,SING,N,H,no,N,2,,70359,17569,M3L
3,,SING,N,H2,no,N,3,,70359,17569,M3L
4,,SING,CA,CB,no,N,4,,70359,17569,M3L
5,,SING,CA,C,no,N,5,,70359,17569,M3L
6,,SING,CA,HA,no,N,6,,70359,17569,M3L
7,,SING,CB,CG,no,N,7,,70359,17569,M3L
8,,SING,CB,HB2,no,N,8,,70359,17569,M3L
9,,SING,CB,HB3,no,N,9,,70359,17569,M3L
10,,SING,CG,CD,no,N,10,,70359,17569,M3L
11,,SING,CG,HG2,no,N,11,,70359,17569,M3L
12,,SING,CG,HG3,no,N,12,,70359,17569,M3L
13,,SING,CD,CE,no,N,13,,70359,17569,M3L
14,,SING,CD,HD2,no,N,14,,70359,17569,M3L
15,,SING,CD,HD3,no,N,15,,70359,17569,M3L
16,,SING,CE,NZ,no,N,16,,70359,17569,M3L
17,,SING,CE,HE2,no,N,17,,70359,17569,M3L
18,,SING,CE,HE3,no,N,18,,70359,17569,M3L
19,,SING,NZ,CM1,no,N,19,,70359,17569,M3L
20,,SING,NZ,CM2,no,N,20,,70359,17569,M3L
21,,SING,NZ,CM3,no,N,21,,70359,17569,M3L
22,,DOUB,C,O,no,N,22,,70359,17569,M3L
23,,SING,C,OXT,no,N,23,,70359,17569,M3L
24,,SING,OXT,HXT,no,N,24,,70359,17569,M3L
25,,SING,CM1,HM11,no,N,25,,70359,17569,M3L
26,,SING,CM1,HM12,no,N,26,,70359,17569,M3L
27,,SING,CM1,HM13,no,N,27,,70359,17569,M3L
28,,SING,CM2,HM21,no,N,28,,70359,17569,M3L
29,,SING,CM2,HM22,no,N,29,,70359,17569,M3L
16,,SING,N3,H3,,,,,117537,20121,T23
30,,SING,CM2,HM23,no,N,30,,70359,17569,M3L
31,,SING,CM3,HM31,no,N,31,,70359,17569,M3L
32,,SING,CM3,HM32,no,N,32,,70359,17569,M3L
33,,SING,CM3,HM33,no,N,33,,70359,17569,M3L
1,,SING,OP3,P,no,N,1,,70428,17572,6IA
2,,SING,OP3,HOP3,no,N,2,,70428,17572,6IA
3,,DOUB,P,OP1,no,N,3,,70428,17572,6IA
4,,SING,P,OP2,no,N,4,,70428,17572,6IA
5,,SING,P,O5',no,N,5,,70428,17572,6IA
6,,SING,OP2,HOP2,no,N,6,,70428,17572,6IA
7,,SING,O5',C5',no,N,7,,70428,17572,6IA
8,,SING,C5',C4',no,N,8,,70428,17572,6IA
9,,SING,C5',H5',no,N,9,,70428,17572,6IA
10,,SING,C5',H5'',no,N,10,,70428,17572,6IA
11,,SING,C4',O4',no,N,11,,70428,17572,6IA
12,,SING,C4',C3',no,N,12,,70428,17572,6IA
13,,SING,C4',H4',no,N,13,,70428,17572,6IA
14,,SING,O4',C1',no,N,14,,70428,17572,6IA
15,,SING,C3',O3',no,N,15,,70428,17572,6IA
16,,SING,C3',C2',no,N,16,,70428,17572,6IA
17,,SING,C3',H3',no,N,17,,70428,17572,6IA
18,,SING,O3',HO3',no,N,18,,70428,17572,6IA
19,,SING,C2',O2',no,N,19,,70428,17572,6IA
20,,SING,C2',C1',no,N,20,,70428,17572,6IA
21,,SING,C2',H2',no,N,21,,70428,17572,6IA
22,,SING,O2',HO2',no,N,22,,70428,17572,6IA
23,,SING,C1',N9,no,N,23,,70428,17572,6IA
24,,SING,C1',H1',no,N,24,,70428,17572,6IA
25,,SING,N9,C8,yes,N,25,,70428,17572,6IA
26,,SING,N9,C4,yes,N,26,,70428,17572,6IA
27,,DOUB,C8,N7,yes,N,27,,70428,17572,6IA
28,,SING,C8,H8,no,N,28,,70428,17572,6IA
29,,SING,N7,C5,yes,N,29,,70428,17572,6IA
30,,SING,C5,C6,yes,N,30,,70428,17572,6IA
31,,DOUB,C5,C4,yes,N,31,,70428,17572,6IA
32,,SING,C6,N6,no,N,32,,70428,17572,6IA
33,,DOUB,C6,N1,yes,N,33,,70428,17572,6IA
34,,SING,N6,C12,no,N,34,,70428,17572,6IA
35,,SING,N6,HN6,no,N,35,,70428,17572,6IA
36,,SING,N1,C2,yes,N,36,,70428,17572,6IA
37,,DOUB,C2,N3,yes,N,37,,70428,17572,6IA
38,,SING,C2,H2,no,N,38,,70428,17572,6IA
39,,SING,N3,C4,yes,N,39,,70428,17572,6IA
40,,SING,C12,C13,no,N,40,,70428,17572,6IA
41,,SING,C12,H121,no,N,41,,70428,17572,6IA
42,,SING,C12,H122,no,N,42,,70428,17572,6IA
43,,SING,C13,C14,no,N,43,,70428,17572,6IA
44,,SING,C13,H131,no,N,44,,70428,17572,6IA
45,,SING,C13,H132,no,N,45,,70428,17572,6IA
46,,SING,C14,C15,no,N,46,,70428,17572,6IA
47,,SING,C14,C16,no,N,47,,70428,17572,6IA
48,,SING,C14,H14,no,N,48,,70428,17572,6IA
49,,SING,C15,H151,no,N,49,,70428,17572,6IA
50,,SING,C15,H152,no,N,50,,70428,17572,6IA
51,,SING,C15,H153,no,N,51,,70428,17572,6IA
52,,SING,C16,H161,no,N,52,,70428,17572,6IA
53,,SING,C16,H162,no,N,53,,70428,17572,6IA
54,,SING,C16,H163,no,N,54,,70428,17572,6IA
1,,SING,OP3,P,no,N,1,,70447,17573,6IA
2,,SING,OP3,HOP3,no,N,2,,70447,17573,6IA
3,,DOUB,P,OP1,no,N,3,,70447,17573,6IA
4,,SING,P,OP2,no,N,4,,70447,17573,6IA
5,,SING,P,O5',no,N,5,,70447,17573,6IA
6,,SING,OP2,HOP2,no,N,6,,70447,17573,6IA
7,,SING,O5',C5',no,N,7,,70447,17573,6IA
8,,SING,C5',C4',no,N,8,,70447,17573,6IA
9,,SING,C5',H5',no,N,9,,70447,17573,6IA
10,,SING,C5',H5'',no,N,10,,70447,17573,6IA
11,,SING,C4',O4',no,N,11,,70447,17573,6IA
12,,SING,C4',C3',no,N,12,,70447,17573,6IA
13,,SING,C4',H4',no,N,13,,70447,17573,6IA
14,,SING,O4',C1',no,N,14,,70447,17573,6IA
15,,SING,C3',O3',no,N,15,,70447,17573,6IA
16,,SING,C3',C2',no,N,16,,70447,17573,6IA
17,,SING,C3',H3',no,N,17,,70447,17573,6IA
18,,SING,O3',HO3',no,N,18,,70447,17573,6IA
19,,SING,C2',O2',no,N,19,,70447,17573,6IA
20,,SING,C2',C1',no,N,20,,70447,17573,6IA
21,,SING,C2',H2',no,N,21,,70447,17573,6IA
22,,SING,O2',HO2',no,N,22,,70447,17573,6IA
23,,SING,C1',N9,no,N,23,,70447,17573,6IA
24,,SING,C1',H1',no,N,24,,70447,17573,6IA
25,,SING,N9,C8,yes,N,25,,70447,17573,6IA
26,,SING,N9,C4,yes,N,26,,70447,17573,6IA
27,,DOUB,C8,N7,yes,N,27,,70447,17573,6IA
28,,SING,C8,H8,no,N,28,,70447,17573,6IA
29,,SING,N7,C5,yes,N,29,,70447,17573,6IA
30,,SING,C5,C6,yes,N,30,,70447,17573,6IA
31,,DOUB,C5,C4,yes,N,31,,70447,17573,6IA
32,,SING,C6,N6,no,N,32,,70447,17573,6IA
33,,DOUB,C6,N1,yes,N,33,,70447,17573,6IA
34,,SING,N6,C12,no,N,34,,70447,17573,6IA
35,,SING,N6,HN6,no,N,35,,70447,17573,6IA
36,,SING,N1,C2,yes,N,36,,70447,17573,6IA
37,,DOUB,C2,N3,yes,N,37,,70447,17573,6IA
38,,SING,C2,H2,no,N,38,,70447,17573,6IA
39,,SING,N3,C4,yes,N,39,,70447,17573,6IA
40,,SING,C12,C13,no,N,40,,70447,17573,6IA
41,,SING,C12,H121,no,N,41,,70447,17573,6IA
42,,SING,C12,H122,no,N,42,,70447,17573,6IA
43,,SING,C13,C14,no,N,43,,70447,17573,6IA
44,,SING,C13,H131,no,N,44,,70447,17573,6IA
45,,SING,C13,H132,no,N,45,,70447,17573,6IA
46,,SING,C14,C15,no,N,46,,70447,17573,6IA
17,,DOUB,C4,O4,,,,,117537,20121,T23
47,,SING,C14,C16,no,N,47,,70447,17573,6IA
48,,SING,C14,H14,no,N,48,,70447,17573,6IA
49,,SING,C15,H151,no,N,49,,70447,17573,6IA
50,,SING,C15,H152,no,N,50,,70447,17573,6IA
51,,SING,C15,H153,no,N,51,,70447,17573,6IA
52,,SING,C16,H161,no,N,52,,70447,17573,6IA
53,,SING,C16,H162,no,N,53,,70447,17573,6IA
54,,SING,C16,H163,no,N,54,,70447,17573,6IA
1,,SING,N1,C2,no,N,1,,70448,17573,PSU
2,,SING,N1,C6,no,N,2,,70448,17573,PSU
3,,SING,N1,HN1,no,N,3,,70448,17573,PSU
4,,SING,C2,N3,no,N,4,,70448,17573,PSU
5,,DOUB,C2,O2,no,N,5,,70448,17573,PSU
6,,SING,N3,C4,no,N,6,,70448,17573,PSU
7,,SING,N3,HN3,no,N,7,,70448,17573,PSU
8,,SING,C4,C5,no,N,8,,70448,17573,PSU
9,,DOUB,C4,O4,no,N,9,,70448,17573,PSU
10,,DOUB,C5,C6,no,N,10,,70448,17573,PSU
11,,SING,C5,C1',no,N,11,,70448,17573,PSU
12,,SING,C6,H6,no,N,12,,70448,17573,PSU
13,,SING,C1',C2',no,N,13,,70448,17573,PSU
14,,SING,C1',O4',no,N,14,,70448,17573,PSU
15,,SING,C1',H1',no,N,15,,70448,17573,PSU
16,,SING,C2',O2',no,N,16,,70448,17573,PSU
17,,SING,C2',C3',no,N,17,,70448,17573,PSU
18,,SING,C2',H2',no,N,18,,70448,17573,PSU
19,,SING,O2',HO2',no,N,19,,70448,17573,PSU
20,,SING,C3',C4',no,N,20,,70448,17573,PSU
21,,SING,C3',O3',no,N,21,,70448,17573,PSU
22,,SING,C3',H3',no,N,22,,70448,17573,PSU
23,,SING,C4',O4',no,N,23,,70448,17573,PSU
24,,SING,C4',C5',no,N,24,,70448,17573,PSU
25,,SING,C4',H4',no,N,25,,70448,17573,PSU
26,,SING,O3',HO3',no,N,26,,70448,17573,PSU
27,,SING,C5',O5',no,N,27,,70448,17573,PSU
28,,SING,C5',H5',no,N,28,,70448,17573,PSU
29,,SING,C5',H5'',no,N,29,,70448,17573,PSU
30,,SING,O5',P,no,N,30,,70448,17573,PSU
31,,DOUB,P,OP1,no,N,31,,70448,17573,PSU
32,,SING,P,OP2,no,N,32,,70448,17573,PSU
33,,SING,P,OP3,no,N,33,,70448,17573,PSU
34,,SING,OP2,HOP2,no,N,34,,70448,17573,PSU
35,,SING,OP3,HOP3,no,N,35,,70448,17573,PSU
1,,SING,O6,C6,no,N,1,,70528,17577,EB4
2,,SING,O6,HO6,no,N,2,,70528,17577,EB4
3,,SING,O4,HO4,no,N,3,,70528,17577,EB4
4,,SING,O5,C5,no,N,4,,70528,17577,EB4
5,,SING,O5,HO5,no,N,5,,70528,17577,EB4
6,,SING,N1,C22,no,N,6,,70528,17577,EB4
7,,SING,N1,HN1,no,N,7,,70528,17577,EB4
8,,DOUB,C5,C2,yes,N,8,,70528,17577,EB4
9,,SING,C5,C8,yes,N,9,,70528,17577,EB4
10,,SING,C4,O4,no,N,10,,70528,17577,EB4
11,,SING,C4,C1,yes,N,11,,70528,17577,EB4
12,,SING,C1,O1,no,N,12,,70528,17577,EB4
13,,SING,C2,C17,yes,N,13,,70528,17577,EB4
14,,SING,C6,C3,yes,N,14,,70528,17577,EB4
15,,DOUB,C8,C11,yes,N,15,,70528,17577,EB4
16,,SING,C8,H8,no,N,16,,70528,17577,EB4
17,,SING,N2,C23,no,N,17,,70528,17577,EB4
18,,SING,N2,HN2,no,N,18,,70528,17577,EB4
19,,DOUB,C9,C6,yes,N,19,,70528,17577,EB4
20,,SING,C9,C12,yes,N,20,,70528,17577,EB4
21,,SING,C9,H9,no,N,21,,70528,17577,EB4
22,,SING,C10,C7,yes,N,22,,70528,17577,EB4
23,,DOUB,C10,C13,yes,N,23,,70528,17577,EB4
24,,SING,C10,H10,no,N,24,,70528,17577,EB4
25,,SING,O3,HO3,no,N,25,,70528,17577,EB4
26,,SING,N3,C21,no,N,26,,70528,17577,EB4
27,,SING,N3,C24,no,N,27,,70528,17577,EB4
28,,SING,N3,HN3,no,N,28,,70528,17577,EB4
29,,DOUB,C16,C1,yes,N,29,,70528,17577,EB4
30,,SING,C16,C19,no,N,30,,70528,17577,EB4
31,,DOUB,C7,C4,yes,N,31,,70528,17577,EB4
32,,SING,C7,H7,no,N,32,,70528,17577,EB4
33,,SING,C3,O3,no,N,33,,70528,17577,EB4
34,,DOUB,C3,C18,yes,N,34,,70528,17577,EB4
35,,SING,C11,C14,yes,N,35,,70528,17577,EB4
36,,SING,C11,H11,no,N,36,,70528,17577,EB4
37,,SING,O1,HO1,no,N,37,,70528,17577,EB4
38,,SING,O2,C2,no,N,38,,70528,17577,EB4
39,,SING,O2,HO2,no,N,39,,70528,17577,EB4
40,,DOUB,C12,C15,yes,N,40,,70528,17577,EB4
41,,SING,C12,H12,no,N,41,,70528,17577,EB4
42,,SING,C15,C18,yes,N,42,,70528,17577,EB4
43,,SING,C15,H15,no,N,43,,70528,17577,EB4
44,,SING,C14,H14,no,N,44,,70528,17577,EB4
45,,SING,C13,C16,yes,N,45,,70528,17577,EB4
46,,SING,C13,H13,no,N,46,,70528,17577,EB4
47,,DOUB,O7,C19,no,N,47,,70528,17577,EB4
48,,SING,C19,N1,no,N,48,,70528,17577,EB4
49,,SING,C22,C25,no,N,49,,70528,17577,EB4
50,,SING,C22,C28,no,N,50,,70528,17577,EB4
51,,SING,C22,H22,no,N,51,,70528,17577,EB4
52,,SING,C25,O15,no,N,52,,70528,17577,EB4
53,,DOUB,O10,C25,no,N,53,,70528,17577,EB4
54,,SING,O15,C30,no,N,54,,70528,17577,EB4
55,,SING,C30,C24,no,N,55,,70528,17577,EB4
56,,SING,C30,H30,no,N,56,,70528,17577,EB4
57,,SING,C30,H30A,no,N,57,,70528,17577,EB4
58,,SING,C24,H24,no,N,58,,70528,17577,EB4
59,,DOUB,C21,O9,no,N,59,,70528,17577,EB4
60,,SING,C18,C21,no,N,60,,70528,17577,EB4
61,,SING,C27,C24,no,N,61,,70528,17577,EB4
62,,SING,C27,O14,no,N,62,,70528,17577,EB4
63,,DOUB,O12,C27,no,N,63,,70528,17577,EB4
64,,SING,C28,H28,no,N,64,,70528,17577,EB4
65,,SING,C28,H28A,no,N,65,,70528,17577,EB4
66,,SING,O13,C28,no,N,66,,70528,17577,EB4
67,,SING,O13,C26,no,N,67,,70528,17577,EB4
68,,SING,C26,C23,no,N,68,,70528,17577,EB4
69,,DOUB,O11,C26,no,N,69,,70528,17577,EB4
70,,SING,C23,C29,no,N,70,,70528,17577,EB4
71,,SING,C23,H23,no,N,71,,70528,17577,EB4
72,,SING,C29,O14,no,N,72,,70528,17577,EB4
73,,SING,C29,H29,no,N,73,,70528,17577,EB4
74,,SING,C29,H29A,no,N,74,,70528,17577,EB4
75,,SING,C20,N2,no,N,75,,70528,17577,EB4
76,,DOUB,O8,C20,no,N,76,,70528,17577,EB4
77,,DOUB,C17,C14,yes,N,77,,70528,17577,EB4
78,,SING,C17,C20,no,N,78,,70528,17577,EB4
1,,SING,C1,C2,no,N,1,,70530,17577,ACD
2,,DOUB,C1,O1,no,N,2,,70530,17577,ACD
3,,SING,C1,O2,no,N,3,,70530,17577,ACD
4,,SING,C2,C3,no,N,4,,70530,17577,ACD
5,,SING,C2,H21,no,N,5,,70530,17577,ACD
6,,SING,C2,H22,no,N,6,,70530,17577,ACD
7,,SING,C3,C4,no,N,7,,70530,17577,ACD
8,,SING,C3,H31,no,N,8,,70530,17577,ACD
9,,SING,C3,H32,no,N,9,,70530,17577,ACD
10,,SING,C4,C5,no,N,10,,70530,17577,ACD
11,,SING,C4,H41,no,N,11,,70530,17577,ACD
12,,SING,C4,H42,no,N,12,,70530,17577,ACD
13,,DOUB,C5,C6,no,Z,13,,70530,17577,ACD
14,,SING,C5,H5,no,N,14,,70530,17577,ACD
15,,SING,C6,C7,no,N,15,,70530,17577,ACD
16,,SING,C6,H6,no,N,16,,70530,17577,ACD
17,,SING,C7,C8,no,N,17,,70530,17577,ACD
18,,SING,C7,H71,no,N,18,,70530,17577,ACD
19,,SING,C7,H72,no,N,19,,70530,17577,ACD
20,,DOUB,C8,C9,no,Z,20,,70530,17577,ACD
21,,SING,C8,H8,no,N,21,,70530,17577,ACD
22,,SING,C9,C10,no,N,22,,70530,17577,ACD
23,,SING,C9,H9,no,N,23,,70530,17577,ACD
24,,SING,C10,C11,no,N,24,,70530,17577,ACD
25,,SING,C10,H101,no,N,25,,70530,17577,ACD
26,,SING,C10,H102,no,N,26,,70530,17577,ACD
27,,DOUB,C11,C12,no,Z,27,,70530,17577,ACD
28,,SING,C11,H11,no,N,28,,70530,17577,ACD
29,,SING,C12,C13,no,N,29,,70530,17577,ACD
30,,SING,C12,H12,no,N,30,,70530,17577,ACD
31,,SING,C13,C14,no,N,31,,70530,17577,ACD
32,,SING,C13,H131,no,N,32,,70530,17577,ACD
33,,SING,C13,H132,no,N,33,,70530,17577,ACD
34,,DOUB,C14,C15,no,Z,34,,70530,17577,ACD
35,,SING,C14,H14,no,N,35,,70530,17577,ACD
36,,SING,C15,C16,no,N,36,,70530,17577,ACD
37,,SING,C15,H15,no,N,37,,70530,17577,ACD
38,,SING,C16,C17,no,N,38,,70530,17577,ACD
39,,SING,C16,H161,no,N,39,,70530,17577,ACD
40,,SING,C16,H162,no,N,40,,70530,17577,ACD
41,,SING,C17,C18,no,N,41,,70530,17577,ACD
42,,SING,C17,H171,no,N,42,,70530,17577,ACD
43,,SING,C17,H172,no,N,43,,70530,17577,ACD
44,,SING,C18,C19,no,N,44,,70530,17577,ACD
45,,SING,C18,H181,no,N,45,,70530,17577,ACD
46,,SING,C18,H182,no,N,46,,70530,17577,ACD
47,,SING,C19,C20,no,N,47,,70530,17577,ACD
48,,SING,C19,H191,no,N,48,,70530,17577,ACD
49,,SING,C19,H192,no,N,49,,70530,17577,ACD
50,,SING,C20,H201,no,N,50,,70530,17577,ACD
51,,SING,C20,H202,no,N,51,,70530,17577,ACD
52,,SING,C20,H203,no,N,52,,70530,17577,ACD
53,,SING,O2,HO2,no,N,53,,70530,17577,ACD
1,,SING,N,CA,no,N,1,,70605,17581,PCA
2,,SING,N,CD,no,N,2,,70605,17581,PCA
3,,SING,N,H,no,N,3,,70605,17581,PCA
4,,SING,CA,CB,no,N,4,,70605,17581,PCA
5,,SING,CA,C,no,N,5,,70605,17581,PCA
6,,SING,CA,HA,no,N,6,,70605,17581,PCA
7,,SING,CB,CG,no,N,7,,70605,17581,PCA
8,,SING,CB,HB2,no,N,8,,70605,17581,PCA
9,,SING,CB,HB3,no,N,9,,70605,17581,PCA
10,,SING,CG,CD,no,N,10,,70605,17581,PCA
11,,SING,CG,HG2,no,N,11,,70605,17581,PCA
12,,SING,CG,HG3,no,N,12,,70605,17581,PCA
13,,DOUB,CD,OE,no,N,13,,70605,17581,PCA
14,,DOUB,C,O,no,N,14,,70605,17581,PCA
15,,SING,C,OXT,no,N,15,,70605,17581,PCA
16,,SING,OXT,HXT,no,N,16,,70605,17581,PCA
1,,SING,N,CA,no,N,1,,70644,17583,DSG
2,,SING,N,H,no,N,2,,70644,17583,DSG
3,,SING,N,H2,no,N,3,,70644,17583,DSG
4,,SING,CA,C,no,N,4,,70644,17583,DSG
5,,SING,CA,CB,no,N,5,,70644,17583,DSG
6,,SING,CA,HA,no,N,6,,70644,17583,DSG
7,,DOUB,C,O,no,N,7,,70644,17583,DSG
8,,SING,C,OXT,no,N,8,,70644,17583,DSG
9,,SING,CB,CG,no,N,9,,70644,17583,DSG
10,,SING,CB,HB2,no,N,10,,70644,17583,DSG
11,,SING,CB,HB3,no,N,11,,70644,17583,DSG
12,,DOUB,CG,OD1,no,N,12,,70644,17583,DSG
13,,SING,CG,ND2,no,N,13,,70644,17583,DSG
14,,SING,ND2,HD21,no,N,14,,70644,17583,DSG
15,,SING,ND2,HD22,no,N,15,,70644,17583,DSG
16,,SING,OXT,HXT,no,N,16,,70644,17583,DSG
1,,SING,N,CA,no,N,1,,70645,17583,DTH
2,,SING,N,H,no,N,2,,70645,17583,DTH
3,,SING,N,HN2,no,N,3,,70645,17583,DTH
4,,SING,CA,CB,no,N,4,,70645,17583,DTH
5,,SING,CA,C,no,N,5,,70645,17583,DTH
6,,SING,CA,HA,no,N,6,,70645,17583,DTH
7,,SING,CB,CG2,no,N,7,,70645,17583,DTH
8,,SING,CB,OG1,no,N,8,,70645,17583,DTH
9,,SING,CB,HB,no,N,9,,70645,17583,DTH
10,,SING,CG2,HG21,no,N,10,,70645,17583,DTH
11,,SING,CG2,HG22,no,N,11,,70645,17583,DTH
12,,SING,CG2,HG23,no,N,12,,70645,17583,DTH
13,,SING,OG1,HG1,no,N,13,,70645,17583,DTH
14,,DOUB,C,O,no,N,14,,70645,17583,DTH
15,,SING,C,OXT,no,N,15,,70645,17583,DTH
16,,SING,OXT,HXT,no,N,16,,70645,17583,DTH
1,,SING,N,CA,no,N,1,,70646,17583,DSN
2,,SING,N,H,no,N,2,,70646,17583,DSN
3,,SING,N,H2,no,N,3,,70646,17583,DSN
4,,SING,CA,C,no,N,4,,70646,17583,DSN
5,,SING,CA,CB,no,N,5,,70646,17583,DSN
6,,SING,CA,HA,no,N,6,,70646,17583,DSN
7,,DOUB,C,O,no,N,7,,70646,17583,DSN
8,,SING,C,OXT,no,N,8,,70646,17583,DSN
9,,SING,OXT,HXT,no,N,9,,70646,17583,DSN
10,,SING,CB,OG,no,N,10,,70646,17583,DSN
11,,SING,CB,HB2,no,N,11,,70646,17583,DSN
12,,SING,CB,HB3,no,N,12,,70646,17583,DSN
13,,SING,OG,HG,no,N,13,,70646,17583,DSN
1,,DOUB,PG,O1G,no,N,1,,71162,17610,GNP
2,,SING,PG,O2G,no,N,2,,71162,17610,GNP
3,,SING,PG,O3G,no,N,3,,71162,17610,GNP
4,,SING,PG,N3B,no,N,4,,71162,17610,GNP
5,,SING,O2G,HOG2,no,N,5,,71162,17610,GNP
6,,SING,O3G,HOG3,no,N,6,,71162,17610,GNP
7,,SING,N3B,PB,no,N,7,,71162,17610,GNP
8,,SING,N3B,HNB3,no,N,8,,71162,17610,GNP
9,,DOUB,PB,O1B,no,N,9,,71162,17610,GNP
10,,SING,PB,O2B,no,N,10,,71162,17610,GNP
11,,SING,PB,O3A,no,N,11,,71162,17610,GNP
12,,SING,O2B,HOB2,no,N,12,,71162,17610,GNP
13,,SING,O3A,PA,no,N,13,,71162,17610,GNP
14,,DOUB,PA,O1A,no,N,14,,71162,17610,GNP
15,,SING,PA,O2A,no,N,15,,71162,17610,GNP
16,,SING,PA,O5',no,N,16,,71162,17610,GNP
17,,SING,O2A,HOA2,no,N,17,,71162,17610,GNP
18,,SING,O5',C5',no,N,18,,71162,17610,GNP
19,,SING,C5',C4',no,N,19,,71162,17610,GNP
20,,SING,C5',H5'2,no,N,20,,71162,17610,GNP
21,,SING,C5',H5'1,no,N,21,,71162,17610,GNP
22,,SING,C4',O4',no,N,22,,71162,17610,GNP
23,,SING,C4',C3',no,N,23,,71162,17610,GNP
24,,SING,C4',H4',no,N,24,,71162,17610,GNP
25,,SING,O4',C1',no,N,25,,71162,17610,GNP
26,,SING,C3',O3',no,N,26,,71162,17610,GNP
27,,SING,C3',C2',no,N,27,,71162,17610,GNP
28,,SING,C3',H3',no,N,28,,71162,17610,GNP
29,,SING,O3',HO3',no,N,29,,71162,17610,GNP
30,,SING,C2',O2',no,N,30,,71162,17610,GNP
31,,SING,C2',C1',no,N,31,,71162,17610,GNP
32,,SING,C2',H2',no,N,32,,71162,17610,GNP
33,,SING,O2',HO2',no,N,33,,71162,17610,GNP
34,,SING,C1',N9,no,N,34,,71162,17610,GNP
35,,SING,C1',H1',no,N,35,,71162,17610,GNP
36,,SING,N9,C8,yes,N,36,,71162,17610,GNP
37,,SING,N9,C4,yes,N,37,,71162,17610,GNP
38,,DOUB,C8,N7,yes,N,38,,71162,17610,GNP
39,,SING,C8,H8,no,N,39,,71162,17610,GNP
40,,SING,N7,C5,yes,N,40,,71162,17610,GNP
41,,SING,C5,C6,yes,N,41,,71162,17610,GNP
42,,DOUB,C5,C4,yes,N,42,,71162,17610,GNP
43,,DOUB,C6,O6,no,N,43,,71162,17610,GNP
44,,SING,C6,N1,yes,N,44,,71162,17610,GNP
45,,SING,N1,C2,yes,N,45,,71162,17610,GNP
46,,SING,N1,HN1,no,N,46,,71162,17610,GNP
47,,SING,C2,N2,no,N,47,,71162,17610,GNP
48,,DOUB,C2,N3,yes,N,48,,71162,17610,GNP
49,,SING,N2,HN21,no,N,49,,71162,17610,GNP
50,,SING,N2,HN22,no,N,50,,71162,17610,GNP
51,,SING,N3,C4,yes,N,51,,71162,17610,GNP
1,,DOUB,C,O,no,N,1,,71344,17618,ACE
2,,SING,C,CH3,no,N,2,,71344,17618,ACE
3,,SING,C,H,no,N,3,,71344,17618,ACE
4,,SING,CH3,H1,no,N,4,,71344,17618,ACE
5,,SING,CH3,H2,no,N,5,,71344,17618,ACE
6,,SING,CH3,H3,no,N,6,,71344,17618,ACE
1,,SING,CA,N,no,N,1,,71345,17618,ETA
2,,SING,CA,CB,no,N,2,,71345,17618,ETA
3,,SING,CA,HA1,no,N,3,,71345,17618,ETA
4,,SING,CA,HA2,no,N,4,,71345,17618,ETA
5,,SING,N,HN1,no,N,5,,71345,17618,ETA
6,,SING,N,HN2,no,N,6,,71345,17618,ETA
7,,SING,CB,O,no,N,7,,71345,17618,ETA
8,,SING,CB,HB1,no,N,8,,71345,17618,ETA
9,,SING,CB,HB2,no,N,9,,71345,17618,ETA
10,,SING,O,HO,no,N,10,,71345,17618,ETA
1,,DOUB,C,O,no,N,1,,71369,17619,ACE
2,,SING,C,CH3,no,N,2,,71369,17619,ACE
3,,SING,C,H,no,N,3,,71369,17619,ACE
4,,SING,CH3,H1,no,N,4,,71369,17619,ACE
5,,SING,CH3,H2,no,N,5,,71369,17619,ACE
6,,SING,CH3,H3,no,N,6,,71369,17619,ACE
1,,SING,CA,N,no,N,1,,71370,17619,ETA
2,,SING,CA,CB,no,N,2,,71370,17619,ETA
3,,SING,CA,HA1,no,N,3,,71370,17619,ETA
4,,SING,CA,HA2,no,N,4,,71370,17619,ETA
5,,SING,N,HN1,no,N,5,,71370,17619,ETA
6,,SING,N,HN2,no,N,6,,71370,17619,ETA
7,,SING,CB,O,no,N,7,,71370,17619,ETA
8,,SING,CB,HB1,no,N,8,,71370,17619,ETA
9,,SING,CB,HB2,no,N,9,,71370,17619,ETA
10,,SING,O,HO,no,N,10,,71370,17619,ETA
1,,SING,C1A,C2A,no,N,1,,71472,17625,MAB
2,,SING,C1A,O5A,no,N,2,,71472,17625,MAB
3,,SING,C1A,O1A,no,N,3,,71472,17625,MAB
4,,SING,C1A,H1A,no,N,4,,71472,17625,MAB
5,,SING,C2A,C3A,no,N,5,,71472,17625,MAB
6,,SING,C2A,O2A,no,N,6,,71472,17625,MAB
7,,SING,C2A,H2A,no,N,7,,71472,17625,MAB
8,,SING,C3A,C4A,no,N,8,,71472,17625,MAB
9,,SING,C3A,O3A,no,N,9,,71472,17625,MAB
10,,SING,C3A,H3A,no,N,10,,71472,17625,MAB
11,,SING,C4A,C5A,no,N,11,,71472,17625,MAB
12,,SING,C4A,O4A,no,N,12,,71472,17625,MAB
13,,SING,C4A,H4A,no,N,13,,71472,17625,MAB
14,,SING,C5A,C6A,no,N,14,,71472,17625,MAB
15,,SING,C5A,O5A,no,N,15,,71472,17625,MAB
16,,SING,C5A,H5A,no,N,16,,71472,17625,MAB
17,,SING,C6A,O6A,no,N,17,,71472,17625,MAB
18,,SING,C6A,H6A2,no,N,18,,71472,17625,MAB
19,,SING,C6A,H6A1,no,N,19,,71472,17625,MAB
20,,SING,O2A,H2O1,no,N,20,,71472,17625,MAB
21,,SING,O3A,H3O1,no,N,21,,71472,17625,MAB
22,,SING,O4A,C1B,no,N,22,,71472,17625,MAB
23,,SING,O6A,H6A,no,N,23,,71472,17625,MAB
24,,SING,C1B,C2B,no,N,24,,71472,17625,MAB
25,,SING,C1B,O5B,no,N,25,,71472,17625,MAB
26,,SING,C1B,H1B,no,N,26,,71472,17625,MAB
27,,SING,C2B,C3B,no,N,27,,71472,17625,MAB
28,,SING,C2B,O2B,no,N,28,,71472,17625,MAB
29,,SING,C2B,H2B,no,N,29,,71472,17625,MAB
30,,SING,C3B,C4B,no,N,30,,71472,17625,MAB
31,,SING,C3B,O3B,no,N,31,,71472,17625,MAB
32,,SING,C3B,H3B,no,N,32,,71472,17625,MAB
33,,SING,C4B,C5B,no,N,33,,71472,17625,MAB
34,,SING,C4B,O4B,no,N,34,,71472,17625,MAB
35,,SING,C4B,H4B,no,N,35,,71472,17625,MAB
36,,SING,C5B,C6B,no,N,36,,71472,17625,MAB
37,,SING,C5B,O5B,no,N,37,,71472,17625,MAB
38,,SING,C5B,H5B,no,N,38,,71472,17625,MAB
39,,SING,C6B,O6B,no,N,39,,71472,17625,MAB
40,,SING,C6B,H6B2,no,N,40,,71472,17625,MAB
41,,SING,C6B,H6B1,no,N,41,,71472,17625,MAB
42,,SING,O2B,H2O2,no,N,42,,71472,17625,MAB
43,,SING,O3B,H3O2,no,N,43,,71472,17625,MAB
44,,SING,O4B,H4O1,no,N,44,,71472,17625,MAB
45,,SING,O6B,H6B,no,N,45,,71472,17625,MAB
46,,SING,O1A,H1O1,no,N,46,,71472,17625,MAB
1,,SING,N,CA,no,N,1,,71610,17632,PTR
2,,SING,N,H,no,N,2,,71610,17632,PTR
3,,SING,N,HN2,no,N,3,,71610,17632,PTR
4,,SING,CA,C,no,N,4,,71610,17632,PTR
5,,SING,CA,CB,no,N,5,,71610,17632,PTR
6,,SING,CA,HA,no,N,6,,71610,17632,PTR
7,,DOUB,C,O,no,N,7,,71610,17632,PTR
8,,SING,C,OXT,no,N,8,,71610,17632,PTR
9,,SING,OXT,HXT,no,N,9,,71610,17632,PTR
10,,SING,CB,CG,no,N,10,,71610,17632,PTR
11,,SING,CB,HB2,no,N,11,,71610,17632,PTR
12,,SING,CB,HB3,no,N,12,,71610,17632,PTR
13,,DOUB,CG,CD1,yes,N,13,,71610,17632,PTR
14,,SING,CG,CD2,yes,N,14,,71610,17632,PTR
15,,SING,CD1,CE1,yes,N,15,,71610,17632,PTR
16,,SING,CD1,HD1,no,N,16,,71610,17632,PTR
17,,DOUB,CD2,CE2,yes,N,17,,71610,17632,PTR
18,,SING,CD2,HD2,no,N,18,,71610,17632,PTR
19,,DOUB,CE1,CZ,yes,N,19,,71610,17632,PTR
20,,SING,CE1,HE1,no,N,20,,71610,17632,PTR
21,,SING,CE2,CZ,yes,N,21,,71610,17632,PTR
22,,SING,CE2,HE2,no,N,22,,71610,17632,PTR
23,,SING,CZ,OH,no,N,23,,71610,17632,PTR
24,,SING,OH,P,no,N,24,,71610,17632,PTR
25,,DOUB,P,O1P,no,N,25,,71610,17632,PTR
26,,SING,P,O2P,no,N,26,,71610,17632,PTR
27,,SING,P,O3P,no,N,27,,71610,17632,PTR
28,,SING,O2P,HO2P,no,N,28,,71610,17632,PTR
29,,SING,O3P,HO3P,no,N,29,,71610,17632,PTR
1,,SING,N1,C2,yes,N,1,,71744,17640,FMN
2,,DOUB,N1,C10,yes,N,2,,71744,17640,FMN
3,,DOUB,C2,O2,no,N,3,,71744,17640,FMN
4,,SING,C2,N3,yes,N,4,,71744,17640,FMN
5,,SING,N3,C4,yes,N,5,,71744,17640,FMN
6,,SING,N3,HN3,no,N,6,,71744,17640,FMN
7,,DOUB,C4,O4,no,N,7,,71744,17640,FMN
8,,SING,C4,C4A,yes,N,8,,71744,17640,FMN
9,,DOUB,C4A,N5,yes,N,9,,71744,17640,FMN
10,,SING,C4A,C10,no,N,10,,71744,17640,FMN
11,,SING,N5,C5A,yes,N,11,,71744,17640,FMN
12,,DOUB,C5A,C6,yes,N,12,,71744,17640,FMN
13,,SING,C5A,C9A,yes,N,13,,71744,17640,FMN
14,,SING,C6,C7,yes,N,14,,71744,17640,FMN
15,,SING,C6,H6,no,N,15,,71744,17640,FMN
16,,SING,C7,C7M,no,N,16,,71744,17640,FMN
17,,DOUB,C7,C8,yes,N,17,,71744,17640,FMN
18,,SING,C7M,HM71,no,N,18,,71744,17640,FMN
19,,SING,C7M,HM72,no,N,19,,71744,17640,FMN
20,,SING,C7M,HM73,no,N,20,,71744,17640,FMN
21,,SING,C8,C8M,no,N,21,,71744,17640,FMN
22,,SING,C8,C9,yes,N,22,,71744,17640,FMN
23,,SING,C8M,HM81,no,N,23,,71744,17640,FMN
24,,SING,C8M,HM82,no,N,24,,71744,17640,FMN
25,,SING,C8M,HM83,no,N,25,,71744,17640,FMN
26,,DOUB,C9,C9A,yes,N,26,,71744,17640,FMN
27,,SING,C9,H9,no,N,27,,71744,17640,FMN
28,,SING,C9A,N10,yes,N,28,,71744,17640,FMN
29,,SING,N10,C10,yes,N,29,,71744,17640,FMN
30,,SING,N10,C1',no,N,30,,71744,17640,FMN
31,,SING,C1',C2',no,N,31,,71744,17640,FMN
32,,SING,C1',H1'1,no,N,32,,71744,17640,FMN
33,,SING,C1',H1'2,no,N,33,,71744,17640,FMN
34,,SING,C2',O2',no,N,34,,71744,17640,FMN
35,,SING,C2',C3',no,N,35,,71744,17640,FMN
36,,SING,C2',H2',no,N,36,,71744,17640,FMN
37,,SING,O2',HO2',no,N,37,,71744,17640,FMN
38,,SING,C3',O3',no,N,38,,71744,17640,FMN
39,,SING,C3',C4',no,N,39,,71744,17640,FMN
40,,SING,C3',H3',no,N,40,,71744,17640,FMN
41,,SING,O3',HO3',no,N,41,,71744,17640,FMN
42,,SING,C4',O4',no,N,42,,71744,17640,FMN
43,,SING,C4',C5',no,N,43,,71744,17640,FMN
44,,SING,C4',H4',no,N,44,,71744,17640,FMN
45,,SING,O4',HO4',no,N,45,,71744,17640,FMN
46,,SING,C5',O5',no,N,46,,71744,17640,FMN
47,,SING,C5',H5'1,no,N,47,,71744,17640,FMN
48,,SING,C5',H5'2,no,N,48,,71744,17640,FMN
49,,SING,O5',P,no,N,49,,71744,17640,FMN
50,,DOUB,P,O1P,no,N,50,,71744,17640,FMN
51,,SING,P,O2P,no,N,51,,71744,17640,FMN
52,,SING,P,O3P,no,N,52,,71744,17640,FMN
53,,SING,O2P,HOP2,no,N,53,,71744,17640,FMN
54,,SING,O3P,HOP3,no,N,54,,71744,17640,FMN
1,,SING,N1,C2,yes,N,1,,71792,17643,FMN
2,,DOUB,N1,C10,yes,N,2,,71792,17643,FMN
3,,DOUB,C2,O2,no,N,3,,71792,17643,FMN
4,,SING,C2,N3,yes,N,4,,71792,17643,FMN
5,,SING,N3,C4,yes,N,5,,71792,17643,FMN
6,,SING,N3,HN3,no,N,6,,71792,17643,FMN
7,,DOUB,C4,O4,no,N,7,,71792,17643,FMN
8,,SING,C4,C4A,yes,N,8,,71792,17643,FMN
9,,DOUB,C4A,N5,yes,N,9,,71792,17643,FMN
10,,SING,C4A,C10,no,N,10,,71792,17643,FMN
11,,SING,N5,C5A,yes,N,11,,71792,17643,FMN
12,,DOUB,C5A,C6,yes,N,12,,71792,17643,FMN
13,,SING,C5A,C9A,yes,N,13,,71792,17643,FMN
14,,SING,C6,C7,yes,N,14,,71792,17643,FMN
15,,SING,C6,H6,no,N,15,,71792,17643,FMN
16,,SING,C7,C7M,no,N,16,,71792,17643,FMN
17,,DOUB,C7,C8,yes,N,17,,71792,17643,FMN
18,,SING,C7M,HM71,no,N,18,,71792,17643,FMN
19,,SING,C7M,HM72,no,N,19,,71792,17643,FMN
20,,SING,C7M,HM73,no,N,20,,71792,17643,FMN
21,,SING,C8,C8M,no,N,21,,71792,17643,FMN
22,,SING,C8,C9,yes,N,22,,71792,17643,FMN
23,,SING,C8M,HM81,no,N,23,,71792,17643,FMN
24,,SING,C8M,HM82,no,N,24,,71792,17643,FMN
25,,SING,C8M,HM83,no,N,25,,71792,17643,FMN
26,,DOUB,C9,C9A,yes,N,26,,71792,17643,FMN
27,,SING,C9,H9,no,N,27,,71792,17643,FMN
28,,SING,C9A,N10,yes,N,28,,71792,17643,FMN
29,,SING,N10,C10,yes,N,29,,71792,17643,FMN
30,,SING,N10,C1',no,N,30,,71792,17643,FMN
31,,SING,C1',C2',no,N,31,,71792,17643,FMN
32,,SING,C1',H1'1,no,N,32,,71792,17643,FMN
33,,SING,C1',H1'2,no,N,33,,71792,17643,FMN
34,,SING,C2',O2',no,N,34,,71792,17643,FMN
35,,SING,C2',C3',no,N,35,,71792,17643,FMN
36,,SING,C2',H2',no,N,36,,71792,17643,FMN
37,,SING,O2',HO2',no,N,37,,71792,17643,FMN
38,,SING,C3',O3',no,N,38,,71792,17643,FMN
39,,SING,C3',C4',no,N,39,,71792,17643,FMN
40,,SING,C3',H3',no,N,40,,71792,17643,FMN
41,,SING,O3',HO3',no,N,41,,71792,17643,FMN
42,,SING,C4',O4',no,N,42,,71792,17643,FMN
43,,SING,C4',C5',no,N,43,,71792,17643,FMN
44,,SING,C4',H4',no,N,44,,71792,17643,FMN
45,,SING,O4',HO4',no,N,45,,71792,17643,FMN
46,,SING,C5',O5',no,N,46,,71792,17643,FMN
47,,SING,C5',H5'1,no,N,47,,71792,17643,FMN
48,,SING,C5',H5'2,no,N,48,,71792,17643,FMN
49,,SING,O5',P,no,N,49,,71792,17643,FMN
50,,DOUB,P,O1P,no,N,50,,71792,17643,FMN
51,,SING,P,O2P,no,N,51,,71792,17643,FMN
52,,SING,P,O3P,no,N,52,,71792,17643,FMN
53,,SING,O2P,HOP2,no,N,53,,71792,17643,FMN
54,,SING,O3P,HOP3,no,N,54,,71792,17643,FMN
1,,DOUB,C,O,no,N,1,,72034,17657,ACE
2,,SING,C,CH3,no,N,2,,72034,17657,ACE
3,,SING,C,H,no,N,3,,72034,17657,ACE
4,,SING,CH3,H1,no,N,4,,72034,17657,ACE
5,,SING,CH3,H2,no,N,5,,72034,17657,ACE
6,,SING,CH3,H3,no,N,6,,72034,17657,ACE
1,,SING,N,HN1,no,N,1,,72035,17657,NH2
2,,SING,N,HN2,no,N,2,,72035,17657,NH2
1,,SING,C,CA,no,N,1,,72036,17657,MK8
2,,SING,C,O2,no,N,2,,72036,17657,MK8
3,,SING,N,HN,no,N,3,,72036,17657,MK8
4,,SING,N,HNA,no,N,4,,72036,17657,MK8
5,,DOUB,O,C,no,N,5,,72036,17657,MK8
6,,SING,CA,N,no,N,6,,72036,17657,MK8
7,,SING,CA,CB,no,N,7,,72036,17657,MK8
8,,SING,CB,HB,no,N,8,,72036,17657,MK8
9,,SING,CB,HBA,no,N,9,,72036,17657,MK8
10,,SING,CD,CG,no,N,10,,72036,17657,MK8
11,,SING,CD,HD,no,N,11,,72036,17657,MK8
12,,SING,CD,HDA,no,N,12,,72036,17657,MK8
13,,SING,CE,CD,no,N,13,,72036,17657,MK8
14,,SING,CE,HE,no,N,14,,72036,17657,MK8
15,,SING,CE,HEA,no,N,15,,72036,17657,MK8
16,,SING,CE,HEB,no,N,16,,72036,17657,MK8
17,,SING,CG,CB,no,N,17,,72036,17657,MK8
18,,SING,CG,HG,no,N,18,,72036,17657,MK8
19,,SING,CG,HGA,no,N,19,,72036,17657,MK8
20,,SING,CB1,CA,no,N,20,,72036,17657,MK8
21,,SING,CB1,HB1,no,N,21,,72036,17657,MK8
22,,SING,CB1,HB1A,no,N,22,,72036,17657,MK8
23,,SING,CB1,HB1B,no,N,23,,72036,17657,MK8
24,,SING,O2,H15,no,N,24,,72036,17657,MK8
1,,DOUB,C,O,no,N,1,,72055,17658,ACE
2,,SING,C,CH3,no,N,2,,72055,17658,ACE
3,,SING,C,H,no,N,3,,72055,17658,ACE
4,,SING,CH3,H1,no,N,4,,72055,17658,ACE
5,,SING,CH3,H2,no,N,5,,72055,17658,ACE
6,,SING,CH3,H3,no,N,6,,72055,17658,ACE
1,,SING,N,HN1,no,N,1,,72056,17658,NH2
2,,SING,N,HN2,no,N,2,,72056,17658,NH2
1,,SING,C,CA,no,N,1,,72057,17658,MK8
2,,SING,C,O2,no,N,2,,72057,17658,MK8
3,,SING,N,HN,no,N,3,,72057,17658,MK8
4,,SING,N,HNA,no,N,4,,72057,17658,MK8
5,,DOUB,O,C,no,N,5,,72057,17658,MK8
6,,SING,CA,N,no,N,6,,72057,17658,MK8
7,,SING,CA,CB,no,N,7,,72057,17658,MK8
8,,SING,CB,HB,no,N,8,,72057,17658,MK8
9,,SING,CB,HBA,no,N,9,,72057,17658,MK8
10,,SING,CD,CG,no,N,10,,72057,17658,MK8
11,,SING,CD,HD,no,N,11,,72057,17658,MK8
12,,SING,CD,HDA,no,N,12,,72057,17658,MK8
13,,SING,CE,CD,no,N,13,,72057,17658,MK8
14,,SING,CE,HE,no,N,14,,72057,17658,MK8
15,,SING,CE,HEA,no,N,15,,72057,17658,MK8
16,,SING,CE,HEB,no,N,16,,72057,17658,MK8
17,,SING,CG,CB,no,N,17,,72057,17658,MK8
18,,SING,CG,HG,no,N,18,,72057,17658,MK8
19,,SING,CG,HGA,no,N,19,,72057,17658,MK8
20,,SING,CB1,CA,no,N,20,,72057,17658,MK8
21,,SING,CB1,HB1,no,N,21,,72057,17658,MK8
22,,SING,CB1,HB1A,no,N,22,,72057,17658,MK8
23,,SING,CB1,HB1B,no,N,23,,72057,17658,MK8
24,,SING,O2,H15,no,N,24,,72057,17658,MK8
1,,DOUB,C,O,no,N,1,,72076,17659,ACE
2,,SING,C,CH3,no,N,2,,72076,17659,ACE
3,,SING,C,H,no,N,3,,72076,17659,ACE
4,,SING,CH3,H1,no,N,4,,72076,17659,ACE
5,,SING,CH3,H2,no,N,5,,72076,17659,ACE
6,,SING,CH3,H3,no,N,6,,72076,17659,ACE
1,,SING,N,HN1,no,N,1,,72077,17659,NH2
2,,SING,N,HN2,no,N,2,,72077,17659,NH2
1,,SING,C,CA,no,N,1,,72078,17659,MK8
2,,SING,C,O2,no,N,2,,72078,17659,MK8
3,,SING,N,HN,no,N,3,,72078,17659,MK8
4,,SING,N,HNA,no,N,4,,72078,17659,MK8
5,,DOUB,O,C,no,N,5,,72078,17659,MK8
6,,SING,CA,N,no,N,6,,72078,17659,MK8
7,,SING,CA,CB,no,N,7,,72078,17659,MK8
8,,SING,CB,HB,no,N,8,,72078,17659,MK8
9,,SING,CB,HBA,no,N,9,,72078,17659,MK8
10,,SING,CD,CG,no,N,10,,72078,17659,MK8
11,,SING,CD,HD,no,N,11,,72078,17659,MK8
12,,SING,CD,HDA,no,N,12,,72078,17659,MK8
13,,SING,CE,CD,no,N,13,,72078,17659,MK8
14,,SING,CE,HE,no,N,14,,72078,17659,MK8
15,,SING,CE,HEA,no,N,15,,72078,17659,MK8
16,,SING,CE,HEB,no,N,16,,72078,17659,MK8
17,,SING,CG,CB,no,N,17,,72078,17659,MK8
18,,SING,CG,HG,no,N,18,,72078,17659,MK8
19,,SING,CG,HGA,no,N,19,,72078,17659,MK8
20,,SING,CB1,CA,no,N,20,,72078,17659,MK8
21,,SING,CB1,HB1,no,N,21,,72078,17659,MK8
22,,SING,CB1,HB1A,no,N,22,,72078,17659,MK8
23,,SING,CB1,HB1B,no,N,23,,72078,17659,MK8
24,,SING,O2,H15,no,N,24,,72078,17659,MK8
1,,DOUB,PB,O1B,no,N,1,,72111,17660,ADP
2,,SING,PB,O2B,no,N,2,,72111,17660,ADP
3,,SING,PB,O3B,no,N,3,,72111,17660,ADP
4,,SING,PB,O3A,no,N,4,,72111,17660,ADP
5,,SING,O2B,HOB2,no,N,5,,72111,17660,ADP
6,,SING,O3B,HOB3,no,N,6,,72111,17660,ADP
7,,DOUB,PA,O1A,no,N,7,,72111,17660,ADP
8,,SING,PA,O2A,no,N,8,,72111,17660,ADP
9,,SING,PA,O3A,no,N,9,,72111,17660,ADP
10,,SING,PA,O5',no,N,10,,72111,17660,ADP
11,,SING,O2A,HOA2,no,N,11,,72111,17660,ADP
12,,SING,O5',C5',no,N,12,,72111,17660,ADP
13,,SING,C5',C4',no,N,13,,72111,17660,ADP
14,,SING,C5',H5'1,no,N,14,,72111,17660,ADP
15,,SING,C5',H5'2,no,N,15,,72111,17660,ADP
16,,SING,C4',O4',no,N,16,,72111,17660,ADP
17,,SING,C4',C3',no,N,17,,72111,17660,ADP
18,,SING,C4',H4',no,N,18,,72111,17660,ADP
19,,SING,O4',C1',no,N,19,,72111,17660,ADP
20,,SING,C3',O3',no,N,20,,72111,17660,ADP
21,,SING,C3',C2',no,N,21,,72111,17660,ADP
22,,SING,C3',H3',no,N,22,,72111,17660,ADP
23,,SING,O3',HO3',no,N,23,,72111,17660,ADP
24,,SING,C2',O2',no,N,24,,72111,17660,ADP
25,,SING,C2',C1',no,N,25,,72111,17660,ADP
26,,SING,C2',H2',no,N,26,,72111,17660,ADP
27,,SING,O2',HO2',no,N,27,,72111,17660,ADP
28,,SING,C1',N9,no,N,28,,72111,17660,ADP
29,,SING,C1',H1',no,N,29,,72111,17660,ADP
30,,SING,N9,C8,yes,N,30,,72111,17660,ADP
31,,SING,N9,C4,yes,N,31,,72111,17660,ADP
32,,DOUB,C8,N7,yes,N,32,,72111,17660,ADP
33,,SING,C8,H8,no,N,33,,72111,17660,ADP
34,,SING,N7,C5,yes,N,34,,72111,17660,ADP
35,,SING,C5,C6,yes,N,35,,72111,17660,ADP
36,,DOUB,C5,C4,yes,N,36,,72111,17660,ADP
37,,SING,C6,N6,no,N,37,,72111,17660,ADP
38,,DOUB,C6,N1,yes,N,38,,72111,17660,ADP
39,,SING,N6,HN61,no,N,39,,72111,17660,ADP
40,,SING,N6,HN62,no,N,40,,72111,17660,ADP
41,,SING,N1,C2,yes,N,41,,72111,17660,ADP
42,,DOUB,C2,N3,yes,N,42,,72111,17660,ADP
43,,SING,C2,H2,no,N,43,,72111,17660,ADP
44,,SING,N3,C4,yes,N,44,,72111,17660,ADP
1,,SING,CA,CB,no,N,1,,72245,17669,GND
2,,SING,CA,C,no,N,2,,72245,17669,GND
3,,SING,CA,N,no,N,3,,72245,17669,GND
4,,SING,CA,HA,no,N,4,,72245,17669,GND
5,,SING,CB,CG,no,N,5,,72245,17669,GND
6,,SING,CB,HB1,no,N,6,,72245,17669,GND
7,,SING,CB,HB2,no,N,7,,72245,17669,GND
8,,SING,CG,CD,no,N,8,,72245,17669,GND
9,,SING,CG,HG1,no,N,9,,72245,17669,GND
10,,SING,CG,HG2,no,N,10,,72245,17669,GND
11,,SING,CD,NE,no,N,11,,72245,17669,GND
12,,SING,CD,HD1,no,N,12,,72245,17669,GND
13,,SING,CD,HD2,no,N,13,,72245,17669,GND
14,,SING,NE,CZ,no,N,14,,72245,17669,GND
15,,SING,NE,HE,no,N,15,,72245,17669,GND
16,,DOUB,CZ,NH1,no,N,16,,72245,17669,GND
17,,SING,CZ,NH2,no,N,17,,72245,17669,GND
18,,SING,NH1,HH11,no,N,18,,72245,17669,GND
19,,SING,NH2,HH21,no,N,19,,72245,17669,GND
20,,SING,NH2,HH22,no,N,20,,72245,17669,GND
21,,SING,C,OXT,no,N,21,,72245,17669,GND
22,,DOUB,C,O,no,N,22,,72245,17669,GND
23,,SING,OXT,HXT,no,N,23,,72245,17669,GND
24,,SING,N,HN1,no,N,24,,72245,17669,GND
25,,SING,N,HN2,no,N,25,,72245,17669,GND
26,,SING,N,HN3,no,N,26,,72245,17669,GND
1,,DOUB,P,O1P,no,N,1,,72306,17671,5GP
2,,SING,P,O2P,no,N,2,,72306,17671,5GP
3,,SING,P,O3P,no,N,3,,72306,17671,5GP
4,,SING,P,O5',no,N,4,,72306,17671,5GP
5,,SING,O2P,HOP2,no,N,5,,72306,17671,5GP
6,,SING,O3P,HOP3,no,N,6,,72306,17671,5GP
7,,SING,O5',C5',no,N,7,,72306,17671,5GP
8,,SING,C5',C4',no,N,8,,72306,17671,5GP
9,,SING,C5',H5'1,no,N,9,,72306,17671,5GP
10,,SING,C5',H5'2,no,N,10,,72306,17671,5GP
11,,SING,C4',O4',no,N,11,,72306,17671,5GP
12,,SING,C4',C3',no,N,12,,72306,17671,5GP
13,,SING,C4',H4',no,N,13,,72306,17671,5GP
14,,SING,O4',C1',no,N,14,,72306,17671,5GP
15,,SING,C3',O3',no,N,15,,72306,17671,5GP
16,,SING,C3',C2',no,N,16,,72306,17671,5GP
17,,SING,C3',H3',no,N,17,,72306,17671,5GP
18,,SING,O3',HO3',no,N,18,,72306,17671,5GP
19,,SING,C2',O2',no,N,19,,72306,17671,5GP
20,,SING,C2',C1',no,N,20,,72306,17671,5GP
21,,SING,C2',H2',no,N,21,,72306,17671,5GP
22,,SING,O2',HO2',no,N,22,,72306,17671,5GP
23,,SING,C1',N9,no,N,23,,72306,17671,5GP
24,,SING,C1',H1',no,N,24,,72306,17671,5GP
25,,SING,N9,C8,yes,N,25,,72306,17671,5GP
26,,SING,N9,C4,yes,N,26,,72306,17671,5GP
27,,DOUB,C8,N7,yes,N,27,,72306,17671,5GP
28,,SING,C8,H8,no,N,28,,72306,17671,5GP
29,,SING,N7,C5,yes,N,29,,72306,17671,5GP
30,,SING,C5,C6,no,N,30,,72306,17671,5GP
31,,DOUB,C5,C4,yes,N,31,,72306,17671,5GP
32,,DOUB,C6,O6,no,N,32,,72306,17671,5GP
33,,SING,C6,N1,no,N,33,,72306,17671,5GP
34,,SING,N1,C2,no,N,34,,72306,17671,5GP
35,,SING,N1,HN1,no,N,35,,72306,17671,5GP
36,,SING,C2,N2,no,N,36,,72306,17671,5GP
37,,DOUB,C2,N3,no,N,37,,72306,17671,5GP
38,,SING,N2,HN21,no,N,38,,72306,17671,5GP
39,,SING,N2,HN22,no,N,39,,72306,17671,5GP
40,,SING,N3,C4,no,N,40,,72306,17671,5GP
1,,SING,N,CA,no,N,1,,72341,17673,M2L
2,,SING,N,HN,no,N,2,,72341,17673,M2L
3,,SING,N,HNA,no,N,3,,72341,17673,M2L
4,,SING,C,CA,no,N,4,,72341,17673,M2L
5,,SING,CA,CB,no,N,5,,72341,17673,M2L
6,,SING,CA,HA,no,N,6,,72341,17673,M2L
7,,SING,CB,SG,no,N,7,,72341,17673,M2L
8,,SING,CB,HB,no,N,8,,72341,17673,M2L
9,,SING,CB,HBA,no,N,9,,72341,17673,M2L
10,,SING,SG,CD,no,N,10,,72341,17673,M2L
11,,SING,CD,CE,no,N,11,,72341,17673,M2L
12,,SING,CD,HD,no,N,12,,72341,17673,M2L
13,,SING,CD,HDA,no,N,13,,72341,17673,M2L
14,,SING,NZ,CE,no,N,14,,72341,17673,M2L
15,,SING,CE,HE,no,N,15,,72341,17673,M2L
16,,SING,CE,HEA,no,N,16,,72341,17673,M2L
17,,SING,CM1,NZ,no,N,17,,72341,17673,M2L
18,,SING,NZ,CM2,no,N,18,,72341,17673,M2L
19,,SING,CM1,HM1,no,N,19,,72341,17673,M2L
20,,SING,CM1,HM1A,no,N,20,,72341,17673,M2L
21,,SING,CM1,HM1B,no,N,21,,72341,17673,M2L
22,,SING,CM2,HM2,no,N,22,,72341,17673,M2L
23,,SING,CM2,HM2A,no,N,23,,72341,17673,M2L
24,,SING,CM2,HM2B,no,N,24,,72341,17673,M2L
25,,DOUB,O,C,no,N,25,,72341,17673,M2L
26,,SING,C,OXT,no,N,26,,72341,17673,M2L
27,,SING,OXT,HOXT,no,N,27,,72341,17673,M2L
1,,DOUB,C1,C2,yes,N,1,,72362,17674,SSR
2,,SING,C1,C6,yes,N,2,,72362,17674,SSR
3,,SING,C2,C3,yes,N,3,,72362,17674,SSR
4,,DOUB,C3,C4,yes,N,4,,72362,17674,SSR
5,,SING,C3,N9,yes,N,5,,72362,17674,SSR
6,,SING,C4,C5,yes,N,6,,72362,17674,SSR
7,,SING,C4,C11,yes,N,7,,72362,17674,SSR
8,,DOUB,C5,C6,yes,N,8,,72362,17674,SSR
9,,SING,C5,C12,no,N,9,,72362,17674,SSR
10,,SING,C6,O16,no,N,10,,72362,17674,SSR
11,,SING,N9,C10,yes,N,11,,72362,17674,SSR
12,,SING,N9,C35,yes,N,12,,72362,17674,SSR
13,,DOUB,C10,C11,yes,N,13,,72362,17674,SSR
14,,SING,C10,C46,no,N,14,,72362,17674,SSR
15,,SING,C11,C17,no,N,15,,72362,17674,SSR
16,,SING,C17,N18,no,N,16,,72362,17674,SSR
17,,DOUB,C17,O32,no,N,17,,72362,17674,SSR
18,,SING,N18,C19,no,N,18,,72362,17674,SSR
19,,SING,N18,C23,no,N,19,,72362,17674,SSR
20,,SING,C19,C20,no,N,20,,72362,17674,SSR
21,,SING,C20,N21,no,N,21,,72362,17674,SSR
22,,SING,N21,C22,no,N,22,,72362,17674,SSR
23,,SING,C22,C23,no,N,23,,72362,17674,SSR
24,,DOUB,C35,C36,yes,N,24,,72362,17674,SSR
25,,SING,C35,C40,yes,N,25,,72362,17674,SSR
26,,SING,C36,C37,yes,N,26,,72362,17674,SSR
27,,DOUB,C37,C38,yes,N,27,,72362,17674,SSR
28,,SING,C38,C39,yes,N,28,,72362,17674,SSR
29,,DOUB,C39,C40,yes,N,29,,72362,17674,SSR
30,,SING,C46,C47,no,N,30,,72362,17674,SSR
31,,DOUB,C47,C50,yes,N,31,,72362,17674,SSR
32,,SING,C47,C54,yes,N,32,,72362,17674,SSR
33,,SING,C50,C51,yes,N,33,,72362,17674,SSR
34,,SING,C50,C58,no,N,34,,72362,17674,SSR
35,,DOUB,C51,C52,yes,N,35,,72362,17674,SSR
36,,SING,C51,F62,no,N,36,,72362,17674,SSR
37,,SING,C52,C53,yes,N,37,,72362,17674,SSR
38,,DOUB,C53,C54,yes,N,38,,72362,17674,SSR
39,,SING,C1,H1,no,N,39,,72362,17674,SSR
40,,SING,C2,H2,no,N,40,,72362,17674,SSR
41,,SING,C12,H12,no,N,41,,72362,17674,SSR
42,,SING,C12,H12A,no,N,42,,72362,17674,SSR
43,,SING,C12,H12B,no,N,43,,72362,17674,SSR
44,,SING,O16,HO16,no,N,44,,72362,17674,SSR
45,,SING,C19,H19,no,N,45,,72362,17674,SSR
46,,SING,C19,H19A,no,N,46,,72362,17674,SSR
47,,SING,C20,H20,no,N,47,,72362,17674,SSR
48,,SING,C20,H20A,no,N,48,,72362,17674,SSR
49,,SING,N21,HN21,no,N,49,,72362,17674,SSR
50,,SING,C22,H22,no,N,50,,72362,17674,SSR
51,,SING,C22,H22A,no,N,51,,72362,17674,SSR
52,,SING,C23,H23,no,N,52,,72362,17674,SSR
53,,SING,C23,H23A,no,N,53,,72362,17674,SSR
54,,SING,C36,H36,no,N,54,,72362,17674,SSR
55,,SING,C37,H37,no,N,55,,72362,17674,SSR
56,,SING,C38,H38,no,N,56,,72362,17674,SSR
57,,SING,C39,H39,no,N,57,,72362,17674,SSR
58,,SING,C40,H40,no,N,58,,72362,17674,SSR
59,,SING,C46,H46,no,N,59,,72362,17674,SSR
60,,SING,C46,H46A,no,N,60,,72362,17674,SSR
61,,SING,C52,H52,no,N,61,,72362,17674,SSR
62,,SING,C53,H53,no,N,62,,72362,17674,SSR
63,,SING,C54,H54,no,N,63,,72362,17674,SSR
64,,SING,C58,H58,no,N,64,,72362,17674,SSR
65,,SING,C58,H58A,no,N,65,,72362,17674,SSR
66,,SING,C58,H58B,no,N,66,,72362,17674,SSR
1,,DOUB,PG,O1G,no,N,1,,72403,17678,GNP
2,,SING,PG,O2G,no,N,2,,72403,17678,GNP
3,,SING,PG,O3G,no,N,3,,72403,17678,GNP
4,,SING,PG,N3B,no,N,4,,72403,17678,GNP
5,,SING,O2G,HOG2,no,N,5,,72403,17678,GNP
6,,SING,O3G,HOG3,no,N,6,,72403,17678,GNP
7,,SING,N3B,PB,no,N,7,,72403,17678,GNP
8,,SING,N3B,HNB3,no,N,8,,72403,17678,GNP
9,,DOUB,PB,O1B,no,N,9,,72403,17678,GNP
10,,SING,PB,O2B,no,N,10,,72403,17678,GNP
11,,SING,PB,O3A,no,N,11,,72403,17678,GNP
12,,SING,O2B,HOB2,no,N,12,,72403,17678,GNP
13,,SING,O3A,PA,no,N,13,,72403,17678,GNP
14,,DOUB,PA,O1A,no,N,14,,72403,17678,GNP
15,,SING,PA,O2A,no,N,15,,72403,17678,GNP
16,,SING,PA,O5',no,N,16,,72403,17678,GNP
17,,SING,O2A,HOA2,no,N,17,,72403,17678,GNP
18,,SING,O5',C5',no,N,18,,72403,17678,GNP
19,,SING,C5',C4',no,N,19,,72403,17678,GNP
20,,SING,C5',H5'2,no,N,20,,72403,17678,GNP
21,,SING,C5',H5'1,no,N,21,,72403,17678,GNP
22,,SING,C4',O4',no,N,22,,72403,17678,GNP
23,,SING,C4',C3',no,N,23,,72403,17678,GNP
24,,SING,C4',H4',no,N,24,,72403,17678,GNP
25,,SING,O4',C1',no,N,25,,72403,17678,GNP
26,,SING,C3',O3',no,N,26,,72403,17678,GNP
27,,SING,C3',C2',no,N,27,,72403,17678,GNP
28,,SING,C3',H3',no,N,28,,72403,17678,GNP
29,,SING,O3',HO3',no,N,29,,72403,17678,GNP
30,,SING,C2',O2',no,N,30,,72403,17678,GNP
31,,SING,C2',C1',no,N,31,,72403,17678,GNP
32,,SING,C2',H2',no,N,32,,72403,17678,GNP
33,,SING,O2',HO2',no,N,33,,72403,17678,GNP
34,,SING,C1',N9,no,N,34,,72403,17678,GNP
35,,SING,C1',H1',no,N,35,,72403,17678,GNP
36,,SING,N9,C8,yes,N,36,,72403,17678,GNP
37,,SING,N9,C4,yes,N,37,,72403,17678,GNP
38,,DOUB,C8,N7,yes,N,38,,72403,17678,GNP
39,,SING,C8,H8,no,N,39,,72403,17678,GNP
40,,SING,N7,C5,yes,N,40,,72403,17678,GNP
41,,SING,C5,C6,yes,N,41,,72403,17678,GNP
42,,DOUB,C5,C4,yes,N,42,,72403,17678,GNP
43,,DOUB,C6,O6,no,N,43,,72403,17678,GNP
44,,SING,C6,N1,yes,N,44,,72403,17678,GNP
45,,SING,N1,C2,yes,N,45,,72403,17678,GNP
46,,SING,N1,HN1,no,N,46,,72403,17678,GNP
47,,SING,C2,N2,no,N,47,,72403,17678,GNP
48,,DOUB,C2,N3,yes,N,48,,72403,17678,GNP
49,,SING,N2,HN21,no,N,49,,72403,17678,GNP
50,,SING,N2,HN22,no,N,50,,72403,17678,GNP
51,,SING,N3,C4,yes,N,51,,72403,17678,GNP
1,,SING,N,CA,no,N,1,,72437,17680,PTR
2,,SING,N,H,no,N,2,,72437,17680,PTR
3,,SING,N,HN2,no,N,3,,72437,17680,PTR
4,,SING,CA,C,no,N,4,,72437,17680,PTR
5,,SING,CA,CB,no,N,5,,72437,17680,PTR
6,,SING,CA,HA,no,N,6,,72437,17680,PTR
7,,DOUB,C,O,no,N,7,,72437,17680,PTR
8,,SING,C,OXT,no,N,8,,72437,17680,PTR
9,,SING,OXT,HXT,no,N,9,,72437,17680,PTR
10,,SING,CB,CG,no,N,10,,72437,17680,PTR
11,,SING,CB,HB2,no,N,11,,72437,17680,PTR
12,,SING,CB,HB3,no,N,12,,72437,17680,PTR
13,,DOUB,CG,CD1,yes,N,13,,72437,17680,PTR
14,,SING,CG,CD2,yes,N,14,,72437,17680,PTR
15,,SING,CD1,CE1,yes,N,15,,72437,17680,PTR
16,,SING,CD1,HD1,no,N,16,,72437,17680,PTR
17,,DOUB,CD2,CE2,yes,N,17,,72437,17680,PTR
18,,SING,CD2,HD2,no,N,18,,72437,17680,PTR
19,,DOUB,CE1,CZ,yes,N,19,,72437,17680,PTR
20,,SING,CE1,HE1,no,N,20,,72437,17680,PTR
21,,SING,CE2,CZ,yes,N,21,,72437,17680,PTR
22,,SING,CE2,HE2,no,N,22,,72437,17680,PTR
23,,SING,CZ,OH,no,N,23,,72437,17680,PTR
24,,SING,OH,P,no,N,24,,72437,17680,PTR
25,,DOUB,P,O1P,no,N,25,,72437,17680,PTR
26,,SING,P,O2P,no,N,26,,72437,17680,PTR
27,,SING,P,O3P,no,N,27,,72437,17680,PTR
28,,SING,O2P,HO2P,no,N,28,,72437,17680,PTR
29,,SING,O3P,HO3P,no,N,29,,72437,17680,PTR
1,,SING,OP3,P,no,N,1,,72739,17697,DI
2,,SING,OP3,HOP3,no,N,2,,72739,17697,DI
3,,DOUB,P,OP1,no,N,3,,72739,17697,DI
4,,SING,P,OP2,no,N,4,,72739,17697,DI
5,,SING,P,O5',no,N,5,,72739,17697,DI
6,,SING,OP2,HOP2,no,N,6,,72739,17697,DI
7,,SING,O5',C5',no,N,7,,72739,17697,DI
8,,SING,C5',C4',no,N,8,,72739,17697,DI
9,,SING,C5',H5',no,N,9,,72739,17697,DI
10,,SING,C5',H5'',no,N,10,,72739,17697,DI
11,,SING,C4',O4',no,N,11,,72739,17697,DI
12,,SING,C4',C3',no,N,12,,72739,17697,DI
13,,SING,C4',H4',no,N,13,,72739,17697,DI
14,,SING,O4',C1',no,N,14,,72739,17697,DI
15,,SING,C3',O3',no,N,15,,72739,17697,DI
16,,SING,C3',C2',no,N,16,,72739,17697,DI
17,,SING,C3',H3',no,N,17,,72739,17697,DI
18,,SING,O3',HO3',no,N,18,,72739,17697,DI
19,,SING,C2',C1',no,N,19,,72739,17697,DI
20,,SING,C2',H2',no,N,20,,72739,17697,DI
21,,SING,C2',H2'',no,N,21,,72739,17697,DI
22,,SING,C1',N9,no,N,22,,72739,17697,DI
23,,SING,C1',H1',no,N,23,,72739,17697,DI
24,,SING,N9,C8,yes,N,24,,72739,17697,DI
25,,SING,N9,C4,yes,N,25,,72739,17697,DI
26,,DOUB,C8,N7,yes,N,26,,72739,17697,DI
27,,SING,C8,H8,no,N,27,,72739,17697,DI
28,,SING,N7,C5,yes,N,28,,72739,17697,DI
29,,SING,C5,C6,no,N,29,,72739,17697,DI
30,,DOUB,C5,C4,yes,N,30,,72739,17697,DI
31,,DOUB,C6,O6,no,N,31,,72739,17697,DI
32,,SING,C6,N1,no,N,32,,72739,17697,DI
33,,SING,N1,C2,no,N,33,,72739,17697,DI
34,,SING,N1,H1,no,N,34,,72739,17697,DI
35,,DOUB,C2,N3,no,N,35,,72739,17697,DI
36,,SING,C2,H2,no,N,36,,72739,17697,DI
37,,SING,N3,C4,no,N,37,,72739,17697,DI
1,,SING,C45,C44,no,N,1,,73042,17710,UQ8
2,,SING,C45,H45,no,N,2,,73042,17710,UQ8
3,,SING,C45,H45A,no,N,3,,73042,17710,UQ8
4,,SING,C45,H45B,no,N,4,,73042,17710,UQ8
5,,DOUB,C43,C44,no,N,5,,73042,17710,UQ8
6,,SING,C44,C46,no,N,6,,73042,17710,UQ8
7,,SING,C46,H46,no,N,7,,73042,17710,UQ8
8,,SING,C46,H46A,no,N,8,,73042,17710,UQ8
9,,SING,C46,H46B,no,N,9,,73042,17710,UQ8
10,,SING,C42,C43,no,N,10,,73042,17710,UQ8
11,,SING,C43,H43,no,N,11,,73042,17710,UQ8
12,,SING,C41,C42,no,N,12,,73042,17710,UQ8
13,,SING,C42,H42,no,N,13,,73042,17710,UQ8
14,,SING,C42,H42A,no,N,14,,73042,17710,UQ8
15,,SING,C39,C41,no,N,15,,73042,17710,UQ8
16,,SING,C41,H41,no,N,16,,73042,17710,UQ8
17,,SING,C41,H41A,no,N,17,,73042,17710,UQ8
18,,SING,C40,C39,no,N,18,,73042,17710,UQ8
19,,DOUB,C38,C39,no,N,19,,73042,17710,UQ8
20,,SING,C40,H40,no,N,20,,73042,17710,UQ8
21,,SING,C40,H40A,no,N,21,,73042,17710,UQ8
22,,SING,C40,H40B,no,E,22,,73042,17710,UQ8
23,,SING,C37,C38,no,N,23,,73042,17710,UQ8
24,,SING,C38,H38,no,N,24,,73042,17710,UQ8
25,,SING,C37,C36,no,N,25,,73042,17710,UQ8
26,,SING,C37,H37,no,N,26,,73042,17710,UQ8
27,,SING,C37,H37A,no,N,27,,73042,17710,UQ8
28,,SING,C34,C36,no,N,28,,73042,17710,UQ8
29,,SING,C36,H36,no,N,29,,73042,17710,UQ8
30,,SING,C36,H36A,no,N,30,,73042,17710,UQ8
31,,DOUB,C33,C34,no,N,31,,73042,17710,UQ8
32,,SING,C34,C35,no,N,32,,73042,17710,UQ8
33,,SING,C35,H35,no,N,33,,73042,17710,UQ8
34,,SING,C35,H35A,no,N,34,,73042,17710,UQ8
35,,SING,C32,C33,no,E,35,,73042,17710,UQ8
36,,SING,C33,H33,no,N,36,,73042,17710,UQ8
37,,SING,C35,H35B,no,N,37,,73042,17710,UQ8
38,,SING,C31,C32,no,N,38,,73042,17710,UQ8
39,,SING,C32,H32,no,N,39,,73042,17710,UQ8
40,,SING,C32,H32A,no,N,40,,73042,17710,UQ8
41,,SING,C29,C31,no,N,41,,73042,17710,UQ8
42,,SING,C31,H31,no,N,42,,73042,17710,UQ8
43,,SING,C31,H31A,no,N,43,,73042,17710,UQ8
44,,DOUB,C28,C29,no,N,44,,73042,17710,UQ8
45,,SING,C30,C29,no,N,45,,73042,17710,UQ8
46,,SING,C30,H30,no,N,46,,73042,17710,UQ8
47,,SING,C30,H30A,no,N,47,,73042,17710,UQ8
48,,SING,C30,H30B,no,E,48,,73042,17710,UQ8
49,,SING,C27,C28,no,N,49,,73042,17710,UQ8
50,,SING,C28,H28,no,N,50,,73042,17710,UQ8
51,,SING,C26,C27,no,N,51,,73042,17710,UQ8
52,,SING,C27,H27,no,N,52,,73042,17710,UQ8
53,,SING,C27,H27A,no,N,53,,73042,17710,UQ8
54,,SING,C24,C26,no,N,54,,73042,17710,UQ8
55,,SING,C26,H26,no,N,55,,73042,17710,UQ8
56,,SING,C26,H26A,no,N,56,,73042,17710,UQ8
57,,DOUB,C23,C24,no,N,57,,73042,17710,UQ8
58,,SING,C24,C25,no,N,58,,73042,17710,UQ8
59,,SING,C25,H25,no,N,59,,73042,17710,UQ8
60,,SING,C25,H25A,no,N,60,,73042,17710,UQ8
61,,SING,C25,H25B,no,E,61,,73042,17710,UQ8
62,,SING,C22,C23,no,N,62,,73042,17710,UQ8
63,,SING,C23,H23,no,N,63,,73042,17710,UQ8
64,,SING,C21,C22,no,N,64,,73042,17710,UQ8
65,,SING,C22,H22,no,N,65,,73042,17710,UQ8
66,,SING,C22,H22A,no,N,66,,73042,17710,UQ8
67,,SING,C19,C21,no,N,67,,73042,17710,UQ8
68,,SING,C21,H21,no,N,68,,73042,17710,UQ8
69,,SING,C21,H21A,no,N,69,,73042,17710,UQ8
70,,SING,C20,C19,no,N,70,,73042,17710,UQ8
71,,DOUB,C18,C19,no,N,71,,73042,17710,UQ8
72,,SING,C20,H20,no,N,72,,73042,17710,UQ8
73,,SING,C20,H20A,no,N,73,,73042,17710,UQ8
74,,SING,C20,H20B,no,E,74,,73042,17710,UQ8
75,,SING,C17,C18,no,N,75,,73042,17710,UQ8
76,,SING,C18,H18,no,N,76,,73042,17710,UQ8
77,,SING,C16,C17,no,N,77,,73042,17710,UQ8
78,,SING,C17,H17,no,N,78,,73042,17710,UQ8
79,,SING,C17,H17A,no,N,79,,73042,17710,UQ8
80,,SING,C14,C16,no,N,80,,73042,17710,UQ8
81,,SING,C16,H16,no,N,81,,73042,17710,UQ8
82,,SING,C16,H16A,no,N,82,,73042,17710,UQ8
83,,DOUB,C13,C14,no,N,83,,73042,17710,UQ8
84,,SING,C15,C14,no,N,84,,73042,17710,UQ8
85,,SING,C15,H15,no,N,85,,73042,17710,UQ8
86,,SING,C15,H15A,no,N,86,,73042,17710,UQ8
87,,SING,C15,H15B,no,E,87,,73042,17710,UQ8
88,,SING,C12,C13,no,N,88,,73042,17710,UQ8
89,,SING,C13,H13,no,N,89,,73042,17710,UQ8
90,,SING,C11,C12,no,N,90,,73042,17710,UQ8
91,,SING,C12,H12,no,N,91,,73042,17710,UQ8
92,,SING,C12,H12A,no,N,92,,73042,17710,UQ8
93,,SING,C9,C11,no,N,93,,73042,17710,UQ8
94,,SING,C11,H11,no,N,94,,73042,17710,UQ8
95,,SING,C11,H11A,no,N,95,,73042,17710,UQ8
96,,DOUB,C8,C9,no,N,96,,73042,17710,UQ8
97,,SING,C10,C9,no,N,97,,73042,17710,UQ8
98,,SING,C10,H10,no,N,98,,73042,17710,UQ8
99,,SING,C10,H10A,no,N,99,,73042,17710,UQ8
100,,SING,C10,H10B,no,E,100,,73042,17710,UQ8
101,,SING,C7,C8,no,N,101,,73042,17710,UQ8
102,,SING,C8,H8,no,N,102,,73042,17710,UQ8
103,,SING,C6,C7,no,N,103,,73042,17710,UQ8
104,,SING,C7,H7,no,N,104,,73042,17710,UQ8
105,,SING,C7,H7A,no,N,105,,73042,17710,UQ8
106,,DOUB,C1,C6,no,N,106,,73042,17710,UQ8
107,,SING,C5,C6,no,N,107,,73042,17710,UQ8
108,,SING,C2,C1,no,N,108,,73042,17710,UQ8
109,,SING,C1,C1M,no,N,109,,73042,17710,UQ8
110,,SING,C1M,H1M,no,N,110,,73042,17710,UQ8
111,,SING,C1M,H1MA,no,N,111,,73042,17710,UQ8
112,,SING,C1M,H1MB,no,N,112,,73042,17710,UQ8
113,,DOUB,O2,C2,no,N,113,,73042,17710,UQ8
114,,SING,C3,C2,no,N,114,,73042,17710,UQ8
115,,SING,O3,C3,no,N,115,,73042,17710,UQ8
116,,DOUB,C3,C4,no,N,116,,73042,17710,UQ8
117,,SING,C3M,O3,no,N,117,,73042,17710,UQ8
118,,SING,C3M,H3M,no,N,118,,73042,17710,UQ8
119,,SING,C3M,H3MA,no,N,119,,73042,17710,UQ8
120,,SING,C3M,H3MB,no,N,120,,73042,17710,UQ8
121,,SING,O4,C4,no,N,121,,73042,17710,UQ8
122,,SING,C4,C5,no,N,122,,73042,17710,UQ8
123,,SING,C4M,O4,no,N,123,,73042,17710,UQ8
124,,SING,C4M,H4M,no,N,124,,73042,17710,UQ8
125,,SING,C4M,H4MA,no,N,125,,73042,17710,UQ8
126,,SING,C4M,H4MB,no,N,126,,73042,17710,UQ8
127,,DOUB,C5,O5,no,N,127,,73042,17710,UQ8
1,,SING,O,H1,no,N,1,,73151,17716,HOH
2,,SING,O,H2,no,N,2,,73151,17716,HOH
1,,DOUB,P2,O4P,no,N,1,,73199,17718,THP
2,,SING,P2,O5P,no,N,2,,73199,17718,THP
3,,SING,P2,O6P,no,N,3,,73199,17718,THP
4,,SING,P2,O5',no,N,4,,73199,17718,THP
5,,SING,O5P,HOP5,no,N,5,,73199,17718,THP
6,,SING,O6P,HOP6,no,N,6,,73199,17718,THP
7,,DOUB,P1,O1P,no,N,7,,73199,17718,THP
8,,SING,P1,O2P,no,N,8,,73199,17718,THP
9,,SING,P1,O3P,no,N,9,,73199,17718,THP
10,,SING,P1,O3',no,N,10,,73199,17718,THP
11,,SING,O2P,HOP2,no,N,11,,73199,17718,THP
12,,SING,O3P,HOP3,no,N,12,,73199,17718,THP
13,,SING,O5',C5',no,N,13,,73199,17718,THP
14,,SING,C5',C4',no,N,14,,73199,17718,THP
15,,SING,C5',H5'1,no,N,15,,73199,17718,THP
16,,SING,C5',H5'2,no,N,16,,73199,17718,THP
17,,SING,C4',O4',no,N,17,,73199,17718,THP
18,,SING,C4',C3',no,N,18,,73199,17718,THP
19,,SING,C4',H4',no,N,19,,73199,17718,THP
20,,SING,O4',C1',no,N,20,,73199,17718,THP
21,,SING,C3',O3',no,N,21,,73199,17718,THP
22,,SING,C3',C2',no,N,22,,73199,17718,THP
23,,SING,C3',H3',no,N,23,,73199,17718,THP
24,,SING,C2',C1',no,N,24,,73199,17718,THP
25,,SING,C2',H2'1,no,N,25,,73199,17718,THP
26,,SING,C2',H2'2,no,N,26,,73199,17718,THP
27,,SING,C1',N1,no,N,27,,73199,17718,THP
28,,SING,C1',H1',no,N,28,,73199,17718,THP
29,,SING,N1,C2,no,N,29,,73199,17718,THP
30,,SING,N1,C6,no,N,30,,73199,17718,THP
31,,DOUB,C2,O2,no,N,31,,73199,17718,THP
32,,SING,C2,N3,no,N,32,,73199,17718,THP
33,,SING,N3,C4,no,N,33,,73199,17718,THP
34,,SING,N3,H3,no,N,34,,73199,17718,THP
35,,DOUB,C4,O4,no,N,35,,73199,17718,THP
36,,SING,C4,C5,no,N,36,,73199,17718,THP
37,,SING,C5,C5M,no,N,37,,73199,17718,THP
38,,DOUB,C5,C6,no,N,38,,73199,17718,THP
39,,SING,C5M,H51,no,N,39,,73199,17718,THP
40,,SING,C5M,H52,no,N,40,,73199,17718,THP
41,,SING,C5M,H53,no,N,41,,73199,17718,THP
42,,SING,C6,H6,no,N,42,,73199,17718,THP
1,,SING,P,OP2,no,N,1,,73782,17746,2LF
2,,SING,P,O5',no,N,2,,73782,17746,2LF
3,,SING,N1,HN1,no,N,3,,73782,17746,2LF
4,,SING,N1,C2,no,N,4,,73782,17746,2LF
5,,SING,C2,N2,no,N,5,,73782,17746,2LF
6,,SING,N2,HN2A,no,N,6,,73782,17746,2LF
7,,SING,N2,HN2,no,N,7,,73782,17746,2LF
8,,DOUB,N3,C2,no,N,8,,73782,17746,2LF
9,,SING,C4,N3,no,N,9,,73782,17746,2LF
10,,DOUB,C5,C4,yes,N,10,,73782,17746,2LF
11,,SING,C5,C6,no,N,11,,73782,17746,2LF
12,,SING,C6,N1,no,N,12,,73782,17746,2LF
13,,DOUB,O6,C6,no,N,13,,73782,17746,2LF
14,,SING,N7,C5,yes,N,14,,73782,17746,2LF
15,,DOUB,N7,C8,yes,N,15,,73782,17746,2LF
16,,SING,C8,N9,yes,N,16,,73782,17746,2LF
17,,SING,N9,C4,yes,N,17,,73782,17746,2LF
18,,SING,N9,C1',no,N,18,,73782,17746,2LF
19,,SING,C1',H1',no,N,19,,73782,17746,2LF
20,,SING,C1',C2',no,N,20,,73782,17746,2LF
21,,SING,OP3,P,no,N,21,,73782,17746,2LF
22,,SING,OP3,HOP3,no,N,22,,73782,17746,2LF
23,,SING,C2',H'2',no,N,23,,73782,17746,2LF
24,,SING,C2',H2',no,N,24,,73782,17746,2LF
25,,SING,OP2,HOP2,no,N,25,,73782,17746,2LF
26,,SING,C3',C2',no,N,26,,73782,17746,2LF
27,,SING,C3',H3',no,N,27,,73782,17746,2LF
28,,SING,C3',O3',no,N,28,,73782,17746,2LF
29,,SING,O3',HO3',no,N,29,,73782,17746,2LF
30,,SING,C4',C3',no,N,30,,73782,17746,2LF
31,,SING,O4',C1',no,N,31,,73782,17746,2LF
32,,SING,O4',C4',no,N,32,,73782,17746,2LF
33,,SING,C5',C8,no,N,33,,73782,17746,2LF
34,,SING,C5',C4',no,N,34,,73782,17746,2LF
35,,SING,O5',C5',no,N,35,,73782,17746,2LF
36,,SING,H4',C4',no,N,36,,73782,17746,2LF
37,,SING,H5',C5',no,N,37,,73782,17746,2LF
38,,DOUB,P,OP1,no,N,38,,73782,17746,2LF
1,,SING,CAC,CAA,no,N,1,,73844,17749,ZIN
2,,DOUB,CAF,CAA,yes,N,2,,73844,17749,ZIN
3,,SING,CAA,CAB,yes,N,3,,73844,17749,ZIN
4,,SING,CAB,OAM,no,N,4,,73844,17749,ZIN
5,,DOUB,CAB,CAD,yes,N,5,,73844,17749,ZIN
6,,SING,CAH,CAC,no,N,6,,73844,17749,ZIN
7,,SING,CAC,HAC,no,N,7,,73844,17749,ZIN
8,,SING,CAC,HACA,no,N,8,,73844,17749,ZIN
9,,SING,CAJ,CAD,yes,N,9,,73844,17749,ZIN
10,,SING,CAD,NAG,yes,N,10,,73844,17749,ZIN
11,,SING,CAF,CAK,yes,N,11,,73844,17749,ZIN
12,,SING,CAF,HAF,no,N,12,,73844,17749,ZIN
13,,DOUB,NAG,CAT,yes,N,13,,73844,17749,ZIN
14,,DOUB,NAI,CAH,yes,N,14,,73844,17749,ZIN
15,,SING,CAV,CAH,yes,N,15,,73844,17749,ZIN
16,,SING,CAU,NAI,yes,N,16,,73844,17749,ZIN
17,,DOUB,CAK,CAJ,yes,N,17,,73844,17749,ZIN
18,,SING,CAJ,CAW,yes,N,18,,73844,17749,ZIN
19,,SING,CAK,HAK,no,N,19,,73844,17749,ZIN
20,,SING,OAM,HOAM,no,N,20,,73844,17749,ZIN
21,,SING,CAY,CAT,yes,N,21,,73844,17749,ZIN
22,,SING,CAT,HAT,no,N,22,,73844,17749,ZIN
23,,DOUB,CAZ,CAU,yes,N,23,,73844,17749,ZIN
24,,SING,CAU,HAU,no,N,24,,73844,17749,ZIN
25,,DOUB,CBA,CAV,yes,N,25,,73844,17749,ZIN
26,,SING,CAV,HAV,no,N,26,,73844,17749,ZIN
27,,DOUB,CAW,CAY,yes,N,27,,73844,17749,ZIN
28,,SING,CAW,HAW,no,N,28,,73844,17749,ZIN
29,,SING,CAY,HAY,no,N,29,,73844,17749,ZIN
30,,SING,CAZ,CBA,yes,N,30,,73844,17749,ZIN
31,,SING,CAZ,HAZ,no,N,31,,73844,17749,ZIN
32,,SING,CBA,HBA,no,N,32,,73844,17749,ZIN
1,,SING,C1,C2,no,N,1,,73866,1775,AAC
2,,SING,C1,O1,no,N,2,,73866,1775,AAC
3,,DOUB,C1,O2,no,N,3,,73866,1775,AAC
4,,SING,C2,N1,no,N,4,,73866,1775,AAC
5,,SING,C2,HC21,no,N,5,,73866,1775,AAC
6,,SING,C2,HC22,no,N,6,,73866,1775,AAC
7,,SING,C3,C4,no,N,7,,73866,1775,AAC
8,,SING,C3,N1,no,N,8,,73866,1775,AAC
9,,DOUB,C3,O3,no,N,9,,73866,1775,AAC
10,,SING,C4,HC41,no,N,10,,73866,1775,AAC
11,,SING,C4,HC42,no,N,11,,73866,1775,AAC
12,,SING,C4,HC43,no,N,12,,73866,1775,AAC
13,,SING,N1,HN1,no,N,13,,73866,1775,AAC
14,,SING,O1,HO1,no,N,14,,73866,1775,AAC
1,,SING,FE,NA,no,N,1,,73867,1775,HEC
2,,SING,FE,NB,no,N,2,,73867,1775,HEC
3,,SING,FE,NC,no,N,3,,73867,1775,HEC
4,,SING,FE,ND,no,N,4,,73867,1775,HEC
5,,DOUB,CHA,C1A,no,N,5,,73867,1775,HEC
6,,SING,CHA,C4D,no,N,6,,73867,1775,HEC
7,,SING,CHA,HHA,no,N,7,,73867,1775,HEC
8,,DOUB,CHB,C4A,no,N,8,,73867,1775,HEC
9,,SING,CHB,C1B,no,N,9,,73867,1775,HEC
10,,SING,CHB,HHB,no,N,10,,73867,1775,HEC
11,,DOUB,CHC,C4B,no,N,11,,73867,1775,HEC
12,,SING,CHC,C1C,no,N,12,,73867,1775,HEC
13,,SING,CHC,HHC,no,N,13,,73867,1775,HEC
14,,DOUB,CHD,C4C,no,N,14,,73867,1775,HEC
15,,SING,CHD,C1D,no,N,15,,73867,1775,HEC
16,,SING,CHD,HHD,no,N,16,,73867,1775,HEC
17,,SING,NA,C1A,yes,N,17,,73867,1775,HEC
18,,SING,NA,C4A,yes,N,18,,73867,1775,HEC
19,,SING,C1A,C2A,yes,N,19,,73867,1775,HEC
20,,DOUB,C2A,C3A,yes,N,20,,73867,1775,HEC
21,,SING,C2A,CAA,no,N,21,,73867,1775,HEC
22,,SING,C3A,C4A,yes,N,22,,73867,1775,HEC
23,,SING,C3A,CMA,no,N,23,,73867,1775,HEC
24,,SING,CMA,HMA1,no,N,24,,73867,1775,HEC
25,,SING,CMA,HMA2,no,N,25,,73867,1775,HEC
26,,SING,CMA,HMA3,no,N,26,,73867,1775,HEC
27,,SING,CAA,CBA,no,N,27,,73867,1775,HEC
28,,SING,CAA,HAA1,no,N,28,,73867,1775,HEC
29,,SING,CAA,HAA2,no,N,29,,73867,1775,HEC
30,,SING,CBA,CGA,no,N,30,,73867,1775,HEC
31,,SING,CBA,HBA1,no,N,31,,73867,1775,HEC
32,,SING,CBA,HBA2,no,N,32,,73867,1775,HEC
33,,DOUB,CGA,O1A,no,N,33,,73867,1775,HEC
34,,SING,CGA,O2A,no,N,34,,73867,1775,HEC
35,,SING,O2A,H2A,no,N,35,,73867,1775,HEC
36,,SING,NB,C1B,yes,N,36,,73867,1775,HEC
37,,SING,NB,C4B,yes,N,37,,73867,1775,HEC
38,,DOUB,C1B,C2B,yes,N,38,,73867,1775,HEC
39,,SING,C2B,C3B,yes,N,39,,73867,1775,HEC
40,,SING,C2B,CMB,no,N,40,,73867,1775,HEC
41,,SING,C3B,C4B,yes,N,41,,73867,1775,HEC
42,,DOUB,C3B,CAB,no,E,42,,73867,1775,HEC
43,,SING,CMB,HMB1,no,N,43,,73867,1775,HEC
44,,SING,CMB,HMB2,no,N,44,,73867,1775,HEC
45,,SING,CMB,HMB3,no,N,45,,73867,1775,HEC
46,,SING,CAB,CBB,no,N,46,,73867,1775,HEC
47,,SING,CAB,HAB,no,N,47,,73867,1775,HEC
48,,SING,CBB,HBB1,no,N,48,,73867,1775,HEC
49,,SING,CBB,HBB2,no,N,49,,73867,1775,HEC
50,,SING,CBB,HBB3,no,N,50,,73867,1775,HEC
51,,SING,NC,C1C,yes,N,51,,73867,1775,HEC
52,,SING,NC,C4C,yes,N,52,,73867,1775,HEC
53,,DOUB,C1C,C2C,yes,N,53,,73867,1775,HEC
54,,SING,C2C,C3C,yes,N,54,,73867,1775,HEC
55,,SING,C2C,CMC,no,N,55,,73867,1775,HEC
56,,SING,C3C,C4C,yes,N,56,,73867,1775,HEC
57,,DOUB,C3C,CAC,no,E,57,,73867,1775,HEC
58,,SING,CMC,HMC1,no,N,58,,73867,1775,HEC
59,,SING,CMC,HMC2,no,N,59,,73867,1775,HEC
60,,SING,CMC,HMC3,no,N,60,,73867,1775,HEC
61,,SING,CAC,CBC,no,N,61,,73867,1775,HEC
62,,SING,CAC,HAC,no,N,62,,73867,1775,HEC
63,,SING,CBC,HBC1,no,N,63,,73867,1775,HEC
64,,SING,CBC,HBC2,no,N,64,,73867,1775,HEC
65,,SING,CBC,HBC3,no,N,65,,73867,1775,HEC
66,,SING,ND,C1D,yes,N,66,,73867,1775,HEC
67,,SING,ND,C4D,yes,N,67,,73867,1775,HEC
68,,DOUB,C1D,C2D,yes,N,68,,73867,1775,HEC
69,,SING,C2D,C3D,yes,N,69,,73867,1775,HEC
70,,SING,C2D,CMD,no,N,70,,73867,1775,HEC
71,,DOUB,C3D,C4D,yes,N,71,,73867,1775,HEC
72,,SING,C3D,CAD,no,N,72,,73867,1775,HEC
73,,SING,CMD,HMD1,no,N,73,,73867,1775,HEC
74,,SING,CMD,HMD2,no,N,74,,73867,1775,HEC
75,,SING,CMD,HMD3,no,N,75,,73867,1775,HEC
76,,SING,CAD,CBD,no,N,76,,73867,1775,HEC
77,,SING,CAD,HAD1,no,N,77,,73867,1775,HEC
78,,SING,CAD,HAD2,no,N,78,,73867,1775,HEC
79,,SING,CBD,CGD,no,N,79,,73867,1775,HEC
80,,SING,CBD,HBD1,no,N,80,,73867,1775,HEC
81,,SING,CBD,HBD2,no,N,81,,73867,1775,HEC
82,,DOUB,CGD,O1D,no,N,82,,73867,1775,HEC
83,,SING,CGD,O2D,no,N,83,,73867,1775,HEC
84,,SING,O2D,H2D,no,N,84,,73867,1775,HEC
1,,SING,CAC,CAA,no,N,1,,73908,17751,ZIN
2,,DOUB,CAF,CAA,yes,N,2,,73908,17751,ZIN
3,,SING,CAA,CAB,yes,N,3,,73908,17751,ZIN
4,,SING,CAB,OAM,no,N,4,,73908,17751,ZIN
5,,DOUB,CAB,CAD,yes,N,5,,73908,17751,ZIN
6,,SING,CAH,CAC,no,N,6,,73908,17751,ZIN
7,,SING,CAC,HAC,no,N,7,,73908,17751,ZIN
8,,SING,CAC,HACA,no,N,8,,73908,17751,ZIN
9,,SING,CAJ,CAD,yes,N,9,,73908,17751,ZIN
10,,SING,CAD,NAG,yes,N,10,,73908,17751,ZIN
11,,SING,CAF,CAK,yes,N,11,,73908,17751,ZIN
12,,SING,CAF,HAF,no,N,12,,73908,17751,ZIN
13,,DOUB,NAG,CAT,yes,N,13,,73908,17751,ZIN
14,,DOUB,NAI,CAH,yes,N,14,,73908,17751,ZIN
15,,SING,CAV,CAH,yes,N,15,,73908,17751,ZIN
16,,SING,CAU,NAI,yes,N,16,,73908,17751,ZIN
17,,DOUB,CAK,CAJ,yes,N,17,,73908,17751,ZIN
18,,SING,CAJ,CAW,yes,N,18,,73908,17751,ZIN
19,,SING,CAK,HAK,no,N,19,,73908,17751,ZIN
20,,SING,OAM,HOAM,no,N,20,,73908,17751,ZIN
21,,SING,CAY,CAT,yes,N,21,,73908,17751,ZIN
22,,SING,CAT,HAT,no,N,22,,73908,17751,ZIN
23,,DOUB,CAZ,CAU,yes,N,23,,73908,17751,ZIN
24,,SING,CAU,HAU,no,N,24,,73908,17751,ZIN
25,,DOUB,CBA,CAV,yes,N,25,,73908,17751,ZIN
26,,SING,CAV,HAV,no,N,26,,73908,17751,ZIN
27,,DOUB,CAW,CAY,yes,N,27,,73908,17751,ZIN
28,,SING,CAW,HAW,no,N,28,,73908,17751,ZIN
29,,SING,CAY,HAY,no,N,29,,73908,17751,ZIN
30,,SING,CAZ,CBA,yes,N,30,,73908,17751,ZIN
31,,SING,CAZ,HAZ,no,N,31,,73908,17751,ZIN
32,,SING,CBA,HBA,no,N,32,,73908,17751,ZIN
1,,SING,N,CA,no,N,1,,74043,17757,SMC
2,,SING,N,H,no,N,2,,74043,17757,SMC
3,,SING,N,H2,no,N,3,,74043,17757,SMC
4,,SING,CA,CB,no,N,4,,74043,17757,SMC
5,,SING,CA,C,no,N,5,,74043,17757,SMC
6,,SING,CA,HA,no,N,6,,74043,17757,SMC
7,,SING,CB,SG,no,N,7,,74043,17757,SMC
8,,SING,CB,HB2,no,N,8,,74043,17757,SMC
9,,SING,CB,HB3,no,N,9,,74043,17757,SMC
10,,SING,SG,CS,no,N,10,,74043,17757,SMC
11,,SING,CS,HCS1,no,N,11,,74043,17757,SMC
12,,SING,CS,HCS2,no,N,12,,74043,17757,SMC
13,,SING,CS,HCS3,no,N,13,,74043,17757,SMC
14,,DOUB,C,O,no,N,14,,74043,17757,SMC
15,,SING,C,OXT,no,N,15,,74043,17757,SMC
16,,SING,OXT,HXT,no,N,16,,74043,17757,SMC
1,,SING,N,CA,no,N,1,,74078,17759,SMC
2,,SING,N,H,no,N,2,,74078,17759,SMC
3,,SING,N,H2,no,N,3,,74078,17759,SMC
4,,SING,CA,CB,no,N,4,,74078,17759,SMC
5,,SING,CA,C,no,N,5,,74078,17759,SMC
6,,SING,CA,HA,no,N,6,,74078,17759,SMC
7,,SING,CB,SG,no,N,7,,74078,17759,SMC
8,,SING,CB,HB2,no,N,8,,74078,17759,SMC
9,,SING,CB,HB3,no,N,9,,74078,17759,SMC
10,,SING,SG,CS,no,N,10,,74078,17759,SMC
11,,SING,CS,HCS1,no,N,11,,74078,17759,SMC
12,,SING,CS,HCS2,no,N,12,,74078,17759,SMC
13,,SING,CS,HCS3,no,N,13,,74078,17759,SMC
14,,DOUB,C,O,no,N,14,,74078,17759,SMC
15,,SING,C,OXT,no,N,15,,74078,17759,SMC
16,,SING,OXT,HXT,no,N,16,,74078,17759,SMC
1,,SING,C1,C2,no,N,1,,74213,17767,CHO
2,,SING,C1,C10,no,N,2,,74213,17767,CHO
3,,SING,C1,H11,no,N,3,,74213,17767,CHO
4,,SING,C1,H12,no,N,4,,74213,17767,CHO
5,,SING,C2,C3,no,N,5,,74213,17767,CHO
6,,SING,C2,H21,no,N,6,,74213,17767,CHO
7,,SING,C2,H22,no,N,7,,74213,17767,CHO
8,,SING,C3,O3,no,N,8,,74213,17767,CHO
9,,SING,C3,C4,no,N,9,,74213,17767,CHO
10,,SING,C3,H3,no,N,10,,74213,17767,CHO
11,,SING,O3,HO3,no,N,11,,74213,17767,CHO
12,,SING,C4,C5,no,N,12,,74213,17767,CHO
13,,SING,C4,H41,no,N,13,,74213,17767,CHO
14,,SING,C4,H42,no,N,14,,74213,17767,CHO
15,,SING,C5,C6,no,N,15,,74213,17767,CHO
16,,SING,C5,C10,no,N,16,,74213,17767,CHO
17,,SING,C5,H5,no,N,17,,74213,17767,CHO
18,,SING,C6,C7,no,N,18,,74213,17767,CHO
19,,SING,C6,H61,no,N,19,,74213,17767,CHO
20,,SING,C6,H62,no,N,20,,74213,17767,CHO
21,,SING,C7,O7,no,N,21,,74213,17767,CHO
22,,SING,C7,C8,no,N,22,,74213,17767,CHO
23,,SING,C7,H7,no,N,23,,74213,17767,CHO
24,,SING,O7,HO7,no,N,24,,74213,17767,CHO
25,,SING,C8,C9,no,N,25,,74213,17767,CHO
26,,SING,C8,C14,no,N,26,,74213,17767,CHO
27,,SING,C8,H8,no,N,27,,74213,17767,CHO
28,,SING,C9,C10,no,N,28,,74213,17767,CHO
29,,SING,C9,C11,no,N,29,,74213,17767,CHO
30,,SING,C9,H9,no,N,30,,74213,17767,CHO
31,,SING,C10,C19,no,N,31,,74213,17767,CHO
32,,SING,C11,C12,no,N,32,,74213,17767,CHO
33,,SING,C11,H111,no,N,33,,74213,17767,CHO
34,,SING,C11,H112,no,N,34,,74213,17767,CHO
35,,SING,C12,C13,no,N,35,,74213,17767,CHO
36,,SING,C12,H121,no,N,36,,74213,17767,CHO
37,,SING,C12,H122,no,N,37,,74213,17767,CHO
38,,SING,C13,C14,no,N,38,,74213,17767,CHO
39,,SING,C13,C17,no,N,39,,74213,17767,CHO
40,,SING,C13,C18,no,N,40,,74213,17767,CHO
41,,SING,C14,C15,no,N,41,,74213,17767,CHO
42,,SING,C14,H14,no,N,42,,74213,17767,CHO
43,,SING,C15,C16,no,N,43,,74213,17767,CHO
44,,SING,C15,H151,no,N,44,,74213,17767,CHO
45,,SING,C15,H152,no,N,45,,74213,17767,CHO
46,,SING,C16,C17,no,N,46,,74213,17767,CHO
47,,SING,C16,H161,no,N,47,,74213,17767,CHO
48,,SING,C16,H162,no,N,48,,74213,17767,CHO
49,,SING,C17,C20,no,N,49,,74213,17767,CHO
50,,SING,C17,H17,no,N,50,,74213,17767,CHO
51,,SING,C18,H181,no,N,51,,74213,17767,CHO
52,,SING,C18,H182,no,N,52,,74213,17767,CHO
53,,SING,C18,H183,no,N,53,,74213,17767,CHO
54,,SING,C19,H191,no,N,54,,74213,17767,CHO
55,,SING,C19,H192,no,N,55,,74213,17767,CHO
56,,SING,C19,H193,no,N,56,,74213,17767,CHO
57,,SING,C20,C21,no,N,57,,74213,17767,CHO
58,,SING,C20,C22,no,N,58,,74213,17767,CHO
59,,SING,C20,H20,no,N,59,,74213,17767,CHO
60,,SING,C21,H211,no,N,60,,74213,17767,CHO
61,,SING,C21,H212,no,N,61,,74213,17767,CHO
62,,SING,C21,H213,no,N,62,,74213,17767,CHO
63,,SING,C22,C23,no,N,63,,74213,17767,CHO
64,,SING,C22,H221,no,N,64,,74213,17767,CHO
65,,SING,C22,H222,no,N,65,,74213,17767,CHO
66,,SING,C23,C24,no,N,66,,74213,17767,CHO
67,,SING,C23,H231,no,N,67,,74213,17767,CHO
68,,SING,C23,H232,no,N,68,,74213,17767,CHO
69,,DOUB,C24,O24,no,N,69,,74213,17767,CHO
70,,SING,C24,N25,no,N,70,,74213,17767,CHO
71,,SING,N25,C26,no,N,71,,74213,17767,CHO
72,,SING,N25,HN,no,N,72,,74213,17767,CHO
73,,SING,C26,C27,no,N,73,,74213,17767,CHO
74,,SING,C26,H261,no,N,74,,74213,17767,CHO
75,,SING,C26,H262,no,N,75,,74213,17767,CHO
76,,DOUB,C27,OT1,no,N,76,,74213,17767,CHO
77,,SING,C27,OT2,no,N,77,,74213,17767,CHO
78,,SING,OT2,HOT,no,N,78,,74213,17767,CHO
1,,SING,C,O,no,N,1,,74214,17767,GCH
2,,SING,C,C1,no,N,2,,74214,17767,GCH
3,,SING,C,C5,no,N,3,,74214,17767,GCH
4,,SING,C,H12,no,N,4,,74214,17767,GCH
5,,SING,O,H1,no,N,5,,74214,17767,GCH
6,,SING,C1,C2,no,N,6,,74214,17767,GCH
7,,SING,C1,H10,no,N,7,,74214,17767,GCH
8,,SING,C1,H11,no,N,8,,74214,17767,GCH
9,,SING,C2,C3,no,N,9,,74214,17767,GCH
10,,SING,C2,C7,no,N,10,,74214,17767,GCH
11,,SING,C2,H9,no,N,11,,74214,17767,GCH
12,,SING,C3,C4,no,N,12,,74214,17767,GCH
13,,SING,C3,C6,no,N,13,,74214,17767,GCH
14,,SING,C3,C10,no,N,14,,74214,17767,GCH
15,,SING,C4,C5,no,N,15,,74214,17767,GCH
16,,SING,C4,H4,no,N,16,,74214,17767,GCH
17,,SING,C4,H5,no,N,17,,74214,17767,GCH
18,,SING,C5,H2,no,N,18,,74214,17767,GCH
19,,SING,C5,H3,no,N,19,,74214,17767,GCH
20,,SING,C6,H6,no,N,20,,74214,17767,GCH
21,,SING,C6,H7,no,N,21,,74214,17767,GCH
22,,SING,C6,H8,no,N,22,,74214,17767,GCH
23,,SING,C7,C8,no,N,23,,74214,17767,GCH
24,,SING,C7,H17,no,N,24,,74214,17767,GCH
25,,SING,C7,H18,no,N,25,,74214,17767,GCH
26,,SING,C8,O1,no,N,26,,74214,17767,GCH
27,,SING,C8,C9,no,N,27,,74214,17767,GCH
28,,SING,C8,H16,no,N,28,,74214,17767,GCH
29,,SING,O1,H13,no,N,29,,74214,17767,GCH
30,,SING,C9,C10,no,N,30,,74214,17767,GCH
31,,SING,C9,C14,no,N,31,,74214,17767,GCH
32,,SING,C9,H15,no,N,32,,74214,17767,GCH
33,,SING,C10,C11,no,N,33,,74214,17767,GCH
34,,SING,C10,H14,no,N,34,,74214,17767,GCH
35,,SING,C11,C12,no,N,35,,74214,17767,GCH
36,,SING,C11,H41,no,N,36,,74214,17767,GCH
37,,SING,C11,H42,no,N,37,,74214,17767,GCH
38,,SING,C12,C13,no,N,38,,74214,17767,GCH
39,,SING,C12,O3,no,N,39,,74214,17767,GCH
40,,SING,C12,H40,no,N,40,,74214,17767,GCH
41,,SING,C13,C14,no,N,41,,74214,17767,GCH
42,,SING,C13,C17,no,N,42,,74214,17767,GCH
43,,SING,C13,C23,no,N,43,,74214,17767,GCH
44,,SING,C14,C15,no,N,44,,74214,17767,GCH
45,,SING,C14,H35,no,N,45,,74214,17767,GCH
46,,SING,C15,C16,no,N,46,,74214,17767,GCH
47,,SING,C15,H33,no,N,47,,74214,17767,GCH
48,,SING,C15,H34,no,N,48,,74214,17767,GCH
49,,SING,C16,C17,no,N,49,,74214,17767,GCH
50,,SING,C16,H31,no,N,50,,74214,17767,GCH
51,,SING,C16,H32,no,N,51,,74214,17767,GCH
52,,SING,C17,C18,no,N,52,,74214,17767,GCH
53,,SING,C17,H30,no,N,53,,74214,17767,GCH
54,,SING,C18,C19,no,N,54,,74214,17767,GCH
55,,SING,C18,C20,no,N,55,,74214,17767,GCH
56,,SING,C18,H29,no,N,56,,74214,17767,GCH
57,,SING,C19,H19,no,N,57,,74214,17767,GCH
58,,SING,C19,H20,no,N,58,,74214,17767,GCH
59,,SING,C19,H21,no,N,59,,74214,17767,GCH
60,,SING,C20,C21,no,N,60,,74214,17767,GCH
61,,SING,C20,H27,no,N,61,,74214,17767,GCH
62,,SING,C20,H28,no,N,62,,74214,17767,GCH
63,,SING,C21,C22,no,N,63,,74214,17767,GCH
64,,SING,C21,H25,no,N,64,,74214,17767,GCH
65,,SING,C21,H26,no,N,65,,74214,17767,GCH
66,,SING,C22,N,no,N,66,,74214,17767,GCH
67,,DOUB,C22,O2,no,N,67,,74214,17767,GCH
68,,SING,N,CA,no,N,68,,74214,17767,GCH
69,,SING,N,H24,no,N,69,,74214,17767,GCH
70,,SING,CA,C24,no,N,70,,74214,17767,GCH
71,,SING,CA,H22,no,N,71,,74214,17767,GCH
72,,SING,CA,H23,no,N,72,,74214,17767,GCH
73,,SING,C23,H36,no,N,73,,74214,17767,GCH
74,,SING,C23,H37,no,N,74,,74214,17767,GCH
75,,SING,C23,H38,no,N,75,,74214,17767,GCH
76,,SING,O3,H39,no,N,76,,74214,17767,GCH
77,,SING,C24,O4,no,N,77,,74214,17767,GCH
78,,DOUB,C24,O5,no,N,78,,74214,17767,GCH
79,,SING,O4,H43,no,N,79,,74214,17767,GCH
1,,SING,C1,C2,no,N,1,,74270,1777,AAC
2,,SING,C1,O1,no,N,2,,74270,1777,AAC
3,,DOUB,C1,O2,no,N,3,,74270,1777,AAC
4,,SING,C2,N1,no,N,4,,74270,1777,AAC
5,,SING,C2,HC21,no,N,5,,74270,1777,AAC
6,,SING,C2,HC22,no,N,6,,74270,1777,AAC
7,,SING,C3,C4,no,N,7,,74270,1777,AAC
8,,SING,C3,N1,no,N,8,,74270,1777,AAC
9,,DOUB,C3,O3,no,N,9,,74270,1777,AAC
10,,SING,C4,HC41,no,N,10,,74270,1777,AAC
11,,SING,C4,HC42,no,N,11,,74270,1777,AAC
12,,SING,C4,HC43,no,N,12,,74270,1777,AAC
13,,SING,N1,HN1,no,N,13,,74270,1777,AAC
14,,SING,O1,HO1,no,N,14,,74270,1777,AAC
1,,SING,FE,NA,no,N,1,,74271,1777,HEC
2,,SING,FE,NB,no,N,2,,74271,1777,HEC
3,,SING,FE,NC,no,N,3,,74271,1777,HEC
4,,SING,FE,ND,no,N,4,,74271,1777,HEC
5,,DOUB,CHA,C1A,no,N,5,,74271,1777,HEC
6,,SING,CHA,C4D,no,N,6,,74271,1777,HEC
7,,SING,CHA,HHA,no,N,7,,74271,1777,HEC
8,,DOUB,CHB,C4A,no,N,8,,74271,1777,HEC
9,,SING,CHB,C1B,no,N,9,,74271,1777,HEC
10,,SING,CHB,HHB,no,N,10,,74271,1777,HEC
11,,DOUB,CHC,C4B,no,N,11,,74271,1777,HEC
12,,SING,CHC,C1C,no,N,12,,74271,1777,HEC
13,,SING,CHC,HHC,no,N,13,,74271,1777,HEC
14,,DOUB,CHD,C4C,no,N,14,,74271,1777,HEC
15,,SING,CHD,C1D,no,N,15,,74271,1777,HEC
16,,SING,CHD,HHD,no,N,16,,74271,1777,HEC
17,,SING,NA,C1A,yes,N,17,,74271,1777,HEC
18,,SING,NA,C4A,yes,N,18,,74271,1777,HEC
19,,SING,C1A,C2A,yes,N,19,,74271,1777,HEC
20,,DOUB,C2A,C3A,yes,N,20,,74271,1777,HEC
21,,SING,C2A,CAA,no,N,21,,74271,1777,HEC
22,,SING,C3A,C4A,yes,N,22,,74271,1777,HEC
23,,SING,C3A,CMA,no,N,23,,74271,1777,HEC
24,,SING,CMA,HMA1,no,N,24,,74271,1777,HEC
25,,SING,CMA,HMA2,no,N,25,,74271,1777,HEC
26,,SING,CMA,HMA3,no,N,26,,74271,1777,HEC
27,,SING,CAA,CBA,no,N,27,,74271,1777,HEC
28,,SING,CAA,HAA1,no,N,28,,74271,1777,HEC
29,,SING,CAA,HAA2,no,N,29,,74271,1777,HEC
30,,SING,CBA,CGA,no,N,30,,74271,1777,HEC
31,,SING,CBA,HBA1,no,N,31,,74271,1777,HEC
32,,SING,CBA,HBA2,no,N,32,,74271,1777,HEC
33,,DOUB,CGA,O1A,no,N,33,,74271,1777,HEC
34,,SING,CGA,O2A,no,N,34,,74271,1777,HEC
35,,SING,O2A,H2A,no,N,35,,74271,1777,HEC
36,,SING,NB,C1B,yes,N,36,,74271,1777,HEC
37,,SING,NB,C4B,yes,N,37,,74271,1777,HEC
38,,DOUB,C1B,C2B,yes,N,38,,74271,1777,HEC
39,,SING,C2B,C3B,yes,N,39,,74271,1777,HEC
40,,SING,C2B,CMB,no,N,40,,74271,1777,HEC
41,,SING,C3B,C4B,yes,N,41,,74271,1777,HEC
42,,DOUB,C3B,CAB,no,E,42,,74271,1777,HEC
43,,SING,CMB,HMB1,no,N,43,,74271,1777,HEC
44,,SING,CMB,HMB2,no,N,44,,74271,1777,HEC
45,,SING,CMB,HMB3,no,N,45,,74271,1777,HEC
46,,SING,CAB,CBB,no,N,46,,74271,1777,HEC
47,,SING,CAB,HAB,no,N,47,,74271,1777,HEC
48,,SING,CBB,HBB1,no,N,48,,74271,1777,HEC
49,,SING,CBB,HBB2,no,N,49,,74271,1777,HEC
50,,SING,CBB,HBB3,no,N,50,,74271,1777,HEC
51,,SING,NC,C1C,yes,N,51,,74271,1777,HEC
52,,SING,NC,C4C,yes,N,52,,74271,1777,HEC
53,,DOUB,C1C,C2C,yes,N,53,,74271,1777,HEC
54,,SING,C2C,C3C,yes,N,54,,74271,1777,HEC
55,,SING,C2C,CMC,no,N,55,,74271,1777,HEC
56,,SING,C3C,C4C,yes,N,56,,74271,1777,HEC
57,,DOUB,C3C,CAC,no,E,57,,74271,1777,HEC
58,,SING,CMC,HMC1,no,N,58,,74271,1777,HEC
59,,SING,CMC,HMC2,no,N,59,,74271,1777,HEC
60,,SING,CMC,HMC3,no,N,60,,74271,1777,HEC
61,,SING,CAC,CBC,no,N,61,,74271,1777,HEC
62,,SING,CAC,HAC,no,N,62,,74271,1777,HEC
63,,SING,CBC,HBC1,no,N,63,,74271,1777,HEC
64,,SING,CBC,HBC2,no,N,64,,74271,1777,HEC
65,,SING,CBC,HBC3,no,N,65,,74271,1777,HEC
66,,SING,ND,C1D,yes,N,66,,74271,1777,HEC
67,,SING,ND,C4D,yes,N,67,,74271,1777,HEC
68,,DOUB,C1D,C2D,yes,N,68,,74271,1777,HEC
69,,SING,C2D,C3D,yes,N,69,,74271,1777,HEC
70,,SING,C2D,CMD,no,N,70,,74271,1777,HEC
71,,DOUB,C3D,C4D,yes,N,71,,74271,1777,HEC
72,,SING,C3D,CAD,no,N,72,,74271,1777,HEC
73,,SING,CMD,HMD1,no,N,73,,74271,1777,HEC
74,,SING,CMD,HMD2,no,N,74,,74271,1777,HEC
75,,SING,CMD,HMD3,no,N,75,,74271,1777,HEC
76,,SING,CAD,CBD,no,N,76,,74271,1777,HEC
77,,SING,CAD,HAD1,no,N,77,,74271,1777,HEC
78,,SING,CAD,HAD2,no,N,78,,74271,1777,HEC
79,,SING,CBD,CGD,no,N,79,,74271,1777,HEC
80,,SING,CBD,HBD1,no,N,80,,74271,1777,HEC
81,,SING,CBD,HBD2,no,N,81,,74271,1777,HEC
82,,DOUB,CGD,O1D,no,N,82,,74271,1777,HEC
83,,SING,CGD,O2D,no,N,83,,74271,1777,HEC
84,,SING,O2D,H2D,no,N,84,,74271,1777,HEC
1,,SING,C1,O1,no,N,1,,74286,17770,3EV
2,,SING,C1,C2,no,N,2,,74286,17770,3EV
3,,SING,C1,C10,no,N,3,,74286,17770,3EV
4,,SING,C2,C3,no,N,4,,74286,17770,3EV
5,,SING,O2,C3,no,N,5,,74286,17770,3EV
6,,SING,C3,C4,no,N,6,,74286,17770,3EV
7,,SING,O3,C25,no,N,7,,74286,17770,3EV
8,,SING,C4,C5,no,N,8,,74286,17770,3EV
9,,DOUB,C5,C6,no,N,9,,74286,17770,3EV
10,,SING,C5,C10,no,N,10,,74286,17770,3EV
11,,SING,C6,C7,no,N,11,,74286,17770,3EV
12,,DOUB,C7,C8,no,N,12,,74286,17770,3EV
13,,SING,C8,C9,no,N,13,,74286,17770,3EV
14,,SING,C8,C14,no,N,14,,74286,17770,3EV
15,,SING,C9,C11,no,N,15,,74286,17770,3EV
16,,DOUB,C10,C19,no,N,16,,74286,17770,3EV
17,,SING,C11,C12,no,N,17,,74286,17770,3EV
18,,SING,C12,C13,no,Z,18,,74286,17770,3EV
19,,SING,C13,C14,no,N,19,,74286,17770,3EV
20,,SING,C13,C17,no,N,20,,74286,17770,3EV
21,,SING,C13,C18,no,N,21,,74286,17770,3EV
22,,SING,C14,C15,no,E,22,,74286,17770,3EV
23,,SING,C15,C16,no,N,23,,74286,17770,3EV
24,,SING,C16,C17,no,N,24,,74286,17770,3EV
25,,SING,C17,C20,no,N,25,,74286,17770,3EV
26,,SING,C20,C21,no,N,26,,74286,17770,3EV
27,,SING,C20,C22,no,N,27,,74286,17770,3EV
28,,SING,C22,C23,no,N,28,,74286,17770,3EV
29,,SING,C23,C24,no,N,29,,74286,17770,3EV
30,,SING,C24,C25,no,N,30,,74286,17770,3EV
31,,SING,C25,C26,no,N,31,,74286,17770,3EV
32,,SING,C25,C27,no,N,32,,74286,17770,3EV
33,,SING,C1,H1,no,N,33,,74286,17770,3EV
34,,SING,O1,HO1,no,N,34,,74286,17770,3EV
35,,SING,C2,H2,no,N,35,,74286,17770,3EV
36,,SING,C2,H2A,no,N,36,,74286,17770,3EV
37,,SING,O2,HO2,no,N,37,,74286,17770,3EV
38,,SING,C3,H3,no,N,38,,74286,17770,3EV
39,,SING,O3,HO3,no,N,39,,74286,17770,3EV
40,,SING,C4,H4,no,N,40,,74286,17770,3EV
41,,SING,C4,H4A,no,N,41,,74286,17770,3EV
42,,SING,C6,H6,no,N,42,,74286,17770,3EV
43,,SING,C7,H7,no,N,43,,74286,17770,3EV
44,,SING,C9,H9,no,N,44,,74286,17770,3EV
45,,SING,C9,H9A,no,N,45,,74286,17770,3EV
46,,SING,C11,H11,no,N,46,,74286,17770,3EV
47,,SING,C11,H11A,no,N,47,,74286,17770,3EV
48,,SING,C12,H12,no,N,48,,74286,17770,3EV
49,,SING,C12,H12A,no,N,49,,74286,17770,3EV
50,,SING,C14,H14,no,N,50,,74286,17770,3EV
51,,SING,C15,H15,no,N,51,,74286,17770,3EV
52,,SING,C15,H15A,no,N,52,,74286,17770,3EV
53,,SING,C16,H16,no,N,53,,74286,17770,3EV
54,,SING,C16,H16A,no,N,54,,74286,17770,3EV
55,,SING,C17,H17,no,N,55,,74286,17770,3EV
56,,SING,C18,H18,no,N,56,,74286,17770,3EV
57,,SING,C18,H18A,no,N,57,,74286,17770,3EV
58,,SING,C18,H18B,no,N,58,,74286,17770,3EV
59,,SING,C19,H19,no,N,59,,74286,17770,3EV
60,,SING,C19,H19A,no,N,60,,74286,17770,3EV
61,,SING,C20,H20,no,N,61,,74286,17770,3EV
62,,SING,C21,H21,no,N,62,,74286,17770,3EV
63,,SING,C21,H21A,no,N,63,,74286,17770,3EV
64,,SING,C21,H21B,no,N,64,,74286,17770,3EV
65,,SING,C22,H22,no,N,65,,74286,17770,3EV
66,,SING,C22,H22A,no,N,66,,74286,17770,3EV
67,,SING,C23,H23,no,N,67,,74286,17770,3EV
68,,SING,C23,H23A,no,N,68,,74286,17770,3EV
69,,SING,C24,H24,no,N,69,,74286,17770,3EV
70,,SING,C24,H24A,no,N,70,,74286,17770,3EV
71,,SING,C26,H26,no,N,71,,74286,17770,3EV
72,,SING,C26,H26A,no,N,72,,74286,17770,3EV
73,,SING,C26,H26B,no,N,73,,74286,17770,3EV
74,,SING,C27,H27,no,N,74,,74286,17770,3EV
75,,SING,C27,H27A,no,N,75,,74286,17770,3EV
76,,SING,C27,H27B,no,N,76,,74286,17770,3EV
1,,DOUB,PG,O1G,no,N,1,,74555,17785,GNP
2,,SING,PG,O2G,no,N,2,,74555,17785,GNP
3,,SING,PG,O3G,no,N,3,,74555,17785,GNP
4,,SING,PG,N3B,no,N,4,,74555,17785,GNP
5,,SING,O2G,HOG2,no,N,5,,74555,17785,GNP
6,,SING,O3G,HOG3,no,N,6,,74555,17785,GNP
7,,SING,N3B,PB,no,N,7,,74555,17785,GNP
8,,SING,N3B,HNB3,no,N,8,,74555,17785,GNP
9,,DOUB,PB,O1B,no,N,9,,74555,17785,GNP
10,,SING,PB,O2B,no,N,10,,74555,17785,GNP
11,,SING,PB,O3A,no,N,11,,74555,17785,GNP
12,,SING,O2B,HOB2,no,N,12,,74555,17785,GNP
13,,SING,O3A,PA,no,N,13,,74555,17785,GNP
14,,DOUB,PA,O1A,no,N,14,,74555,17785,GNP
15,,SING,PA,O2A,no,N,15,,74555,17785,GNP
16,,SING,PA,O5',no,N,16,,74555,17785,GNP
17,,SING,O2A,HOA2,no,N,17,,74555,17785,GNP
18,,SING,O5',C5',no,N,18,,74555,17785,GNP
19,,SING,C5',C4',no,N,19,,74555,17785,GNP
20,,SING,C5',H5'2,no,N,20,,74555,17785,GNP
21,,SING,C5',H5'1,no,N,21,,74555,17785,GNP
22,,SING,C4',O4',no,N,22,,74555,17785,GNP
23,,SING,C4',C3',no,N,23,,74555,17785,GNP
24,,SING,C4',H4',no,N,24,,74555,17785,GNP
25,,SING,O4',C1',no,N,25,,74555,17785,GNP
26,,SING,C3',O3',no,N,26,,74555,17785,GNP
27,,SING,C3',C2',no,N,27,,74555,17785,GNP
28,,SING,C3',H3',no,N,28,,74555,17785,GNP
29,,SING,O3',HO3',no,N,29,,74555,17785,GNP
30,,SING,C2',O2',no,N,30,,74555,17785,GNP
31,,SING,C2',C1',no,N,31,,74555,17785,GNP
32,,SING,C2',H2',no,N,32,,74555,17785,GNP
33,,SING,O2',HO2',no,N,33,,74555,17785,GNP
34,,SING,C1',N9,no,N,34,,74555,17785,GNP
35,,SING,C1',H1',no,N,35,,74555,17785,GNP
36,,SING,N9,C8,yes,N,36,,74555,17785,GNP
37,,SING,N9,C4,yes,N,37,,74555,17785,GNP
38,,DOUB,C8,N7,yes,N,38,,74555,17785,GNP
39,,SING,C8,H8,no,N,39,,74555,17785,GNP
40,,SING,N7,C5,yes,N,40,,74555,17785,GNP
41,,SING,C5,C6,yes,N,41,,74555,17785,GNP
42,,DOUB,C5,C4,yes,N,42,,74555,17785,GNP
43,,DOUB,C6,O6,no,N,43,,74555,17785,GNP
44,,SING,C6,N1,yes,N,44,,74555,17785,GNP
45,,SING,N1,C2,yes,N,45,,74555,17785,GNP
46,,SING,N1,HN1,no,N,46,,74555,17785,GNP
47,,SING,C2,N2,no,N,47,,74555,17785,GNP
48,,DOUB,C2,N3,yes,N,48,,74555,17785,GNP
49,,SING,N2,HN21,no,N,49,,74555,17785,GNP
50,,SING,N2,HN22,no,N,50,,74555,17785,GNP
51,,SING,N3,C4,yes,N,51,,74555,17785,GNP
1,,SING,C1,C2,no,N,1,,74602,17788,TME
2,,SING,C1,H11,no,N,2,,74602,17788,TME
3,,SING,C1,H12,no,N,3,,74602,17788,TME
4,,SING,C1,H13,no,N,4,,74602,17788,TME
5,,SING,C2,C3,no,N,5,,74602,17788,TME
6,,SING,C2,H21,no,N,6,,74602,17788,TME
7,,SING,C2,H22,no,N,7,,74602,17788,TME
8,,SING,C3,H31,no,N,8,,74602,17788,TME
9,,SING,C3,H32,no,N,9,,74602,17788,TME
10,,SING,C3,H33,no,N,10,,74602,17788,TME
1,,SING,C1,C2,no,N,1,,74632,1779,AAC
2,,SING,C1,O1,no,N,2,,74632,1779,AAC
3,,DOUB,C1,O2,no,N,3,,74632,1779,AAC
4,,SING,C2,N1,no,N,4,,74632,1779,AAC
5,,SING,C2,HC21,no,N,5,,74632,1779,AAC
6,,SING,C2,HC22,no,N,6,,74632,1779,AAC
7,,SING,C3,C4,no,N,7,,74632,1779,AAC
8,,SING,C3,N1,no,N,8,,74632,1779,AAC
9,,DOUB,C3,O3,no,N,9,,74632,1779,AAC
10,,SING,C4,HC41,no,N,10,,74632,1779,AAC
11,,SING,C4,HC42,no,N,11,,74632,1779,AAC
12,,SING,C4,HC43,no,N,12,,74632,1779,AAC
13,,SING,N1,HN1,no,N,13,,74632,1779,AAC
14,,SING,O1,HO1,no,N,14,,74632,1779,AAC
1,,SING,FE,NA,no,N,1,,74633,1779,HEC
2,,SING,FE,NB,no,N,2,,74633,1779,HEC
3,,SING,FE,NC,no,N,3,,74633,1779,HEC
4,,SING,FE,ND,no,N,4,,74633,1779,HEC
5,,DOUB,CHA,C1A,no,N,5,,74633,1779,HEC
6,,SING,CHA,C4D,no,N,6,,74633,1779,HEC
7,,SING,CHA,HHA,no,N,7,,74633,1779,HEC
8,,DOUB,CHB,C4A,no,N,8,,74633,1779,HEC
9,,SING,CHB,C1B,no,N,9,,74633,1779,HEC
10,,SING,CHB,HHB,no,N,10,,74633,1779,HEC
11,,DOUB,CHC,C4B,no,N,11,,74633,1779,HEC
12,,SING,CHC,C1C,no,N,12,,74633,1779,HEC
13,,SING,CHC,HHC,no,N,13,,74633,1779,HEC
14,,DOUB,CHD,C4C,no,N,14,,74633,1779,HEC
15,,SING,CHD,C1D,no,N,15,,74633,1779,HEC
16,,SING,CHD,HHD,no,N,16,,74633,1779,HEC
17,,SING,NA,C1A,yes,N,17,,74633,1779,HEC
18,,SING,NA,C4A,yes,N,18,,74633,1779,HEC
19,,SING,C1A,C2A,yes,N,19,,74633,1779,HEC
20,,DOUB,C2A,C3A,yes,N,20,,74633,1779,HEC
21,,SING,C2A,CAA,no,N,21,,74633,1779,HEC
22,,SING,C3A,C4A,yes,N,22,,74633,1779,HEC
23,,SING,C3A,CMA,no,N,23,,74633,1779,HEC
24,,SING,CMA,HMA1,no,N,24,,74633,1779,HEC
25,,SING,CMA,HMA2,no,N,25,,74633,1779,HEC
26,,SING,CMA,HMA3,no,N,26,,74633,1779,HEC
27,,SING,CAA,CBA,no,N,27,,74633,1779,HEC
28,,SING,CAA,HAA1,no,N,28,,74633,1779,HEC
29,,SING,CAA,HAA2,no,N,29,,74633,1779,HEC
30,,SING,CBA,CGA,no,N,30,,74633,1779,HEC
31,,SING,CBA,HBA1,no,N,31,,74633,1779,HEC
32,,SING,CBA,HBA2,no,N,32,,74633,1779,HEC
33,,DOUB,CGA,O1A,no,N,33,,74633,1779,HEC
34,,SING,CGA,O2A,no,N,34,,74633,1779,HEC
35,,SING,O2A,H2A,no,N,35,,74633,1779,HEC
36,,SING,NB,C1B,yes,N,36,,74633,1779,HEC
37,,SING,NB,C4B,yes,N,37,,74633,1779,HEC
38,,DOUB,C1B,C2B,yes,N,38,,74633,1779,HEC
39,,SING,C2B,C3B,yes,N,39,,74633,1779,HEC
40,,SING,C2B,CMB,no,N,40,,74633,1779,HEC
41,,SING,C3B,C4B,yes,N,41,,74633,1779,HEC
42,,DOUB,C3B,CAB,no,E,42,,74633,1779,HEC
43,,SING,CMB,HMB1,no,N,43,,74633,1779,HEC
44,,SING,CMB,HMB2,no,N,44,,74633,1779,HEC
45,,SING,CMB,HMB3,no,N,45,,74633,1779,HEC
46,,SING,CAB,CBB,no,N,46,,74633,1779,HEC
47,,SING,CAB,HAB,no,N,47,,74633,1779,HEC
48,,SING,CBB,HBB1,no,N,48,,74633,1779,HEC
49,,SING,CBB,HBB2,no,N,49,,74633,1779,HEC
50,,SING,CBB,HBB3,no,N,50,,74633,1779,HEC
51,,SING,NC,C1C,yes,N,51,,74633,1779,HEC
52,,SING,NC,C4C,yes,N,52,,74633,1779,HEC
53,,DOUB,C1C,C2C,yes,N,53,,74633,1779,HEC
54,,SING,C2C,C3C,yes,N,54,,74633,1779,HEC
55,,SING,C2C,CMC,no,N,55,,74633,1779,HEC
56,,SING,C3C,C4C,yes,N,56,,74633,1779,HEC
57,,DOUB,C3C,CAC,no,E,57,,74633,1779,HEC
58,,SING,CMC,HMC1,no,N,58,,74633,1779,HEC
59,,SING,CMC,HMC2,no,N,59,,74633,1779,HEC
60,,SING,CMC,HMC3,no,N,60,,74633,1779,HEC
61,,SING,CAC,CBC,no,N,61,,74633,1779,HEC
62,,SING,CAC,HAC,no,N,62,,74633,1779,HEC
63,,SING,CBC,HBC1,no,N,63,,74633,1779,HEC
64,,SING,CBC,HBC2,no,N,64,,74633,1779,HEC
65,,SING,CBC,HBC3,no,N,65,,74633,1779,HEC
66,,SING,ND,C1D,yes,N,66,,74633,1779,HEC
67,,SING,ND,C4D,yes,N,67,,74633,1779,HEC
68,,DOUB,C1D,C2D,yes,N,68,,74633,1779,HEC
69,,SING,C2D,C3D,yes,N,69,,74633,1779,HEC
70,,SING,C2D,CMD,no,N,70,,74633,1779,HEC
71,,DOUB,C3D,C4D,yes,N,71,,74633,1779,HEC
72,,SING,C3D,CAD,no,N,72,,74633,1779,HEC
73,,SING,CMD,HMD1,no,N,73,,74633,1779,HEC
74,,SING,CMD,HMD2,no,N,74,,74633,1779,HEC
75,,SING,CMD,HMD3,no,N,75,,74633,1779,HEC
76,,SING,CAD,CBD,no,N,76,,74633,1779,HEC
77,,SING,CAD,HAD1,no,N,77,,74633,1779,HEC
78,,SING,CAD,HAD2,no,N,78,,74633,1779,HEC
79,,SING,CBD,CGD,no,N,79,,74633,1779,HEC
80,,SING,CBD,HBD1,no,N,80,,74633,1779,HEC
81,,SING,CBD,HBD2,no,N,81,,74633,1779,HEC
82,,DOUB,CGD,O1D,no,N,82,,74633,1779,HEC
83,,SING,CGD,O2D,no,N,83,,74633,1779,HEC
84,,SING,O2D,H2D,no,N,84,,74633,1779,HEC
1,,SING,C1,C2,no,N,1,,74649,17790,HNE
2,,DOUB,C1,O11,no,N,2,,74649,17790,HNE
3,,SING,C1,H1,no,N,3,,74649,17790,HNE
4,,DOUB,C2,C3,no,N,4,,74649,17790,HNE
5,,SING,C2,H2,no,N,5,,74649,17790,HNE
6,,SING,C3,C4,no,N,6,,74649,17790,HNE
7,,SING,C3,H3,no,N,7,,74649,17790,HNE
8,,SING,C4,C5,no,N,8,,74649,17790,HNE
9,,SING,C4,O10,no,N,9,,74649,17790,HNE
10,,SING,C4,H4,no,N,10,,74649,17790,HNE
11,,SING,C5,C6,no,N,11,,74649,17790,HNE
12,,SING,C5,H5C1,no,N,12,,74649,17790,HNE
13,,SING,C5,H5C2,no,N,13,,74649,17790,HNE
14,,SING,C6,C7,no,N,14,,74649,17790,HNE
15,,SING,C6,H6C1,no,N,15,,74649,17790,HNE
16,,SING,C6,H6C2,no,N,16,,74649,17790,HNE
17,,SING,C7,C8,no,N,17,,74649,17790,HNE
18,,SING,C7,H7C1,no,N,18,,74649,17790,HNE
19,,SING,C7,H7C2,no,N,19,,74649,17790,HNE
20,,SING,C8,C9,no,N,20,,74649,17790,HNE
21,,SING,C8,H8C1,no,N,21,,74649,17790,HNE
22,,SING,C8,H8C2,no,N,22,,74649,17790,HNE
23,,SING,C9,H9C1,no,N,23,,74649,17790,HNE
24,,SING,C9,H9C2,no,N,24,,74649,17790,HNE
25,,SING,C9,H9C3,no,N,25,,74649,17790,HNE
26,,SING,O10,H10,no,N,26,,74649,17790,HNE
1,,SING,C1,C2,no,N,1,,74667,17791,HNE
2,,DOUB,C1,O11,no,N,2,,74667,17791,HNE
3,,SING,C1,H1,no,N,3,,74667,17791,HNE
4,,DOUB,C2,C3,no,N,4,,74667,17791,HNE
5,,SING,C2,H2,no,N,5,,74667,17791,HNE
6,,SING,C3,C4,no,N,6,,74667,17791,HNE
7,,SING,C3,H3,no,N,7,,74667,17791,HNE
8,,SING,C4,C5,no,N,8,,74667,17791,HNE
9,,SING,C4,O10,no,N,9,,74667,17791,HNE
10,,SING,C4,H4,no,N,10,,74667,17791,HNE
11,,SING,C5,C6,no,N,11,,74667,17791,HNE
12,,SING,C5,H5C1,no,N,12,,74667,17791,HNE
13,,SING,C5,H5C2,no,N,13,,74667,17791,HNE
14,,SING,C6,C7,no,N,14,,74667,17791,HNE
15,,SING,C6,H6C1,no,N,15,,74667,17791,HNE
16,,SING,C6,H6C2,no,N,16,,74667,17791,HNE
17,,SING,C7,C8,no,N,17,,74667,17791,HNE
18,,SING,C7,H7C1,no,N,18,,74667,17791,HNE
19,,SING,C7,H7C2,no,N,19,,74667,17791,HNE
20,,SING,C8,C9,no,N,20,,74667,17791,HNE
21,,SING,C8,H8C1,no,N,21,,74667,17791,HNE
22,,SING,C8,H8C2,no,N,22,,74667,17791,HNE
23,,SING,C9,H9C1,no,N,23,,74667,17791,HNE
24,,SING,C9,H9C2,no,N,24,,74667,17791,HNE
25,,SING,C9,H9C3,no,N,25,,74667,17791,HNE
26,,SING,O10,H10,no,N,26,,74667,17791,HNE
1,,SING,C1,C2,no,N,1,,74995,1781,AAC
2,,SING,C1,O1,no,N,2,,74995,1781,AAC
3,,DOUB,C1,O2,no,N,3,,74995,1781,AAC
4,,SING,C2,N1,no,N,4,,74995,1781,AAC
5,,SING,C2,HC21,no,N,5,,74995,1781,AAC
6,,SING,C2,HC22,no,N,6,,74995,1781,AAC
7,,SING,C3,C4,no,N,7,,74995,1781,AAC
8,,SING,C3,N1,no,N,8,,74995,1781,AAC
9,,DOUB,C3,O3,no,N,9,,74995,1781,AAC
10,,SING,C4,HC41,no,N,10,,74995,1781,AAC
11,,SING,C4,HC42,no,N,11,,74995,1781,AAC
12,,SING,C4,HC43,no,N,12,,74995,1781,AAC
13,,SING,N1,HN1,no,N,13,,74995,1781,AAC
14,,SING,O1,HO1,no,N,14,,74995,1781,AAC
1,,SING,FE,NA,no,N,1,,74996,1781,HEC
2,,SING,FE,NB,no,N,2,,74996,1781,HEC
3,,SING,FE,NC,no,N,3,,74996,1781,HEC
4,,SING,FE,ND,no,N,4,,74996,1781,HEC
5,,DOUB,CHA,C1A,no,N,5,,74996,1781,HEC
6,,SING,CHA,C4D,no,N,6,,74996,1781,HEC
7,,SING,CHA,HHA,no,N,7,,74996,1781,HEC
8,,DOUB,CHB,C4A,no,N,8,,74996,1781,HEC
9,,SING,CHB,C1B,no,N,9,,74996,1781,HEC
10,,SING,CHB,HHB,no,N,10,,74996,1781,HEC
11,,DOUB,CHC,C4B,no,N,11,,74996,1781,HEC
12,,SING,CHC,C1C,no,N,12,,74996,1781,HEC
13,,SING,CHC,HHC,no,N,13,,74996,1781,HEC
14,,DOUB,CHD,C4C,no,N,14,,74996,1781,HEC
15,,SING,CHD,C1D,no,N,15,,74996,1781,HEC
16,,SING,CHD,HHD,no,N,16,,74996,1781,HEC
17,,SING,NA,C1A,yes,N,17,,74996,1781,HEC
18,,SING,NA,C4A,yes,N,18,,74996,1781,HEC
19,,SING,C1A,C2A,yes,N,19,,74996,1781,HEC
20,,DOUB,C2A,C3A,yes,N,20,,74996,1781,HEC
21,,SING,C2A,CAA,no,N,21,,74996,1781,HEC
22,,SING,C3A,C4A,yes,N,22,,74996,1781,HEC
23,,SING,C3A,CMA,no,N,23,,74996,1781,HEC
24,,SING,CMA,HMA1,no,N,24,,74996,1781,HEC
25,,SING,CMA,HMA2,no,N,25,,74996,1781,HEC
26,,SING,CMA,HMA3,no,N,26,,74996,1781,HEC
27,,SING,CAA,CBA,no,N,27,,74996,1781,HEC
28,,SING,CAA,HAA1,no,N,28,,74996,1781,HEC
29,,SING,CAA,HAA2,no,N,29,,74996,1781,HEC
30,,SING,CBA,CGA,no,N,30,,74996,1781,HEC
31,,SING,CBA,HBA1,no,N,31,,74996,1781,HEC
32,,SING,CBA,HBA2,no,N,32,,74996,1781,HEC
33,,DOUB,CGA,O1A,no,N,33,,74996,1781,HEC
34,,SING,CGA,O2A,no,N,34,,74996,1781,HEC
35,,SING,O2A,H2A,no,N,35,,74996,1781,HEC
36,,SING,NB,C1B,yes,N,36,,74996,1781,HEC
37,,SING,NB,C4B,yes,N,37,,74996,1781,HEC
38,,DOUB,C1B,C2B,yes,N,38,,74996,1781,HEC
39,,SING,C2B,C3B,yes,N,39,,74996,1781,HEC
40,,SING,C2B,CMB,no,N,40,,74996,1781,HEC
41,,SING,C3B,C4B,yes,N,41,,74996,1781,HEC
42,,DOUB,C3B,CAB,no,E,42,,74996,1781,HEC
43,,SING,CMB,HMB1,no,N,43,,74996,1781,HEC
44,,SING,CMB,HMB2,no,N,44,,74996,1781,HEC
45,,SING,CMB,HMB3,no,N,45,,74996,1781,HEC
46,,SING,CAB,CBB,no,N,46,,74996,1781,HEC
47,,SING,CAB,HAB,no,N,47,,74996,1781,HEC
48,,SING,CBB,HBB1,no,N,48,,74996,1781,HEC
49,,SING,CBB,HBB2,no,N,49,,74996,1781,HEC
50,,SING,CBB,HBB3,no,N,50,,74996,1781,HEC
51,,SING,NC,C1C,yes,N,51,,74996,1781,HEC
52,,SING,NC,C4C,yes,N,52,,74996,1781,HEC
53,,DOUB,C1C,C2C,yes,N,53,,74996,1781,HEC
54,,SING,C2C,C3C,yes,N,54,,74996,1781,HEC
55,,SING,C2C,CMC,no,N,55,,74996,1781,HEC
56,,SING,C3C,C4C,yes,N,56,,74996,1781,HEC
57,,DOUB,C3C,CAC,no,E,57,,74996,1781,HEC
58,,SING,CMC,HMC1,no,N,58,,74996,1781,HEC
59,,SING,CMC,HMC2,no,N,59,,74996,1781,HEC
60,,SING,CMC,HMC3,no,N,60,,74996,1781,HEC
61,,SING,CAC,CBC,no,N,61,,74996,1781,HEC
62,,SING,CAC,HAC,no,N,62,,74996,1781,HEC
63,,SING,CBC,HBC1,no,N,63,,74996,1781,HEC
64,,SING,CBC,HBC2,no,N,64,,74996,1781,HEC
65,,SING,CBC,HBC3,no,N,65,,74996,1781,HEC
66,,SING,ND,C1D,yes,N,66,,74996,1781,HEC
67,,SING,ND,C4D,yes,N,67,,74996,1781,HEC
68,,DOUB,C1D,C2D,yes,N,68,,74996,1781,HEC
69,,SING,C2D,C3D,yes,N,69,,74996,1781,HEC
70,,SING,C2D,CMD,no,N,70,,74996,1781,HEC
71,,DOUB,C3D,C4D,yes,N,71,,74996,1781,HEC
72,,SING,C3D,CAD,no,N,72,,74996,1781,HEC
73,,SING,CMD,HMD1,no,N,73,,74996,1781,HEC
74,,SING,CMD,HMD2,no,N,74,,74996,1781,HEC
75,,SING,CMD,HMD3,no,N,75,,74996,1781,HEC
76,,SING,CAD,CBD,no,N,76,,74996,1781,HEC
77,,SING,CAD,HAD1,no,N,77,,74996,1781,HEC
78,,SING,CAD,HAD2,no,N,78,,74996,1781,HEC
79,,SING,CBD,CGD,no,N,79,,74996,1781,HEC
80,,SING,CBD,HBD1,no,N,80,,74996,1781,HEC
81,,SING,CBD,HBD2,no,N,81,,74996,1781,HEC
82,,DOUB,CGD,O1D,no,N,82,,74996,1781,HEC
83,,SING,CGD,O2D,no,N,83,,74996,1781,HEC
84,,SING,O2D,H2D,no,N,84,,74996,1781,HEC
1,,SING,N,CA,no,N,1,,75052,17812,M3L
2,,SING,N,H,no,N,2,,75052,17812,M3L
3,,SING,N,H2,no,N,3,,75052,17812,M3L
4,,SING,CA,CB,no,N,4,,75052,17812,M3L
5,,SING,CA,C,no,N,5,,75052,17812,M3L
6,,SING,CA,HA,no,N,6,,75052,17812,M3L
7,,SING,CB,CG,no,N,7,,75052,17812,M3L
8,,SING,CB,HB2,no,N,8,,75052,17812,M3L
9,,SING,CB,HB3,no,N,9,,75052,17812,M3L
10,,SING,CG,CD,no,N,10,,75052,17812,M3L
11,,SING,CG,HG2,no,N,11,,75052,17812,M3L
12,,SING,CG,HG3,no,N,12,,75052,17812,M3L
13,,SING,CD,CE,no,N,13,,75052,17812,M3L
14,,SING,CD,HD2,no,N,14,,75052,17812,M3L
15,,SING,CD,HD3,no,N,15,,75052,17812,M3L
16,,SING,CE,NZ,no,N,16,,75052,17812,M3L
17,,SING,CE,HE2,no,N,17,,75052,17812,M3L
18,,SING,CE,HE3,no,N,18,,75052,17812,M3L
19,,SING,NZ,CM1,no,N,19,,75052,17812,M3L
20,,SING,NZ,CM2,no,N,20,,75052,17812,M3L
21,,SING,NZ,CM3,no,N,21,,75052,17812,M3L
22,,DOUB,C,O,no,N,22,,75052,17812,M3L
23,,SING,C,OXT,no,N,23,,75052,17812,M3L
24,,SING,OXT,HXT,no,N,24,,75052,17812,M3L
25,,SING,CM1,HM11,no,N,25,,75052,17812,M3L
26,,SING,CM1,HM12,no,N,26,,75052,17812,M3L
27,,SING,CM1,HM13,no,N,27,,75052,17812,M3L
28,,SING,CM2,HM21,no,N,28,,75052,17812,M3L
29,,SING,CM2,HM22,no,N,29,,75052,17812,M3L
30,,SING,CM2,HM23,no,N,30,,75052,17812,M3L
31,,SING,CM3,HM31,no,N,31,,75052,17812,M3L
32,,SING,CM3,HM32,no,N,32,,75052,17812,M3L
33,,SING,CM3,HM33,no,N,33,,75052,17812,M3L
1,,SING,C1,C2,no,N,1,,75143,17817,RET
2,,SING,C1,C6,no,N,2,,75143,17817,RET
3,,SING,C1,C16,no,N,3,,75143,17817,RET
4,,SING,C1,C17,no,N,4,,75143,17817,RET
5,,SING,C2,C3,no,N,5,,75143,17817,RET
6,,SING,C2,H21,no,N,6,,75143,17817,RET
7,,SING,C2,H22,no,N,7,,75143,17817,RET
8,,SING,C3,C4,no,N,8,,75143,17817,RET
9,,SING,C3,H31,no,N,9,,75143,17817,RET
10,,SING,C3,H32,no,N,10,,75143,17817,RET
11,,SING,C4,C5,no,N,11,,75143,17817,RET
12,,SING,C4,H41,no,N,12,,75143,17817,RET
13,,SING,C4,H42,no,N,13,,75143,17817,RET
14,,DOUB,C5,C6,no,N,14,,75143,17817,RET
15,,SING,C5,C18,no,N,15,,75143,17817,RET
16,,SING,C6,C7,no,N,16,,75143,17817,RET
17,,DOUB,C7,C8,no,E,17,,75143,17817,RET
18,,SING,C7,H7,no,N,18,,75143,17817,RET
19,,SING,C8,C9,no,N,19,,75143,17817,RET
20,,SING,C8,H8,no,N,20,,75143,17817,RET
21,,DOUB,C9,C10,no,E,21,,75143,17817,RET
22,,SING,C9,C19,no,N,22,,75143,17817,RET
23,,SING,C10,C11,no,N,23,,75143,17817,RET
24,,SING,C10,H10,no,N,24,,75143,17817,RET
25,,DOUB,C11,C12,no,E,25,,75143,17817,RET
26,,SING,C11,H11,no,N,26,,75143,17817,RET
27,,SING,C12,C13,no,N,27,,75143,17817,RET
28,,SING,C12,H12,no,N,28,,75143,17817,RET
29,,DOUB,C13,C14,no,E,29,,75143,17817,RET
30,,SING,C13,C20,no,N,30,,75143,17817,RET
31,,SING,C14,C15,no,N,31,,75143,17817,RET
32,,SING,C14,H14,no,N,32,,75143,17817,RET
33,,DOUB,C15,O1,no,N,33,,75143,17817,RET
34,,SING,C15,H15,no,N,34,,75143,17817,RET
35,,SING,C16,H161,no,N,35,,75143,17817,RET
36,,SING,C16,H162,no,N,36,,75143,17817,RET
37,,SING,C16,H163,no,N,37,,75143,17817,RET
38,,SING,C17,H171,no,N,38,,75143,17817,RET
39,,SING,C17,H172,no,N,39,,75143,17817,RET
40,,SING,C17,H173,no,N,40,,75143,17817,RET
41,,SING,C18,H181,no,N,41,,75143,17817,RET
42,,SING,C18,H182,no,N,42,,75143,17817,RET
43,,SING,C18,H183,no,N,43,,75143,17817,RET
44,,SING,C19,H191,no,N,44,,75143,17817,RET
45,,SING,C19,H192,no,N,45,,75143,17817,RET
46,,SING,C19,H193,no,N,46,,75143,17817,RET
47,,SING,C20,H201,no,N,47,,75143,17817,RET
48,,SING,C20,H202,no,N,48,,75143,17817,RET
49,,SING,C20,H203,no,N,49,,75143,17817,RET
1,,SING,C1,C2,no,N,1,,75389,1783,AAC
2,,SING,C1,O1,no,N,2,,75389,1783,AAC
3,,DOUB,C1,O2,no,N,3,,75389,1783,AAC
4,,SING,C2,N1,no,N,4,,75389,1783,AAC
5,,SING,C2,HC21,no,N,5,,75389,1783,AAC
6,,SING,C2,HC22,no,N,6,,75389,1783,AAC
7,,SING,C3,C4,no,N,7,,75389,1783,AAC
8,,SING,C3,N1,no,N,8,,75389,1783,AAC
9,,DOUB,C3,O3,no,N,9,,75389,1783,AAC
10,,SING,C4,HC41,no,N,10,,75389,1783,AAC
11,,SING,C4,HC42,no,N,11,,75389,1783,AAC
12,,SING,C4,HC43,no,N,12,,75389,1783,AAC
13,,SING,N1,HN1,no,N,13,,75389,1783,AAC
14,,SING,O1,HO1,no,N,14,,75389,1783,AAC
1,,SING,FE,NA,no,N,1,,75390,1783,HEC
2,,SING,FE,NB,no,N,2,,75390,1783,HEC
3,,SING,FE,NC,no,N,3,,75390,1783,HEC
4,,SING,FE,ND,no,N,4,,75390,1783,HEC
5,,DOUB,CHA,C1A,no,N,5,,75390,1783,HEC
6,,SING,CHA,C4D,no,N,6,,75390,1783,HEC
7,,SING,CHA,HHA,no,N,7,,75390,1783,HEC
8,,DOUB,CHB,C4A,no,N,8,,75390,1783,HEC
9,,SING,CHB,C1B,no,N,9,,75390,1783,HEC
10,,SING,CHB,HHB,no,N,10,,75390,1783,HEC
11,,DOUB,CHC,C4B,no,N,11,,75390,1783,HEC
12,,SING,CHC,C1C,no,N,12,,75390,1783,HEC
13,,SING,CHC,HHC,no,N,13,,75390,1783,HEC
14,,DOUB,CHD,C4C,no,N,14,,75390,1783,HEC
15,,SING,CHD,C1D,no,N,15,,75390,1783,HEC
16,,SING,CHD,HHD,no,N,16,,75390,1783,HEC
17,,SING,NA,C1A,yes,N,17,,75390,1783,HEC
18,,SING,NA,C4A,yes,N,18,,75390,1783,HEC
19,,SING,C1A,C2A,yes,N,19,,75390,1783,HEC
20,,DOUB,C2A,C3A,yes,N,20,,75390,1783,HEC
21,,SING,C2A,CAA,no,N,21,,75390,1783,HEC
22,,SING,C3A,C4A,yes,N,22,,75390,1783,HEC
23,,SING,C3A,CMA,no,N,23,,75390,1783,HEC
24,,SING,CMA,HMA1,no,N,24,,75390,1783,HEC
25,,SING,CMA,HMA2,no,N,25,,75390,1783,HEC
26,,SING,CMA,HMA3,no,N,26,,75390,1783,HEC
27,,SING,CAA,CBA,no,N,27,,75390,1783,HEC
28,,SING,CAA,HAA1,no,N,28,,75390,1783,HEC
29,,SING,CAA,HAA2,no,N,29,,75390,1783,HEC
30,,SING,CBA,CGA,no,N,30,,75390,1783,HEC
31,,SING,CBA,HBA1,no,N,31,,75390,1783,HEC
32,,SING,CBA,HBA2,no,N,32,,75390,1783,HEC
33,,DOUB,CGA,O1A,no,N,33,,75390,1783,HEC
34,,SING,CGA,O2A,no,N,34,,75390,1783,HEC
35,,SING,O2A,H2A,no,N,35,,75390,1783,HEC
36,,SING,NB,C1B,yes,N,36,,75390,1783,HEC
37,,SING,NB,C4B,yes,N,37,,75390,1783,HEC
38,,DOUB,C1B,C2B,yes,N,38,,75390,1783,HEC
39,,SING,C2B,C3B,yes,N,39,,75390,1783,HEC
40,,SING,C2B,CMB,no,N,40,,75390,1783,HEC
41,,SING,C3B,C4B,yes,N,41,,75390,1783,HEC
42,,DOUB,C3B,CAB,no,E,42,,75390,1783,HEC
43,,SING,CMB,HMB1,no,N,43,,75390,1783,HEC
44,,SING,CMB,HMB2,no,N,44,,75390,1783,HEC
45,,SING,CMB,HMB3,no,N,45,,75390,1783,HEC
46,,SING,CAB,CBB,no,N,46,,75390,1783,HEC
47,,SING,CAB,HAB,no,N,47,,75390,1783,HEC
48,,SING,CBB,HBB1,no,N,48,,75390,1783,HEC
49,,SING,CBB,HBB2,no,N,49,,75390,1783,HEC
50,,SING,CBB,HBB3,no,N,50,,75390,1783,HEC
51,,SING,NC,C1C,yes,N,51,,75390,1783,HEC
52,,SING,NC,C4C,yes,N,52,,75390,1783,HEC
53,,DOUB,C1C,C2C,yes,N,53,,75390,1783,HEC
18,,SING,C4,C5,,,,,117537,20121,T23
54,,SING,C2C,C3C,yes,N,54,,75390,1783,HEC
55,,SING,C2C,CMC,no,N,55,,75390,1783,HEC
56,,SING,C3C,C4C,yes,N,56,,75390,1783,HEC
57,,DOUB,C3C,CAC,no,E,57,,75390,1783,HEC
58,,SING,CMC,HMC1,no,N,58,,75390,1783,HEC
59,,SING,CMC,HMC2,no,N,59,,75390,1783,HEC
60,,SING,CMC,HMC3,no,N,60,,75390,1783,HEC
61,,SING,CAC,CBC,no,N,61,,75390,1783,HEC
62,,SING,CAC,HAC,no,N,62,,75390,1783,HEC
63,,SING,CBC,HBC1,no,N,63,,75390,1783,HEC
64,,SING,CBC,HBC2,no,N,64,,75390,1783,HEC
65,,SING,CBC,HBC3,no,N,65,,75390,1783,HEC
66,,SING,ND,C1D,yes,N,66,,75390,1783,HEC
67,,SING,ND,C4D,yes,N,67,,75390,1783,HEC
68,,DOUB,C1D,C2D,yes,N,68,,75390,1783,HEC
69,,SING,C2D,C3D,yes,N,69,,75390,1783,HEC
70,,SING,C2D,CMD,no,N,70,,75390,1783,HEC
71,,DOUB,C3D,C4D,yes,N,71,,75390,1783,HEC
72,,SING,C3D,CAD,no,N,72,,75390,1783,HEC
73,,SING,CMD,HMD1,no,N,73,,75390,1783,HEC
74,,SING,CMD,HMD2,no,N,74,,75390,1783,HEC
75,,SING,CMD,HMD3,no,N,75,,75390,1783,HEC
76,,SING,CAD,CBD,no,N,76,,75390,1783,HEC
77,,SING,CAD,HAD1,no,N,77,,75390,1783,HEC
78,,SING,CAD,HAD2,no,N,78,,75390,1783,HEC
79,,SING,CBD,CGD,no,N,79,,75390,1783,HEC
80,,SING,CBD,HBD1,no,N,80,,75390,1783,HEC
81,,SING,CBD,HBD2,no,N,81,,75390,1783,HEC
82,,DOUB,CGD,O1D,no,N,82,,75390,1783,HEC
83,,SING,CGD,O2D,no,N,83,,75390,1783,HEC
84,,SING,O2D,H2D,no,N,84,,75390,1783,HEC
1,,SING,C32,C33,no,N,1,,75469,17834,VB1
2,,SING,C33,CAV,no,N,2,,75469,17834,VB1
3,,SING,CAV,C31,no,N,3,,75469,17834,VB1
4,,SING,CAV,N29,no,N,4,,75469,17834,VB1
5,,SING,C31,O43,no,N,5,,75469,17834,VB1
6,,DOUB,C31,O42,no,N,6,,75469,17834,VB1
7,,SING,N29,C13,no,N,7,,75469,17834,VB1
8,,DOUB,C13,O18,no,N,8,,75469,17834,VB1
9,,SING,C13,C12,no,N,9,,75469,17834,VB1
10,,SING,C12,C16,no,N,10,,75469,17834,VB1
11,,SING,C12,N11,no,N,11,,75469,17834,VB1
12,,SING,C16,S17,no,N,12,,75469,17834,VB1
13,,SING,N11,C10,no,N,13,,75469,17834,VB1
14,,DOUB,C10,O15,no,N,14,,75469,17834,VB1
15,,SING,C10,C7,no,N,15,,75469,17834,VB1
16,,SING,C7,C4,no,N,16,,75469,17834,VB1
17,,SING,C4,C3,no,N,17,,75469,17834,VB1
18,,SING,C3,C2,no,N,18,,75469,17834,VB1
19,,SING,C2,C1,no,N,19,,75469,17834,VB1
20,,SING,C2,N14,no,N,20,,75469,17834,VB1
21,,DOUB,C1,O20,no,N,21,,75469,17834,VB1
22,,SING,C1,O19,no,N,22,,75469,17834,VB1
23,,SING,C32,H321,no,N,23,,75469,17834,VB1
24,,SING,C32,H322,no,N,24,,75469,17834,VB1
25,,SING,C32,H323,no,N,25,,75469,17834,VB1
26,,SING,C33,H331,no,N,26,,75469,17834,VB1
27,,SING,C33,H332,no,N,27,,75469,17834,VB1
28,,SING,CAV,HAV,no,N,28,,75469,17834,VB1
29,,SING,N29,H29,no,N,29,,75469,17834,VB1
30,,SING,O43,H43,no,N,30,,75469,17834,VB1
31,,SING,C12,H12,no,N,31,,75469,17834,VB1
32,,SING,C16,H161,no,N,32,,75469,17834,VB1
33,,SING,C16,H162,no,N,33,,75469,17834,VB1
34,,SING,N11,H11,no,N,34,,75469,17834,VB1
35,,SING,S17,H17,no,N,35,,75469,17834,VB1
36,,SING,C7,H7C1,no,N,36,,75469,17834,VB1
37,,SING,C7,H7C2,no,N,37,,75469,17834,VB1
38,,SING,C4,H4C1,no,N,38,,75469,17834,VB1
39,,SING,C4,H4C2,no,N,39,,75469,17834,VB1
40,,SING,C3,H3C1,no,N,40,,75469,17834,VB1
41,,SING,C3,H3C2,no,N,41,,75469,17834,VB1
42,,SING,C2,H2,no,N,42,,75469,17834,VB1
43,,SING,N14,H141,no,N,43,,75469,17834,VB1
44,,SING,N14,H142,no,N,44,,75469,17834,VB1
45,,SING,O19,H19,no,N,45,,75469,17834,VB1
1,,SING,C1,C2,no,N,1,,75543,17838,IHP
2,,SING,C1,C6,no,N,2,,75543,17838,IHP
3,,SING,C1,O11,no,N,3,,75543,17838,IHP
4,,SING,C1,H1,no,N,4,,75543,17838,IHP
5,,SING,C2,C3,no,N,5,,75543,17838,IHP
6,,SING,C2,O12,no,N,6,,75543,17838,IHP
7,,SING,C2,H2,no,N,7,,75543,17838,IHP
8,,SING,C3,C4,no,N,8,,75543,17838,IHP
9,,SING,C3,O13,no,N,9,,75543,17838,IHP
10,,SING,C3,H3,no,N,10,,75543,17838,IHP
11,,SING,C4,C5,no,N,11,,75543,17838,IHP
12,,SING,C4,O14,no,N,12,,75543,17838,IHP
13,,SING,C4,H4,no,N,13,,75543,17838,IHP
14,,SING,C5,C6,no,N,14,,75543,17838,IHP
15,,SING,C5,O15,no,N,15,,75543,17838,IHP
16,,SING,C5,H5,no,N,16,,75543,17838,IHP
17,,SING,C6,O16,no,N,17,,75543,17838,IHP
18,,SING,C6,H6,no,N,18,,75543,17838,IHP
19,,SING,O11,P1,no,N,19,,75543,17838,IHP
20,,DOUB,P1,O21,no,N,20,,75543,17838,IHP
21,,SING,P1,O31,no,N,21,,75543,17838,IHP
22,,SING,P1,O41,no,N,22,,75543,17838,IHP
23,,SING,O31,H31,no,N,23,,75543,17838,IHP
24,,SING,O41,H41,no,N,24,,75543,17838,IHP
25,,SING,O12,P2,no,N,25,,75543,17838,IHP
26,,DOUB,P2,O22,no,N,26,,75543,17838,IHP
27,,SING,P2,O32,no,N,27,,75543,17838,IHP
28,,SING,P2,O42,no,N,28,,75543,17838,IHP
29,,SING,O32,H32,no,N,29,,75543,17838,IHP
30,,SING,O42,H42,no,N,30,,75543,17838,IHP
31,,SING,O13,P3,no,N,31,,75543,17838,IHP
32,,DOUB,P3,O23,no,N,32,,75543,17838,IHP
33,,SING,P3,O33,no,N,33,,75543,17838,IHP
34,,SING,P3,O43,no,N,34,,75543,17838,IHP
35,,SING,O33,H33,no,N,35,,75543,17838,IHP
36,,SING,O43,H43,no,N,36,,75543,17838,IHP
37,,SING,O14,P4,no,N,37,,75543,17838,IHP
38,,DOUB,P4,O24,no,N,38,,75543,17838,IHP
39,,SING,P4,O34,no,N,39,,75543,17838,IHP
40,,SING,P4,O44,no,N,40,,75543,17838,IHP
41,,SING,O34,H34,no,N,41,,75543,17838,IHP
42,,SING,O44,H44,no,N,42,,75543,17838,IHP
43,,SING,O15,P5,no,N,43,,75543,17838,IHP
44,,DOUB,P5,O25,no,N,44,,75543,17838,IHP
45,,SING,P5,O35,no,N,45,,75543,17838,IHP
46,,SING,P5,O45,no,N,46,,75543,17838,IHP
47,,SING,O35,H35,no,N,47,,75543,17838,IHP
48,,SING,O45,H45,no,N,48,,75543,17838,IHP
49,,SING,O16,P6,no,N,49,,75543,17838,IHP
50,,DOUB,P6,O26,no,N,50,,75543,17838,IHP
51,,SING,P6,O36,no,N,51,,75543,17838,IHP
52,,SING,P6,O46,no,N,52,,75543,17838,IHP
53,,SING,O36,H36,no,N,53,,75543,17838,IHP
54,,SING,O46,H46,no,N,54,,75543,17838,IHP
1,,SING,FE,NA,no,N,1,,75674,17845,HEC
2,,SING,FE,NB,no,N,2,,75674,17845,HEC
3,,SING,FE,NC,no,N,3,,75674,17845,HEC
4,,SING,FE,ND,no,N,4,,75674,17845,HEC
5,,DOUB,CHA,C1A,no,N,5,,75674,17845,HEC
6,,SING,CHA,C4D,no,N,6,,75674,17845,HEC
7,,SING,CHA,HHA,no,N,7,,75674,17845,HEC
8,,DOUB,CHB,C4A,no,N,8,,75674,17845,HEC
9,,SING,CHB,C1B,no,N,9,,75674,17845,HEC
10,,SING,CHB,HHB,no,N,10,,75674,17845,HEC
11,,DOUB,CHC,C4B,no,N,11,,75674,17845,HEC
12,,SING,CHC,C1C,no,N,12,,75674,17845,HEC
13,,SING,CHC,HHC,no,N,13,,75674,17845,HEC
14,,DOUB,CHD,C4C,no,N,14,,75674,17845,HEC
15,,SING,CHD,C1D,no,N,15,,75674,17845,HEC
16,,SING,CHD,HHD,no,N,16,,75674,17845,HEC
17,,SING,NA,C1A,yes,N,17,,75674,17845,HEC
18,,SING,NA,C4A,yes,N,18,,75674,17845,HEC
19,,SING,C1A,C2A,yes,N,19,,75674,17845,HEC
20,,DOUB,C2A,C3A,yes,N,20,,75674,17845,HEC
21,,SING,C2A,CAA,no,N,21,,75674,17845,HEC
22,,SING,C3A,C4A,yes,N,22,,75674,17845,HEC
23,,SING,C3A,CMA,no,N,23,,75674,17845,HEC
24,,SING,CMA,HMA1,no,N,24,,75674,17845,HEC
25,,SING,CMA,HMA2,no,N,25,,75674,17845,HEC
26,,SING,CMA,HMA3,no,N,26,,75674,17845,HEC
27,,SING,CAA,CBA,no,N,27,,75674,17845,HEC
28,,SING,CAA,HAA1,no,N,28,,75674,17845,HEC
29,,SING,CAA,HAA2,no,N,29,,75674,17845,HEC
30,,SING,CBA,CGA,no,N,30,,75674,17845,HEC
31,,SING,CBA,HBA1,no,N,31,,75674,17845,HEC
32,,SING,CBA,HBA2,no,N,32,,75674,17845,HEC
33,,DOUB,CGA,O1A,no,N,33,,75674,17845,HEC
34,,SING,CGA,O2A,no,N,34,,75674,17845,HEC
35,,SING,O2A,H2A,no,N,35,,75674,17845,HEC
36,,SING,NB,C1B,yes,N,36,,75674,17845,HEC
37,,SING,NB,C4B,yes,N,37,,75674,17845,HEC
38,,DOUB,C1B,C2B,yes,N,38,,75674,17845,HEC
39,,SING,C2B,C3B,yes,N,39,,75674,17845,HEC
40,,SING,C2B,CMB,no,N,40,,75674,17845,HEC
41,,SING,C3B,C4B,yes,N,41,,75674,17845,HEC
42,,DOUB,C3B,CAB,no,E,42,,75674,17845,HEC
43,,SING,CMB,HMB1,no,N,43,,75674,17845,HEC
44,,SING,CMB,HMB2,no,N,44,,75674,17845,HEC
45,,SING,CMB,HMB3,no,N,45,,75674,17845,HEC
46,,SING,CAB,CBB,no,N,46,,75674,17845,HEC
47,,SING,CAB,HAB,no,N,47,,75674,17845,HEC
48,,SING,CBB,HBB1,no,N,48,,75674,17845,HEC
49,,SING,CBB,HBB2,no,N,49,,75674,17845,HEC
50,,SING,CBB,HBB3,no,N,50,,75674,17845,HEC
51,,SING,NC,C1C,yes,N,51,,75674,17845,HEC
52,,SING,NC,C4C,yes,N,52,,75674,17845,HEC
53,,DOUB,C1C,C2C,yes,N,53,,75674,17845,HEC
54,,SING,C2C,C3C,yes,N,54,,75674,17845,HEC
55,,SING,C2C,CMC,no,N,55,,75674,17845,HEC
56,,SING,C3C,C4C,yes,N,56,,75674,17845,HEC
57,,DOUB,C3C,CAC,no,E,57,,75674,17845,HEC
58,,SING,CMC,HMC1,no,N,58,,75674,17845,HEC
59,,SING,CMC,HMC2,no,N,59,,75674,17845,HEC
60,,SING,CMC,HMC3,no,N,60,,75674,17845,HEC
61,,SING,CAC,CBC,no,N,61,,75674,17845,HEC
62,,SING,CAC,HAC,no,N,62,,75674,17845,HEC
63,,SING,CBC,HBC1,no,N,63,,75674,17845,HEC
64,,SING,CBC,HBC2,no,N,64,,75674,17845,HEC
65,,SING,CBC,HBC3,no,N,65,,75674,17845,HEC
66,,SING,ND,C1D,yes,N,66,,75674,17845,HEC
67,,SING,ND,C4D,yes,N,67,,75674,17845,HEC
68,,DOUB,C1D,C2D,yes,N,68,,75674,17845,HEC
69,,SING,C2D,C3D,yes,N,69,,75674,17845,HEC
70,,SING,C2D,CMD,no,N,70,,75674,17845,HEC
71,,DOUB,C3D,C4D,yes,N,71,,75674,17845,HEC
72,,SING,C3D,CAD,no,N,72,,75674,17845,HEC
73,,SING,CMD,HMD1,no,N,73,,75674,17845,HEC
74,,SING,CMD,HMD2,no,N,74,,75674,17845,HEC
75,,SING,CMD,HMD3,no,N,75,,75674,17845,HEC
76,,SING,CAD,CBD,no,N,76,,75674,17845,HEC
77,,SING,CAD,HAD1,no,N,77,,75674,17845,HEC
78,,SING,CAD,HAD2,no,N,78,,75674,17845,HEC
79,,SING,CBD,CGD,no,N,79,,75674,17845,HEC
80,,SING,CBD,HBD1,no,N,80,,75674,17845,HEC
81,,SING,CBD,HBD2,no,N,81,,75674,17845,HEC
82,,DOUB,CGD,O1D,no,N,82,,75674,17845,HEC
83,,SING,CGD,O2D,no,N,83,,75674,17845,HEC
84,,SING,O2D,H2D,no,N,84,,75674,17845,HEC
1,,SING,FE,NA,no,N,1,,75695,17846,HEC
2,,SING,FE,NB,no,N,2,,75695,17846,HEC
3,,SING,FE,NC,no,N,3,,75695,17846,HEC
4,,SING,FE,ND,no,N,4,,75695,17846,HEC
5,,DOUB,CHA,C1A,no,N,5,,75695,17846,HEC
6,,SING,CHA,C4D,no,N,6,,75695,17846,HEC
7,,SING,CHA,HHA,no,N,7,,75695,17846,HEC
8,,DOUB,CHB,C4A,no,N,8,,75695,17846,HEC
9,,SING,CHB,C1B,no,N,9,,75695,17846,HEC
10,,SING,CHB,HHB,no,N,10,,75695,17846,HEC
11,,DOUB,CHC,C4B,no,N,11,,75695,17846,HEC
12,,SING,CHC,C1C,no,N,12,,75695,17846,HEC
13,,SING,CHC,HHC,no,N,13,,75695,17846,HEC
14,,DOUB,CHD,C4C,no,N,14,,75695,17846,HEC
15,,SING,CHD,C1D,no,N,15,,75695,17846,HEC
16,,SING,CHD,HHD,no,N,16,,75695,17846,HEC
17,,SING,NA,C1A,yes,N,17,,75695,17846,HEC
18,,SING,NA,C4A,yes,N,18,,75695,17846,HEC
19,,SING,C1A,C2A,yes,N,19,,75695,17846,HEC
20,,DOUB,C2A,C3A,yes,N,20,,75695,17846,HEC
21,,SING,C2A,CAA,no,N,21,,75695,17846,HEC
22,,SING,C3A,C4A,yes,N,22,,75695,17846,HEC
23,,SING,C3A,CMA,no,N,23,,75695,17846,HEC
24,,SING,CMA,HMA1,no,N,24,,75695,17846,HEC
25,,SING,CMA,HMA2,no,N,25,,75695,17846,HEC
26,,SING,CMA,HMA3,no,N,26,,75695,17846,HEC
27,,SING,CAA,CBA,no,N,27,,75695,17846,HEC
28,,SING,CAA,HAA1,no,N,28,,75695,17846,HEC
29,,SING,CAA,HAA2,no,N,29,,75695,17846,HEC
30,,SING,CBA,CGA,no,N,30,,75695,17846,HEC
31,,SING,CBA,HBA1,no,N,31,,75695,17846,HEC
32,,SING,CBA,HBA2,no,N,32,,75695,17846,HEC
33,,DOUB,CGA,O1A,no,N,33,,75695,17846,HEC
34,,SING,CGA,O2A,no,N,34,,75695,17846,HEC
35,,SING,O2A,H2A,no,N,35,,75695,17846,HEC
36,,SING,NB,C1B,yes,N,36,,75695,17846,HEC
37,,SING,NB,C4B,yes,N,37,,75695,17846,HEC
38,,DOUB,C1B,C2B,yes,N,38,,75695,17846,HEC
39,,SING,C2B,C3B,yes,N,39,,75695,17846,HEC
40,,SING,C2B,CMB,no,N,40,,75695,17846,HEC
41,,SING,C3B,C4B,yes,N,41,,75695,17846,HEC
42,,DOUB,C3B,CAB,no,E,42,,75695,17846,HEC
43,,SING,CMB,HMB1,no,N,43,,75695,17846,HEC
44,,SING,CMB,HMB2,no,N,44,,75695,17846,HEC
45,,SING,CMB,HMB3,no,N,45,,75695,17846,HEC
46,,SING,CAB,CBB,no,N,46,,75695,17846,HEC
47,,SING,CAB,HAB,no,N,47,,75695,17846,HEC
48,,SING,CBB,HBB1,no,N,48,,75695,17846,HEC
49,,SING,CBB,HBB2,no,N,49,,75695,17846,HEC
50,,SING,CBB,HBB3,no,N,50,,75695,17846,HEC
51,,SING,NC,C1C,yes,N,51,,75695,17846,HEC
52,,SING,NC,C4C,yes,N,52,,75695,17846,HEC
53,,DOUB,C1C,C2C,yes,N,53,,75695,17846,HEC
54,,SING,C2C,C3C,yes,N,54,,75695,17846,HEC
55,,SING,C2C,CMC,no,N,55,,75695,17846,HEC
56,,SING,C3C,C4C,yes,N,56,,75695,17846,HEC
57,,DOUB,C3C,CAC,no,E,57,,75695,17846,HEC
58,,SING,CMC,HMC1,no,N,58,,75695,17846,HEC
59,,SING,CMC,HMC2,no,N,59,,75695,17846,HEC
60,,SING,CMC,HMC3,no,N,60,,75695,17846,HEC
61,,SING,CAC,CBC,no,N,61,,75695,17846,HEC
62,,SING,CAC,HAC,no,N,62,,75695,17846,HEC
63,,SING,CBC,HBC1,no,N,63,,75695,17846,HEC
64,,SING,CBC,HBC2,no,N,64,,75695,17846,HEC
65,,SING,CBC,HBC3,no,N,65,,75695,17846,HEC
66,,SING,ND,C1D,yes,N,66,,75695,17846,HEC
67,,SING,ND,C4D,yes,N,67,,75695,17846,HEC
68,,DOUB,C1D,C2D,yes,N,68,,75695,17846,HEC
69,,SING,C2D,C3D,yes,N,69,,75695,17846,HEC
70,,SING,C2D,CMD,no,N,70,,75695,17846,HEC
71,,DOUB,C3D,C4D,yes,N,71,,75695,17846,HEC
72,,SING,C3D,CAD,no,N,72,,75695,17846,HEC
73,,SING,CMD,HMD1,no,N,73,,75695,17846,HEC
74,,SING,CMD,HMD2,no,N,74,,75695,17846,HEC
75,,SING,CMD,HMD3,no,N,75,,75695,17846,HEC
76,,SING,CAD,CBD,no,N,76,,75695,17846,HEC
77,,SING,CAD,HAD1,no,N,77,,75695,17846,HEC
78,,SING,CAD,HAD2,no,N,78,,75695,17846,HEC
79,,SING,CBD,CGD,no,N,79,,75695,17846,HEC
80,,SING,CBD,HBD1,no,N,80,,75695,17846,HEC
81,,SING,CBD,HBD2,no,N,81,,75695,17846,HEC
82,,DOUB,CGD,O1D,no,N,82,,75695,17846,HEC
83,,SING,CGD,O2D,no,N,83,,75695,17846,HEC
84,,SING,O2D,H2D,no,N,84,,75695,17846,HEC
1,,SING,FE,NA,no,N,1,,75716,17847,HEC
2,,SING,FE,NB,no,N,2,,75716,17847,HEC
3,,SING,FE,NC,no,N,3,,75716,17847,HEC
4,,SING,FE,ND,no,N,4,,75716,17847,HEC
5,,DOUB,CHA,C1A,no,N,5,,75716,17847,HEC
6,,SING,CHA,C4D,no,N,6,,75716,17847,HEC
7,,SING,CHA,HHA,no,N,7,,75716,17847,HEC
8,,DOUB,CHB,C4A,no,N,8,,75716,17847,HEC
9,,SING,CHB,C1B,no,N,9,,75716,17847,HEC
10,,SING,CHB,HHB,no,N,10,,75716,17847,HEC
11,,DOUB,CHC,C4B,no,N,11,,75716,17847,HEC
12,,SING,CHC,C1C,no,N,12,,75716,17847,HEC
13,,SING,CHC,HHC,no,N,13,,75716,17847,HEC
14,,DOUB,CHD,C4C,no,N,14,,75716,17847,HEC
15,,SING,CHD,C1D,no,N,15,,75716,17847,HEC
16,,SING,CHD,HHD,no,N,16,,75716,17847,HEC
17,,SING,NA,C1A,yes,N,17,,75716,17847,HEC
18,,SING,NA,C4A,yes,N,18,,75716,17847,HEC
19,,SING,C1A,C2A,yes,N,19,,75716,17847,HEC
20,,DOUB,C2A,C3A,yes,N,20,,75716,17847,HEC
21,,SING,C2A,CAA,no,N,21,,75716,17847,HEC
22,,SING,C3A,C4A,yes,N,22,,75716,17847,HEC
23,,SING,C3A,CMA,no,N,23,,75716,17847,HEC
24,,SING,CMA,HMA1,no,N,24,,75716,17847,HEC
25,,SING,CMA,HMA2,no,N,25,,75716,17847,HEC
26,,SING,CMA,HMA3,no,N,26,,75716,17847,HEC
27,,SING,CAA,CBA,no,N,27,,75716,17847,HEC
28,,SING,CAA,HAA1,no,N,28,,75716,17847,HEC
29,,SING,CAA,HAA2,no,N,29,,75716,17847,HEC
30,,SING,CBA,CGA,no,N,30,,75716,17847,HEC
31,,SING,CBA,HBA1,no,N,31,,75716,17847,HEC
32,,SING,CBA,HBA2,no,N,32,,75716,17847,HEC
33,,DOUB,CGA,O1A,no,N,33,,75716,17847,HEC
34,,SING,CGA,O2A,no,N,34,,75716,17847,HEC
35,,SING,O2A,H2A,no,N,35,,75716,17847,HEC
36,,SING,NB,C1B,yes,N,36,,75716,17847,HEC
37,,SING,NB,C4B,yes,N,37,,75716,17847,HEC
38,,DOUB,C1B,C2B,yes,N,38,,75716,17847,HEC
39,,SING,C2B,C3B,yes,N,39,,75716,17847,HEC
40,,SING,C2B,CMB,no,N,40,,75716,17847,HEC
41,,SING,C3B,C4B,yes,N,41,,75716,17847,HEC
42,,DOUB,C3B,CAB,no,E,42,,75716,17847,HEC
43,,SING,CMB,HMB1,no,N,43,,75716,17847,HEC
44,,SING,CMB,HMB2,no,N,44,,75716,17847,HEC
45,,SING,CMB,HMB3,no,N,45,,75716,17847,HEC
46,,SING,CAB,CBB,no,N,46,,75716,17847,HEC
47,,SING,CAB,HAB,no,N,47,,75716,17847,HEC
48,,SING,CBB,HBB1,no,N,48,,75716,17847,HEC
49,,SING,CBB,HBB2,no,N,49,,75716,17847,HEC
50,,SING,CBB,HBB3,no,N,50,,75716,17847,HEC
51,,SING,NC,C1C,yes,N,51,,75716,17847,HEC
52,,SING,NC,C4C,yes,N,52,,75716,17847,HEC
53,,DOUB,C1C,C2C,yes,N,53,,75716,17847,HEC
54,,SING,C2C,C3C,yes,N,54,,75716,17847,HEC
55,,SING,C2C,CMC,no,N,55,,75716,17847,HEC
56,,SING,C3C,C4C,yes,N,56,,75716,17847,HEC
57,,DOUB,C3C,CAC,no,E,57,,75716,17847,HEC
58,,SING,CMC,HMC1,no,N,58,,75716,17847,HEC
59,,SING,CMC,HMC2,no,N,59,,75716,17847,HEC
60,,SING,CMC,HMC3,no,N,60,,75716,17847,HEC
61,,SING,CAC,CBC,no,N,61,,75716,17847,HEC
62,,SING,CAC,HAC,no,N,62,,75716,17847,HEC
63,,SING,CBC,HBC1,no,N,63,,75716,17847,HEC
64,,SING,CBC,HBC2,no,N,64,,75716,17847,HEC
65,,SING,CBC,HBC3,no,N,65,,75716,17847,HEC
66,,SING,ND,C1D,yes,N,66,,75716,17847,HEC
67,,SING,ND,C4D,yes,N,67,,75716,17847,HEC
68,,DOUB,C1D,C2D,yes,N,68,,75716,17847,HEC
69,,SING,C2D,C3D,yes,N,69,,75716,17847,HEC
70,,SING,C2D,CMD,no,N,70,,75716,17847,HEC
71,,DOUB,C3D,C4D,yes,N,71,,75716,17847,HEC
72,,SING,C3D,CAD,no,N,72,,75716,17847,HEC
73,,SING,CMD,HMD1,no,N,73,,75716,17847,HEC
74,,SING,CMD,HMD2,no,N,74,,75716,17847,HEC
75,,SING,CMD,HMD3,no,N,75,,75716,17847,HEC
76,,SING,CAD,CBD,no,N,76,,75716,17847,HEC
77,,SING,CAD,HAD1,no,N,77,,75716,17847,HEC
78,,SING,CAD,HAD2,no,N,78,,75716,17847,HEC
79,,SING,CBD,CGD,no,N,79,,75716,17847,HEC
80,,SING,CBD,HBD1,no,N,80,,75716,17847,HEC
81,,SING,CBD,HBD2,no,N,81,,75716,17847,HEC
82,,DOUB,CGD,O1D,no,N,82,,75716,17847,HEC
83,,SING,CGD,O2D,no,N,83,,75716,17847,HEC
84,,SING,O2D,H2D,no,N,84,,75716,17847,HEC
1,,SING,FE,NA,no,N,1,,75737,17848,HEC
2,,SING,FE,NB,no,N,2,,75737,17848,HEC
3,,SING,FE,NC,no,N,3,,75737,17848,HEC
4,,SING,FE,ND,no,N,4,,75737,17848,HEC
5,,DOUB,CHA,C1A,no,N,5,,75737,17848,HEC
6,,SING,CHA,C4D,no,N,6,,75737,17848,HEC
7,,SING,CHA,HHA,no,N,7,,75737,17848,HEC
8,,DOUB,CHB,C4A,no,N,8,,75737,17848,HEC
9,,SING,CHB,C1B,no,N,9,,75737,17848,HEC
10,,SING,CHB,HHB,no,N,10,,75737,17848,HEC
11,,DOUB,CHC,C4B,no,N,11,,75737,17848,HEC
12,,SING,CHC,C1C,no,N,12,,75737,17848,HEC
13,,SING,CHC,HHC,no,N,13,,75737,17848,HEC
14,,DOUB,CHD,C4C,no,N,14,,75737,17848,HEC
15,,SING,CHD,C1D,no,N,15,,75737,17848,HEC
16,,SING,CHD,HHD,no,N,16,,75737,17848,HEC
17,,SING,NA,C1A,yes,N,17,,75737,17848,HEC
18,,SING,NA,C4A,yes,N,18,,75737,17848,HEC
19,,SING,C1A,C2A,yes,N,19,,75737,17848,HEC
20,,DOUB,C2A,C3A,yes,N,20,,75737,17848,HEC
21,,SING,C2A,CAA,no,N,21,,75737,17848,HEC
22,,SING,C3A,C4A,yes,N,22,,75737,17848,HEC
23,,SING,C3A,CMA,no,N,23,,75737,17848,HEC
24,,SING,CMA,HMA1,no,N,24,,75737,17848,HEC
25,,SING,CMA,HMA2,no,N,25,,75737,17848,HEC
26,,SING,CMA,HMA3,no,N,26,,75737,17848,HEC
27,,SING,CAA,CBA,no,N,27,,75737,17848,HEC
28,,SING,CAA,HAA1,no,N,28,,75737,17848,HEC
29,,SING,CAA,HAA2,no,N,29,,75737,17848,HEC
30,,SING,CBA,CGA,no,N,30,,75737,17848,HEC
31,,SING,CBA,HBA1,no,N,31,,75737,17848,HEC
32,,SING,CBA,HBA2,no,N,32,,75737,17848,HEC
33,,DOUB,CGA,O1A,no,N,33,,75737,17848,HEC
34,,SING,CGA,O2A,no,N,34,,75737,17848,HEC
35,,SING,O2A,H2A,no,N,35,,75737,17848,HEC
36,,SING,NB,C1B,yes,N,36,,75737,17848,HEC
37,,SING,NB,C4B,yes,N,37,,75737,17848,HEC
38,,DOUB,C1B,C2B,yes,N,38,,75737,17848,HEC
39,,SING,C2B,C3B,yes,N,39,,75737,17848,HEC
40,,SING,C2B,CMB,no,N,40,,75737,17848,HEC
41,,SING,C3B,C4B,yes,N,41,,75737,17848,HEC
42,,DOUB,C3B,CAB,no,E,42,,75737,17848,HEC
43,,SING,CMB,HMB1,no,N,43,,75737,17848,HEC
44,,SING,CMB,HMB2,no,N,44,,75737,17848,HEC
45,,SING,CMB,HMB3,no,N,45,,75737,17848,HEC
46,,SING,CAB,CBB,no,N,46,,75737,17848,HEC
47,,SING,CAB,HAB,no,N,47,,75737,17848,HEC
48,,SING,CBB,HBB1,no,N,48,,75737,17848,HEC
49,,SING,CBB,HBB2,no,N,49,,75737,17848,HEC
50,,SING,CBB,HBB3,no,N,50,,75737,17848,HEC
51,,SING,NC,C1C,yes,N,51,,75737,17848,HEC
52,,SING,NC,C4C,yes,N,52,,75737,17848,HEC
53,,DOUB,C1C,C2C,yes,N,53,,75737,17848,HEC
54,,SING,C2C,C3C,yes,N,54,,75737,17848,HEC
55,,SING,C2C,CMC,no,N,55,,75737,17848,HEC
56,,SING,C3C,C4C,yes,N,56,,75737,17848,HEC
57,,DOUB,C3C,CAC,no,E,57,,75737,17848,HEC
58,,SING,CMC,HMC1,no,N,58,,75737,17848,HEC
59,,SING,CMC,HMC2,no,N,59,,75737,17848,HEC
60,,SING,CMC,HMC3,no,N,60,,75737,17848,HEC
61,,SING,CAC,CBC,no,N,61,,75737,17848,HEC
62,,SING,CAC,HAC,no,N,62,,75737,17848,HEC
63,,SING,CBC,HBC1,no,N,63,,75737,17848,HEC
64,,SING,CBC,HBC2,no,N,64,,75737,17848,HEC
65,,SING,CBC,HBC3,no,N,65,,75737,17848,HEC
66,,SING,ND,C1D,yes,N,66,,75737,17848,HEC
67,,SING,ND,C4D,yes,N,67,,75737,17848,HEC
68,,DOUB,C1D,C2D,yes,N,68,,75737,17848,HEC
69,,SING,C2D,C3D,yes,N,69,,75737,17848,HEC
70,,SING,C2D,CMD,no,N,70,,75737,17848,HEC
71,,DOUB,C3D,C4D,yes,N,71,,75737,17848,HEC
72,,SING,C3D,CAD,no,N,72,,75737,17848,HEC
73,,SING,CMD,HMD1,no,N,73,,75737,17848,HEC
74,,SING,CMD,HMD2,no,N,74,,75737,17848,HEC
75,,SING,CMD,HMD3,no,N,75,,75737,17848,HEC
76,,SING,CAD,CBD,no,N,76,,75737,17848,HEC
77,,SING,CAD,HAD1,no,N,77,,75737,17848,HEC
78,,SING,CAD,HAD2,no,N,78,,75737,17848,HEC
79,,SING,CBD,CGD,no,N,79,,75737,17848,HEC
80,,SING,CBD,HBD1,no,N,80,,75737,17848,HEC
81,,SING,CBD,HBD2,no,N,81,,75737,17848,HEC
82,,DOUB,CGD,O1D,no,N,82,,75737,17848,HEC
83,,SING,CGD,O2D,no,N,83,,75737,17848,HEC
84,,SING,O2D,H2D,no,N,84,,75737,17848,HEC
1,,SING,C1,C2,no,N,1,,75778,1785,AAC
2,,SING,C1,O1,no,N,2,,75778,1785,AAC
3,,DOUB,C1,O2,no,N,3,,75778,1785,AAC
4,,SING,C2,N1,no,N,4,,75778,1785,AAC
5,,SING,C2,HC21,no,N,5,,75778,1785,AAC
6,,SING,C2,HC22,no,N,6,,75778,1785,AAC
7,,SING,C3,C4,no,N,7,,75778,1785,AAC
8,,SING,C3,N1,no,N,8,,75778,1785,AAC
9,,DOUB,C3,O3,no,N,9,,75778,1785,AAC
10,,SING,C4,HC41,no,N,10,,75778,1785,AAC
11,,SING,C4,HC42,no,N,11,,75778,1785,AAC
12,,SING,C4,HC43,no,N,12,,75778,1785,AAC
13,,SING,N1,HN1,no,N,13,,75778,1785,AAC
14,,SING,O1,HO1,no,N,14,,75778,1785,AAC
1,,SING,FE,NA,no,N,1,,75779,1785,HEC
2,,SING,FE,NB,no,N,2,,75779,1785,HEC
3,,SING,FE,NC,no,N,3,,75779,1785,HEC
4,,SING,FE,ND,no,N,4,,75779,1785,HEC
5,,DOUB,CHA,C1A,no,N,5,,75779,1785,HEC
6,,SING,CHA,C4D,no,N,6,,75779,1785,HEC
7,,SING,CHA,HHA,no,N,7,,75779,1785,HEC
8,,DOUB,CHB,C4A,no,N,8,,75779,1785,HEC
9,,SING,CHB,C1B,no,N,9,,75779,1785,HEC
10,,SING,CHB,HHB,no,N,10,,75779,1785,HEC
11,,DOUB,CHC,C4B,no,N,11,,75779,1785,HEC
12,,SING,CHC,C1C,no,N,12,,75779,1785,HEC
13,,SING,CHC,HHC,no,N,13,,75779,1785,HEC
14,,DOUB,CHD,C4C,no,N,14,,75779,1785,HEC
15,,SING,CHD,C1D,no,N,15,,75779,1785,HEC
16,,SING,CHD,HHD,no,N,16,,75779,1785,HEC
17,,SING,NA,C1A,yes,N,17,,75779,1785,HEC
18,,SING,NA,C4A,yes,N,18,,75779,1785,HEC
19,,SING,C1A,C2A,yes,N,19,,75779,1785,HEC
20,,DOUB,C2A,C3A,yes,N,20,,75779,1785,HEC
21,,SING,C2A,CAA,no,N,21,,75779,1785,HEC
22,,SING,C3A,C4A,yes,N,22,,75779,1785,HEC
23,,SING,C3A,CMA,no,N,23,,75779,1785,HEC
24,,SING,CMA,HMA1,no,N,24,,75779,1785,HEC
25,,SING,CMA,HMA2,no,N,25,,75779,1785,HEC
26,,SING,CMA,HMA3,no,N,26,,75779,1785,HEC
27,,SING,CAA,CBA,no,N,27,,75779,1785,HEC
28,,SING,CAA,HAA1,no,N,28,,75779,1785,HEC
29,,SING,CAA,HAA2,no,N,29,,75779,1785,HEC
30,,SING,CBA,CGA,no,N,30,,75779,1785,HEC
31,,SING,CBA,HBA1,no,N,31,,75779,1785,HEC
32,,SING,CBA,HBA2,no,N,32,,75779,1785,HEC
33,,DOUB,CGA,O1A,no,N,33,,75779,1785,HEC
34,,SING,CGA,O2A,no,N,34,,75779,1785,HEC
35,,SING,O2A,H2A,no,N,35,,75779,1785,HEC
36,,SING,NB,C1B,yes,N,36,,75779,1785,HEC
37,,SING,NB,C4B,yes,N,37,,75779,1785,HEC
38,,DOUB,C1B,C2B,yes,N,38,,75779,1785,HEC
39,,SING,C2B,C3B,yes,N,39,,75779,1785,HEC
40,,SING,C2B,CMB,no,N,40,,75779,1785,HEC
41,,SING,C3B,C4B,yes,N,41,,75779,1785,HEC
42,,DOUB,C3B,CAB,no,E,42,,75779,1785,HEC
43,,SING,CMB,HMB1,no,N,43,,75779,1785,HEC
44,,SING,CMB,HMB2,no,N,44,,75779,1785,HEC
45,,SING,CMB,HMB3,no,N,45,,75779,1785,HEC
46,,SING,CAB,CBB,no,N,46,,75779,1785,HEC
47,,SING,CAB,HAB,no,N,47,,75779,1785,HEC
48,,SING,CBB,HBB1,no,N,48,,75779,1785,HEC
49,,SING,CBB,HBB2,no,N,49,,75779,1785,HEC
50,,SING,CBB,HBB3,no,N,50,,75779,1785,HEC
51,,SING,NC,C1C,yes,N,51,,75779,1785,HEC
52,,SING,NC,C4C,yes,N,52,,75779,1785,HEC
53,,DOUB,C1C,C2C,yes,N,53,,75779,1785,HEC
54,,SING,C2C,C3C,yes,N,54,,75779,1785,HEC
55,,SING,C2C,CMC,no,N,55,,75779,1785,HEC
56,,SING,C3C,C4C,yes,N,56,,75779,1785,HEC
57,,DOUB,C3C,CAC,no,E,57,,75779,1785,HEC
58,,SING,CMC,HMC1,no,N,58,,75779,1785,HEC
59,,SING,CMC,HMC2,no,N,59,,75779,1785,HEC
60,,SING,CMC,HMC3,no,N,60,,75779,1785,HEC
61,,SING,CAC,CBC,no,N,61,,75779,1785,HEC
62,,SING,CAC,HAC,no,N,62,,75779,1785,HEC
63,,SING,CBC,HBC1,no,N,63,,75779,1785,HEC
64,,SING,CBC,HBC2,no,N,64,,75779,1785,HEC
65,,SING,CBC,HBC3,no,N,65,,75779,1785,HEC
66,,SING,ND,C1D,yes,N,66,,75779,1785,HEC
67,,SING,ND,C4D,yes,N,67,,75779,1785,HEC
68,,DOUB,C1D,C2D,yes,N,68,,75779,1785,HEC
69,,SING,C2D,C3D,yes,N,69,,75779,1785,HEC
70,,SING,C2D,CMD,no,N,70,,75779,1785,HEC
71,,DOUB,C3D,C4D,yes,N,71,,75779,1785,HEC
72,,SING,C3D,CAD,no,N,72,,75779,1785,HEC
73,,SING,CMD,HMD1,no,N,73,,75779,1785,HEC
74,,SING,CMD,HMD2,no,N,74,,75779,1785,HEC
75,,SING,CMD,HMD3,no,N,75,,75779,1785,HEC
76,,SING,CAD,CBD,no,N,76,,75779,1785,HEC
77,,SING,CAD,HAD1,no,N,77,,75779,1785,HEC
78,,SING,CAD,HAD2,no,N,78,,75779,1785,HEC
79,,SING,CBD,CGD,no,N,79,,75779,1785,HEC
80,,SING,CBD,HBD1,no,N,80,,75779,1785,HEC
81,,SING,CBD,HBD2,no,N,81,,75779,1785,HEC
82,,DOUB,CGD,O1D,no,N,82,,75779,1785,HEC
83,,SING,CGD,O2D,no,N,83,,75779,1785,HEC
84,,SING,O2D,H2D,no,N,84,,75779,1785,HEC
1,,SING,BE,F1,no,N,1,,75818,17851,BEF
2,,SING,BE,F2,no,N,2,,75818,17851,BEF
3,,SING,BE,F3,no,N,3,,75818,17851,BEF
1,,SING,BE,F1,no,N,1,,75840,17852,BEF
2,,SING,BE,F2,no,N,2,,75840,17852,BEF
3,,SING,BE,F3,no,N,3,,75840,17852,BEF
1,,SING,C1,C2,no,N,1,,75842,17852,BG6
2,,SING,C1,O1,no,N,2,,75842,17852,BG6
3,,SING,C1,O5,no,N,3,,75842,17852,BG6
4,,SING,C1,HC1,no,N,4,,75842,17852,BG6
5,,SING,C2,C3,no,N,5,,75842,17852,BG6
6,,SING,C2,O2,no,N,6,,75842,17852,BG6
7,,SING,C2,HC2,no,N,7,,75842,17852,BG6
8,,SING,O1,HO1,no,N,8,,75842,17852,BG6
9,,SING,O5,C5,no,N,9,,75842,17852,BG6
10,,SING,C3,C4,no,N,10,,75842,17852,BG6
11,,SING,C3,O3,no,N,11,,75842,17852,BG6
12,,SING,C3,HC3,no,N,12,,75842,17852,BG6
13,,SING,O2,HO2,no,N,13,,75842,17852,BG6
14,,SING,C4,C5,no,N,14,,75842,17852,BG6
15,,SING,C4,O4,no,N,15,,75842,17852,BG6
16,,SING,C4,HC4,no,N,16,,75842,17852,BG6
17,,SING,O3,HO3,no,N,17,,75842,17852,BG6
18,,SING,C5,C6,no,N,18,,75842,17852,BG6
19,,SING,C5,HC5,no,N,19,,75842,17852,BG6
20,,SING,O4,HO4,no,N,20,,75842,17852,BG6
21,,SING,C6,O6,no,N,21,,75842,17852,BG6
22,,SING,C6,HC61,no,N,22,,75842,17852,BG6
23,,SING,C6,HC62,no,N,23,,75842,17852,BG6
24,,SING,O6,P,no,N,24,,75842,17852,BG6
25,,SING,P,O1P,no,N,25,,75842,17852,BG6
26,,SING,P,O2P,no,N,26,,75842,17852,BG6
27,,DOUB,P,O3P,no,N,27,,75842,17852,BG6
28,,SING,O1P,H1O1,no,N,28,,75842,17852,BG6
29,,SING,O2P,H2O2,no,N,29,,75842,17852,BG6
1,,SING,P,OP3,no,N,1,,75958,17859,LHO
2,,DOUB,C1,C2,no,N,2,,75958,17859,LHO
3,,SING,N1,C1,no,N,3,,75958,17859,LHO
4,,SING,N1,C5,no,N,4,,75958,17859,LHO
5,,DOUB,S1,C5,no,N,5,,75958,17859,LHO
6,,SING,C2,H2,no,N,6,,75958,17859,LHO
7,,SING,C2,C3,no,N,7,,75958,17859,LHO
8,,SING,C3,C6,yes,N,8,,75958,17859,LHO
9,,DOUB,C4,C3,yes,N,9,,75958,17859,LHO
10,,SING,C4,C9,yes,N,10,,75958,17859,LHO
11,,SING,C5,C4,no,N,11,,75958,17859,LHO
12,,SING,C6,H6,no,N,12,,75958,17859,LHO
13,,DOUB,C6,C7,yes,N,13,,75958,17859,LHO
14,,SING,C7,C10,no,N,14,,75958,17859,LHO
15,,SING,C8,C7,yes,N,15,,75958,17859,LHO
16,,SING,C8,H8,no,N,16,,75958,17859,LHO
17,,DOUB,C9,C8,yes,N,17,,75958,17859,LHO
18,,SING,C1',N1,no,N,18,,75958,17859,LHO
19,,SING,C1',C2',no,N,19,,75958,17859,LHO
20,,SING,C10,H110,no,N,20,,75958,17859,LHO
21,,SING,OP2,P,no,N,21,,75958,17859,LHO
22,,SING,OP2,HOP2,no,N,22,,75958,17859,LHO
23,,SING,C2',H22',no,N,23,,75958,17859,LHO
24,,SING,C2',H12',no,N,24,,75958,17859,LHO
25,,SING,OP3,HOP3,no,N,25,,75958,17859,LHO
26,,SING,C3',C2',no,N,26,,75958,17859,LHO
27,,SING,C3',H3',no,N,27,,75958,17859,LHO
28,,SING,O3',C3',no,N,28,,75958,17859,LHO
29,,SING,O3',HO3',no,N,29,,75958,17859,LHO
30,,SING,C4',C3',no,N,30,,75958,17859,LHO
31,,SING,C4',O4',no,N,31,,75958,17859,LHO
32,,SING,C4',C5',no,N,32,,75958,17859,LHO
33,,SING,O4',C1',no,N,33,,75958,17859,LHO
34,,SING,C5',O5',no,N,34,,75958,17859,LHO
35,,SING,O5',P,no,N,35,,75958,17859,LHO
36,,SING,H1,C1,no,N,36,,75958,17859,LHO
37,,SING,H9,C9,no,N,37,,75958,17859,LHO
38,,SING,H1',C1',no,N,38,,75958,17859,LHO
39,,SING,H210,C10,no,N,39,,75958,17859,LHO
40,,SING,H310,C10,no,N,40,,75958,17859,LHO
41,,SING,H4',C4',no,N,41,,75958,17859,LHO
42,,SING,H15',C5',no,N,42,,75958,17859,LHO
43,,SING,H25',C5',no,N,43,,75958,17859,LHO
44,,DOUB,P,OP1,no,N,44,,75958,17859,LHO
1,,SING,C1,C2,yes,N,1,,75959,17859,MM7
2,,SING,O1,C8,no,N,2,,75959,17859,MM7
3,,SING,O1,C6,no,N,3,,75959,17859,MM7
4,,DOUB,C2,C3,yes,N,4,,75959,17859,MM7
5,,SING,C2,H2,no,N,5,,75959,17859,MM7
6,,SING,C3,H3,no,N,6,,75959,17859,MM7
7,,SING,C4,C3,yes,N,7,,75959,17859,MM7
8,,DOUB,C5,C4,yes,N,8,,75959,17859,MM7
9,,DOUB,C6,C1,yes,N,9,,75959,17859,MM7
10,,SING,C6,C5,yes,N,10,,75959,17859,MM7
11,,SING,C7,C4,no,N,11,,75959,17859,MM7
12,,SING,C7,H17,no,N,12,,75959,17859,MM7
13,,SING,C7,H37,no,N,13,,75959,17859,MM7
14,,SING,C8,H38,no,N,14,,75959,17859,MM7
15,,SING,C8,H28,no,N,15,,75959,17859,MM7
16,,SING,C1',C1,no,N,16,,75959,17859,MM7
17,,SING,C1',O4',no,N,17,,75959,17859,MM7
18,,SING,OP2,P,no,N,18,,75959,17859,MM7
19,,SING,OP2,HOP2,no,N,19,,75959,17859,MM7
20,,SING,C2',C1',no,N,20,,75959,17859,MM7
21,,SING,C2',H12',no,N,21,,75959,17859,MM7
22,,SING,C2',C3',no,N,22,,75959,17859,MM7
23,,SING,OP3,P,no,N,23,,75959,17859,MM7
24,,SING,OP3,HOP3,no,N,24,,75959,17859,MM7
25,,SING,C3',C4',no,N,25,,75959,17859,MM7
26,,SING,O3',C3',no,N,26,,75959,17859,MM7
27,,SING,O3',HO3',no,N,27,,75959,17859,MM7
28,,SING,C4',H4',no,N,28,,75959,17859,MM7
29,,SING,C4',O4',no,N,29,,75959,17859,MM7
30,,SING,C4',C5',no,N,30,,75959,17859,MM7
31,,SING,C5',H15',no,N,31,,75959,17859,MM7
32,,SING,O5',P,no,N,32,,75959,17859,MM7
33,,SING,O5',C5',no,N,33,,75959,17859,MM7
34,,SING,H5,C5,no,N,34,,75959,17859,MM7
35,,SING,H27,C7,no,N,35,,75959,17859,MM7
36,,SING,H18,C8,no,N,36,,75959,17859,MM7
37,,SING,H1',C1',no,N,37,,75959,17859,MM7
38,,SING,H22',C2',no,N,38,,75959,17859,MM7
39,,SING,H3',C3',no,N,39,,75959,17859,MM7
40,,SING,H25',C5',no,N,40,,75959,17859,MM7
41,,DOUB,P,OP1,no,N,41,,75959,17859,MM7
1,,DOUB,C,O,no,N,1,,76136,17868,ACE
2,,SING,C,CH3,no,N,2,,76136,17868,ACE
3,,SING,C,H,no,N,3,,76136,17868,ACE
4,,SING,CH3,H1,no,N,4,,76136,17868,ACE
5,,SING,CH3,H2,no,N,5,,76136,17868,ACE
6,,SING,CH3,H3,no,N,6,,76136,17868,ACE
1,,SING,N,HN1,no,N,1,,76137,17868,NH2
2,,SING,N,HN2,no,N,2,,76137,17868,NH2
1,,DOUB,C,O,no,N,1,,76156,17869,ACE
2,,SING,C,CH3,no,N,2,,76156,17869,ACE
3,,SING,C,H,no,N,3,,76156,17869,ACE
4,,SING,CH3,H1,no,N,4,,76156,17869,ACE
5,,SING,CH3,H2,no,N,5,,76156,17869,ACE
6,,SING,CH3,H3,no,N,6,,76156,17869,ACE
1,,SING,N,HN1,no,N,1,,76157,17869,NH2
2,,SING,N,HN2,no,N,2,,76157,17869,NH2
1,,SING,O,C5,no,N,1,,76158,17869,A2G
2,,SING,C1,O,no,N,2,,76158,17869,A2G
3,,SING,C1,C2,no,N,3,,76158,17869,A2G
4,,SING,C1,H1,no,N,4,,76158,17869,A2G
5,,SING,O1,C1,no,N,5,,76158,17869,A2G
6,,SING,O1,HO1,no,N,6,,76158,17869,A2G
7,,SING,C2,C3,no,N,7,,76158,17869,A2G
8,,SING,C2,H2,no,N,8,,76158,17869,A2G
9,,SING,N2,C2,no,N,9,,76158,17869,A2G
10,,SING,N2,HN2,no,N,10,,76158,17869,A2G
11,,SING,C3,C4,no,N,11,,76158,17869,A2G
12,,SING,C3,O3,no,N,12,,76158,17869,A2G
13,,SING,C3,H3,no,N,13,,76158,17869,A2G
14,,SING,O3,HO3,no,N,14,,76158,17869,A2G
15,,SING,C4,O4,no,N,15,,76158,17869,A2G
16,,SING,C4,H4,no,N,16,,76158,17869,A2G
17,,SING,O4,HO4,no,N,17,,76158,17869,A2G
18,,SING,C5,C4,no,N,18,,76158,17869,A2G
19,,SING,C5,C6,no,N,19,,76158,17869,A2G
20,,SING,C5,H5,no,N,20,,76158,17869,A2G
21,,SING,C6,O6,no,N,21,,76158,17869,A2G
22,,SING,C6,H6,no,N,22,,76158,17869,A2G
23,,SING,C7,N2,no,N,23,,76158,17869,A2G
24,,DOUB,O7,C7,no,N,24,,76158,17869,A2G
25,,SING,C8,C7,no,N,25,,76158,17869,A2G
26,,SING,C8,H8,no,N,26,,76158,17869,A2G
27,,SING,C8,H8A,no,N,27,,76158,17869,A2G
28,,SING,C8,H8B,no,N,28,,76158,17869,A2G
29,,SING,C6,H14,no,N,29,,76158,17869,A2G
30,,SING,O6,H15,no,N,30,,76158,17869,A2G
1,,SING,C1,C2,no,N,1,,76176,1787,AAC
2,,SING,C1,O1,no,N,2,,76176,1787,AAC
3,,DOUB,C1,O2,no,N,3,,76176,1787,AAC
4,,SING,C2,N1,no,N,4,,76176,1787,AAC
5,,SING,C2,HC21,no,N,5,,76176,1787,AAC
6,,SING,C2,HC22,no,N,6,,76176,1787,AAC
7,,SING,C3,C4,no,N,7,,76176,1787,AAC
8,,SING,C3,N1,no,N,8,,76176,1787,AAC
9,,DOUB,C3,O3,no,N,9,,76176,1787,AAC
10,,SING,C4,HC41,no,N,10,,76176,1787,AAC
11,,SING,C4,HC42,no,N,11,,76176,1787,AAC
12,,SING,C4,HC43,no,N,12,,76176,1787,AAC
13,,SING,N1,HN1,no,N,13,,76176,1787,AAC
14,,SING,O1,HO1,no,N,14,,76176,1787,AAC
1,,SING,FE,NA,no,N,1,,76177,1787,HEC
2,,SING,FE,NB,no,N,2,,76177,1787,HEC
3,,SING,FE,NC,no,N,3,,76177,1787,HEC
4,,SING,FE,ND,no,N,4,,76177,1787,HEC
5,,DOUB,CHA,C1A,no,N,5,,76177,1787,HEC
6,,SING,CHA,C4D,no,N,6,,76177,1787,HEC
7,,SING,CHA,HHA,no,N,7,,76177,1787,HEC
8,,DOUB,CHB,C4A,no,N,8,,76177,1787,HEC
9,,SING,CHB,C1B,no,N,9,,76177,1787,HEC
10,,SING,CHB,HHB,no,N,10,,76177,1787,HEC
11,,DOUB,CHC,C4B,no,N,11,,76177,1787,HEC
12,,SING,CHC,C1C,no,N,12,,76177,1787,HEC
13,,SING,CHC,HHC,no,N,13,,76177,1787,HEC
14,,DOUB,CHD,C4C,no,N,14,,76177,1787,HEC
15,,SING,CHD,C1D,no,N,15,,76177,1787,HEC
16,,SING,CHD,HHD,no,N,16,,76177,1787,HEC
17,,SING,NA,C1A,yes,N,17,,76177,1787,HEC
18,,SING,NA,C4A,yes,N,18,,76177,1787,HEC
19,,SING,C1A,C2A,yes,N,19,,76177,1787,HEC
20,,DOUB,C2A,C3A,yes,N,20,,76177,1787,HEC
21,,SING,C2A,CAA,no,N,21,,76177,1787,HEC
22,,SING,C3A,C4A,yes,N,22,,76177,1787,HEC
23,,SING,C3A,CMA,no,N,23,,76177,1787,HEC
24,,SING,CMA,HMA1,no,N,24,,76177,1787,HEC
25,,SING,CMA,HMA2,no,N,25,,76177,1787,HEC
26,,SING,CMA,HMA3,no,N,26,,76177,1787,HEC
27,,SING,CAA,CBA,no,N,27,,76177,1787,HEC
28,,SING,CAA,HAA1,no,N,28,,76177,1787,HEC
29,,SING,CAA,HAA2,no,N,29,,76177,1787,HEC
30,,SING,CBA,CGA,no,N,30,,76177,1787,HEC
31,,SING,CBA,HBA1,no,N,31,,76177,1787,HEC
32,,SING,CBA,HBA2,no,N,32,,76177,1787,HEC
33,,DOUB,CGA,O1A,no,N,33,,76177,1787,HEC
34,,SING,CGA,O2A,no,N,34,,76177,1787,HEC
35,,SING,O2A,H2A,no,N,35,,76177,1787,HEC
36,,SING,NB,C1B,yes,N,36,,76177,1787,HEC
37,,SING,NB,C4B,yes,N,37,,76177,1787,HEC
38,,DOUB,C1B,C2B,yes,N,38,,76177,1787,HEC
39,,SING,C2B,C3B,yes,N,39,,76177,1787,HEC
40,,SING,C2B,CMB,no,N,40,,76177,1787,HEC
41,,SING,C3B,C4B,yes,N,41,,76177,1787,HEC
42,,DOUB,C3B,CAB,no,E,42,,76177,1787,HEC
43,,SING,CMB,HMB1,no,N,43,,76177,1787,HEC
44,,SING,CMB,HMB2,no,N,44,,76177,1787,HEC
45,,SING,CMB,HMB3,no,N,45,,76177,1787,HEC
46,,SING,CAB,CBB,no,N,46,,76177,1787,HEC
47,,SING,CAB,HAB,no,N,47,,76177,1787,HEC
48,,SING,CBB,HBB1,no,N,48,,76177,1787,HEC
49,,SING,CBB,HBB2,no,N,49,,76177,1787,HEC
50,,SING,CBB,HBB3,no,N,50,,76177,1787,HEC
51,,SING,NC,C1C,yes,N,51,,76177,1787,HEC
52,,SING,NC,C4C,yes,N,52,,76177,1787,HEC
53,,DOUB,C1C,C2C,yes,N,53,,76177,1787,HEC
54,,SING,C2C,C3C,yes,N,54,,76177,1787,HEC
55,,SING,C2C,CMC,no,N,55,,76177,1787,HEC
56,,SING,C3C,C4C,yes,N,56,,76177,1787,HEC
57,,DOUB,C3C,CAC,no,E,57,,76177,1787,HEC
58,,SING,CMC,HMC1,no,N,58,,76177,1787,HEC
59,,SING,CMC,HMC2,no,N,59,,76177,1787,HEC
60,,SING,CMC,HMC3,no,N,60,,76177,1787,HEC
61,,SING,CAC,CBC,no,N,61,,76177,1787,HEC
62,,SING,CAC,HAC,no,N,62,,76177,1787,HEC
63,,SING,CBC,HBC1,no,N,63,,76177,1787,HEC
64,,SING,CBC,HBC2,no,N,64,,76177,1787,HEC
65,,SING,CBC,HBC3,no,N,65,,76177,1787,HEC
66,,SING,ND,C1D,yes,N,66,,76177,1787,HEC
67,,SING,ND,C4D,yes,N,67,,76177,1787,HEC
68,,DOUB,C1D,C2D,yes,N,68,,76177,1787,HEC
69,,SING,C2D,C3D,yes,N,69,,76177,1787,HEC
70,,SING,C2D,CMD,no,N,70,,76177,1787,HEC
71,,DOUB,C3D,C4D,yes,N,71,,76177,1787,HEC
72,,SING,C3D,CAD,no,N,72,,76177,1787,HEC
73,,SING,CMD,HMD1,no,N,73,,76177,1787,HEC
74,,SING,CMD,HMD2,no,N,74,,76177,1787,HEC
75,,SING,CMD,HMD3,no,N,75,,76177,1787,HEC
76,,SING,CAD,CBD,no,N,76,,76177,1787,HEC
77,,SING,CAD,HAD1,no,N,77,,76177,1787,HEC
78,,SING,CAD,HAD2,no,N,78,,76177,1787,HEC
79,,SING,CBD,CGD,no,N,79,,76177,1787,HEC
80,,SING,CBD,HBD1,no,N,80,,76177,1787,HEC
81,,SING,CBD,HBD2,no,N,81,,76177,1787,HEC
82,,DOUB,CGD,O1D,no,N,82,,76177,1787,HEC
83,,SING,CGD,O2D,no,N,83,,76177,1787,HEC
84,,SING,O2D,H2D,no,N,84,,76177,1787,HEC
1,,DOUB,C,O,no,N,1,,76192,17870,ACE
2,,SING,C,CH3,no,N,2,,76192,17870,ACE
3,,SING,C,H,no,N,3,,76192,17870,ACE
4,,SING,CH3,H1,no,N,4,,76192,17870,ACE
5,,SING,CH3,H2,no,N,5,,76192,17870,ACE
6,,SING,CH3,H3,no,N,6,,76192,17870,ACE
1,,SING,N,HN1,no,N,1,,76193,17870,NH2
2,,SING,N,HN2,no,N,2,,76193,17870,NH2
1,,SING,O,C5,no,N,1,,76194,17870,A2G
2,,SING,C1,O,no,N,2,,76194,17870,A2G
3,,SING,C1,C2,no,N,3,,76194,17870,A2G
4,,SING,C1,H1,no,N,4,,76194,17870,A2G
5,,SING,O1,C1,no,N,5,,76194,17870,A2G
6,,SING,O1,HO1,no,N,6,,76194,17870,A2G
7,,SING,C2,C3,no,N,7,,76194,17870,A2G
8,,SING,C2,H2,no,N,8,,76194,17870,A2G
9,,SING,N2,C2,no,N,9,,76194,17870,A2G
10,,SING,N2,HN2,no,N,10,,76194,17870,A2G
11,,SING,C3,C4,no,N,11,,76194,17870,A2G
12,,SING,C3,O3,no,N,12,,76194,17870,A2G
13,,SING,C3,H3,no,N,13,,76194,17870,A2G
14,,SING,O3,HO3,no,N,14,,76194,17870,A2G
15,,SING,C4,O4,no,N,15,,76194,17870,A2G
16,,SING,C4,H4,no,N,16,,76194,17870,A2G
17,,SING,O4,HO4,no,N,17,,76194,17870,A2G
18,,SING,C5,C4,no,N,18,,76194,17870,A2G
19,,SING,C5,C6,no,N,19,,76194,17870,A2G
20,,SING,C5,H5,no,N,20,,76194,17870,A2G
21,,SING,C6,O6,no,N,21,,76194,17870,A2G
22,,SING,C6,H6,no,N,22,,76194,17870,A2G
23,,SING,C7,N2,no,N,23,,76194,17870,A2G
24,,DOUB,O7,C7,no,N,24,,76194,17870,A2G
25,,SING,C8,C7,no,N,25,,76194,17870,A2G
26,,SING,C8,H8,no,N,26,,76194,17870,A2G
27,,SING,C8,H8A,no,N,27,,76194,17870,A2G
28,,SING,C8,H8B,no,N,28,,76194,17870,A2G
29,,SING,C6,H14,no,N,29,,76194,17870,A2G
30,,SING,O6,H15,no,N,30,,76194,17870,A2G
1,,DOUB,C,O,no,N,1,,76213,17871,ACE
2,,SING,C,CH3,no,N,2,,76213,17871,ACE
3,,SING,C,H,no,N,3,,76213,17871,ACE
4,,SING,CH3,H1,no,N,4,,76213,17871,ACE
5,,SING,CH3,H2,no,N,5,,76213,17871,ACE
6,,SING,CH3,H3,no,N,6,,76213,17871,ACE
1,,SING,N,HN1,no,N,1,,76214,17871,NH2
2,,SING,N,HN2,no,N,2,,76214,17871,NH2
1,,SING,O,C5,no,N,1,,76215,17871,A2G
2,,SING,C1,O,no,N,2,,76215,17871,A2G
3,,SING,C1,C2,no,N,3,,76215,17871,A2G
4,,SING,C1,H1,no,N,4,,76215,17871,A2G
5,,SING,O1,C1,no,N,5,,76215,17871,A2G
6,,SING,O1,HO1,no,N,6,,76215,17871,A2G
7,,SING,C2,C3,no,N,7,,76215,17871,A2G
8,,SING,C2,H2,no,N,8,,76215,17871,A2G
9,,SING,N2,C2,no,N,9,,76215,17871,A2G
10,,SING,N2,HN2,no,N,10,,76215,17871,A2G
11,,SING,C3,C4,no,N,11,,76215,17871,A2G
12,,SING,C3,O3,no,N,12,,76215,17871,A2G
13,,SING,C3,H3,no,N,13,,76215,17871,A2G
14,,SING,O3,HO3,no,N,14,,76215,17871,A2G
15,,SING,C4,O4,no,N,15,,76215,17871,A2G
16,,SING,C4,H4,no,N,16,,76215,17871,A2G
17,,SING,O4,HO4,no,N,17,,76215,17871,A2G
18,,SING,C5,C4,no,N,18,,76215,17871,A2G
19,,SING,C5,C6,no,N,19,,76215,17871,A2G
20,,SING,C5,H5,no,N,20,,76215,17871,A2G
21,,SING,C6,O6,no,N,21,,76215,17871,A2G
22,,SING,C6,H6,no,N,22,,76215,17871,A2G
23,,SING,C7,N2,no,N,23,,76215,17871,A2G
24,,DOUB,O7,C7,no,N,24,,76215,17871,A2G
25,,SING,C8,C7,no,N,25,,76215,17871,A2G
26,,SING,C8,H8,no,N,26,,76215,17871,A2G
27,,SING,C8,H8A,no,N,27,,76215,17871,A2G
28,,SING,C8,H8B,no,N,28,,76215,17871,A2G
29,,SING,C6,H14,no,N,29,,76215,17871,A2G
30,,SING,O6,H15,no,N,30,,76215,17871,A2G
1,,DOUB,C,O,no,N,1,,76234,17872,ACE
2,,SING,C,CH3,no,N,2,,76234,17872,ACE
3,,SING,C,H,no,N,3,,76234,17872,ACE
4,,SING,CH3,H1,no,N,4,,76234,17872,ACE
5,,SING,CH3,H2,no,N,5,,76234,17872,ACE
6,,SING,CH3,H3,no,N,6,,76234,17872,ACE
1,,SING,N,HN1,no,N,1,,76235,17872,NH2
2,,SING,N,HN2,no,N,2,,76235,17872,NH2
1,,SING,O,C5,no,N,1,,76236,17872,A2G
2,,SING,C1,O,no,N,2,,76236,17872,A2G
3,,SING,C1,C2,no,N,3,,76236,17872,A2G
4,,SING,C1,H1,no,N,4,,76236,17872,A2G
5,,SING,O1,C1,no,N,5,,76236,17872,A2G
6,,SING,O1,HO1,no,N,6,,76236,17872,A2G
7,,SING,C2,C3,no,N,7,,76236,17872,A2G
8,,SING,C2,H2,no,N,8,,76236,17872,A2G
9,,SING,N2,C2,no,N,9,,76236,17872,A2G
10,,SING,N2,HN2,no,N,10,,76236,17872,A2G
11,,SING,C3,C4,no,N,11,,76236,17872,A2G
12,,SING,C3,O3,no,N,12,,76236,17872,A2G
13,,SING,C3,H3,no,N,13,,76236,17872,A2G
14,,SING,O3,HO3,no,N,14,,76236,17872,A2G
15,,SING,C4,O4,no,N,15,,76236,17872,A2G
16,,SING,C4,H4,no,N,16,,76236,17872,A2G
17,,SING,O4,HO4,no,N,17,,76236,17872,A2G
18,,SING,C5,C4,no,N,18,,76236,17872,A2G
19,,SING,C5,C6,no,N,19,,76236,17872,A2G
20,,SING,C5,H5,no,N,20,,76236,17872,A2G
21,,SING,C6,O6,no,N,21,,76236,17872,A2G
22,,SING,C6,H6,no,N,22,,76236,17872,A2G
23,,SING,C7,N2,no,N,23,,76236,17872,A2G
24,,DOUB,O7,C7,no,N,24,,76236,17872,A2G
25,,SING,C8,C7,no,N,25,,76236,17872,A2G
26,,SING,C8,H8,no,N,26,,76236,17872,A2G
27,,SING,C8,H8A,no,N,27,,76236,17872,A2G
28,,SING,C8,H8B,no,N,28,,76236,17872,A2G
29,,SING,C6,H14,no,N,29,,76236,17872,A2G
30,,SING,O6,H15,no,N,30,,76236,17872,A2G
1,,DOUB,C,O,no,N,1,,76255,17873,ACE
2,,SING,C,CH3,no,N,2,,76255,17873,ACE
3,,SING,C,H,no,N,3,,76255,17873,ACE
4,,SING,CH3,H1,no,N,4,,76255,17873,ACE
5,,SING,CH3,H2,no,N,5,,76255,17873,ACE
6,,SING,CH3,H3,no,N,6,,76255,17873,ACE
1,,SING,N,HN1,no,N,1,,76256,17873,NH2
2,,SING,N,HN2,no,N,2,,76256,17873,NH2
1,,SING,O,C5,no,N,1,,76257,17873,A2G
2,,SING,C1,O,no,N,2,,76257,17873,A2G
3,,SING,C1,C2,no,N,3,,76257,17873,A2G
4,,SING,C1,H1,no,N,4,,76257,17873,A2G
5,,SING,O1,C1,no,N,5,,76257,17873,A2G
6,,SING,O1,HO1,no,N,6,,76257,17873,A2G
7,,SING,C2,C3,no,N,7,,76257,17873,A2G
8,,SING,C2,H2,no,N,8,,76257,17873,A2G
9,,SING,N2,C2,no,N,9,,76257,17873,A2G
10,,SING,N2,HN2,no,N,10,,76257,17873,A2G
11,,SING,C3,C4,no,N,11,,76257,17873,A2G
12,,SING,C3,O3,no,N,12,,76257,17873,A2G
13,,SING,C3,H3,no,N,13,,76257,17873,A2G
14,,SING,O3,HO3,no,N,14,,76257,17873,A2G
15,,SING,C4,O4,no,N,15,,76257,17873,A2G
16,,SING,C4,H4,no,N,16,,76257,17873,A2G
17,,SING,O4,HO4,no,N,17,,76257,17873,A2G
18,,SING,C5,C4,no,N,18,,76257,17873,A2G
19,,SING,C5,C6,no,N,19,,76257,17873,A2G
20,,SING,C5,H5,no,N,20,,76257,17873,A2G
21,,SING,C6,O6,no,N,21,,76257,17873,A2G
22,,SING,C6,H6,no,N,22,,76257,17873,A2G
23,,SING,C7,N2,no,N,23,,76257,17873,A2G
24,,DOUB,O7,C7,no,N,24,,76257,17873,A2G
25,,SING,C8,C7,no,N,25,,76257,17873,A2G
26,,SING,C8,H8,no,N,26,,76257,17873,A2G
27,,SING,C8,H8A,no,N,27,,76257,17873,A2G
28,,SING,C8,H8B,no,N,28,,76257,17873,A2G
29,,SING,C6,H14,no,N,29,,76257,17873,A2G
30,,SING,O6,H15,no,N,30,,76257,17873,A2G
1,,DOUB,C,O,no,N,1,,76276,17874,ACE
2,,SING,C,CH3,no,N,2,,76276,17874,ACE
3,,SING,C,H,no,N,3,,76276,17874,ACE
4,,SING,CH3,H1,no,N,4,,76276,17874,ACE
5,,SING,CH3,H2,no,N,5,,76276,17874,ACE
6,,SING,CH3,H3,no,N,6,,76276,17874,ACE
1,,SING,N,HN1,no,N,1,,76277,17874,NH2
2,,SING,N,HN2,no,N,2,,76277,17874,NH2
1,,SING,O,C5,no,N,1,,76278,17874,A2G
2,,SING,C1,O,no,N,2,,76278,17874,A2G
3,,SING,C1,C2,no,N,3,,76278,17874,A2G
4,,SING,C1,H1,no,N,4,,76278,17874,A2G
5,,SING,O1,C1,no,N,5,,76278,17874,A2G
6,,SING,O1,HO1,no,N,6,,76278,17874,A2G
7,,SING,C2,C3,no,N,7,,76278,17874,A2G
8,,SING,C2,H2,no,N,8,,76278,17874,A2G
9,,SING,N2,C2,no,N,9,,76278,17874,A2G
10,,SING,N2,HN2,no,N,10,,76278,17874,A2G
11,,SING,C3,C4,no,N,11,,76278,17874,A2G
12,,SING,C3,O3,no,N,12,,76278,17874,A2G
13,,SING,C3,H3,no,N,13,,76278,17874,A2G
14,,SING,O3,HO3,no,N,14,,76278,17874,A2G
15,,SING,C4,O4,no,N,15,,76278,17874,A2G
16,,SING,C4,H4,no,N,16,,76278,17874,A2G
17,,SING,O4,HO4,no,N,17,,76278,17874,A2G
18,,SING,C5,C4,no,N,18,,76278,17874,A2G
19,,SING,C5,C6,no,N,19,,76278,17874,A2G
20,,SING,C5,H5,no,N,20,,76278,17874,A2G
21,,SING,C6,O6,no,N,21,,76278,17874,A2G
22,,SING,C6,H6,no,N,22,,76278,17874,A2G
23,,SING,C7,N2,no,N,23,,76278,17874,A2G
24,,DOUB,O7,C7,no,N,24,,76278,17874,A2G
25,,SING,C8,C7,no,N,25,,76278,17874,A2G
26,,SING,C8,H8,no,N,26,,76278,17874,A2G
27,,SING,C8,H8A,no,N,27,,76278,17874,A2G
28,,SING,C8,H8B,no,N,28,,76278,17874,A2G
29,,SING,C6,H14,no,N,29,,76278,17874,A2G
30,,SING,O6,H15,no,N,30,,76278,17874,A2G
1,,DOUB,C,O,no,N,1,,76297,17875,ACE
2,,SING,C,CH3,no,N,2,,76297,17875,ACE
3,,SING,C,H,no,N,3,,76297,17875,ACE
4,,SING,CH3,H1,no,N,4,,76297,17875,ACE
5,,SING,CH3,H2,no,N,5,,76297,17875,ACE
6,,SING,CH3,H3,no,N,6,,76297,17875,ACE
1,,SING,N,HN1,no,N,1,,76298,17875,NH2
2,,SING,N,HN2,no,N,2,,76298,17875,NH2
1,,SING,O,C5,no,N,1,,76299,17875,A2G
2,,SING,C1,O,no,N,2,,76299,17875,A2G
3,,SING,C1,C2,no,N,3,,76299,17875,A2G
4,,SING,C1,H1,no,N,4,,76299,17875,A2G
5,,SING,O1,C1,no,N,5,,76299,17875,A2G
6,,SING,O1,HO1,no,N,6,,76299,17875,A2G
7,,SING,C2,C3,no,N,7,,76299,17875,A2G
8,,SING,C2,H2,no,N,8,,76299,17875,A2G
9,,SING,N2,C2,no,N,9,,76299,17875,A2G
10,,SING,N2,HN2,no,N,10,,76299,17875,A2G
11,,SING,C3,C4,no,N,11,,76299,17875,A2G
12,,SING,C3,O3,no,N,12,,76299,17875,A2G
13,,SING,C3,H3,no,N,13,,76299,17875,A2G
14,,SING,O3,HO3,no,N,14,,76299,17875,A2G
15,,SING,C4,O4,no,N,15,,76299,17875,A2G
16,,SING,C4,H4,no,N,16,,76299,17875,A2G
17,,SING,O4,HO4,no,N,17,,76299,17875,A2G
18,,SING,C5,C4,no,N,18,,76299,17875,A2G
19,,SING,C5,C6,no,N,19,,76299,17875,A2G
20,,SING,C5,H5,no,N,20,,76299,17875,A2G
21,,SING,C6,O6,no,N,21,,76299,17875,A2G
22,,SING,C6,H6,no,N,22,,76299,17875,A2G
23,,SING,C7,N2,no,N,23,,76299,17875,A2G
24,,DOUB,O7,C7,no,N,24,,76299,17875,A2G
25,,SING,C8,C7,no,N,25,,76299,17875,A2G
26,,SING,C8,H8,no,N,26,,76299,17875,A2G
27,,SING,C8,H8A,no,N,27,,76299,17875,A2G
28,,SING,C8,H8B,no,N,28,,76299,17875,A2G
29,,SING,C6,H14,no,N,29,,76299,17875,A2G
30,,SING,O6,H15,no,N,30,,76299,17875,A2G
1,,SING,C3',C2',no,N,1,,76430,17882,NHE
2,,SING,C3',C4',no,N,2,,76430,17882,NHE
3,,SING,C3',H3'1,no,N,3,,76430,17882,NHE
4,,SING,C3',H3'2,no,N,4,,76430,17882,NHE
5,,SING,C2',C1',no,N,5,,76430,17882,NHE
6,,SING,C2',H2'1,no,N,6,,76430,17882,NHE
7,,SING,C2',H2'2,no,N,7,,76430,17882,NHE
8,,SING,C1',C6',no,N,8,,76430,17882,NHE
9,,SING,C1',N,no,N,9,,76430,17882,NHE
10,,SING,C1',HC'1,no,N,10,,76430,17882,NHE
11,,SING,C6',C5',no,N,11,,76430,17882,NHE
12,,SING,C6',H6'1,no,N,12,,76430,17882,NHE
13,,SING,C6',H6'2,no,N,13,,76430,17882,NHE
14,,SING,N,C1,no,N,14,,76430,17882,NHE
15,,SING,N,HN,no,N,15,,76430,17882,NHE
16,,SING,C1,C2,no,N,16,,76430,17882,NHE
17,,SING,C1,HC11,no,N,17,,76430,17882,NHE
18,,SING,C1,HC12,no,N,18,,76430,17882,NHE
19,,SING,C2,S,no,N,19,,76430,17882,NHE
20,,SING,C2,HC21,no,N,20,,76430,17882,NHE
21,,SING,C2,HC22,no,N,21,,76430,17882,NHE
22,,DOUB,S,O1,no,N,22,,76430,17882,NHE
23,,DOUB,S,O2,no,N,23,,76430,17882,NHE
24,,SING,S,O3,no,N,24,,76430,17882,NHE
25,,SING,O3,HO3,no,N,25,,76430,17882,NHE
26,,SING,C5',C4',no,N,26,,76430,17882,NHE
27,,SING,C5',H5'1,no,N,27,,76430,17882,NHE
28,,SING,C5',H5'2,no,N,28,,76430,17882,NHE
29,,SING,C4',H4'1,no,N,29,,76430,17882,NHE
30,,SING,C4',H4'2,no,N,30,,76430,17882,NHE
1,,SING,N,HN1,no,N,1,,76474,17884,NH2
2,,SING,N,HN2,no,N,2,,76474,17884,NH2
1,,DOUB,C,O,no,N,1,,76475,17884,ACE
2,,SING,C,CH3,no,N,2,,76475,17884,ACE
3,,SING,C,H,no,N,3,,76475,17884,ACE
4,,SING,CH3,H1,no,N,4,,76475,17884,ACE
5,,SING,CH3,H2,no,N,5,,76475,17884,ACE
6,,SING,CH3,H3,no,N,6,,76475,17884,ACE
1,,DOUB,P,OP1,no,N,1,,76499,17885,2LA
2,,SING,P,OP2,no,N,2,,76499,17885,2LA
3,,SING,P,O5',no,N,3,,76499,17885,2LA
4,,SING,N1,C2,no,N,4,,76499,17885,2LA
5,,SING,N1,C6,no,N,5,,76499,17885,2LA
6,,SING,N1,H1N1,no,N,6,,76499,17885,2LA
7,,SING,C2,N2,no,N,7,,76499,17885,2LA
8,,DOUB,C2,N3,no,N,8,,76499,17885,2LA
9,,SING,N2,HN2,no,N,9,,76499,17885,2LA
10,,SING,N2,HN2A,no,N,10,,76499,17885,2LA
11,,SING,N3,C4,no,N,11,,76499,17885,2LA
12,,DOUB,C4,C5,yes,N,12,,76499,17885,2LA
13,,SING,C4,N9,yes,N,13,,76499,17885,2LA
14,,SING,C5,C6,no,N,14,,76499,17885,2LA
15,,SING,C5,C7,yes,N,15,,76499,17885,2LA
16,,DOUB,C6,O6,no,N,16,,76499,17885,2LA
17,,DOUB,C7,C8,yes,N,17,,76499,17885,2LA
18,,SING,C7,C10,no,N,18,,76499,17885,2LA
19,,SING,C8,N9,yes,N,19,,76499,17885,2LA
20,,SING,C8,H8,no,N,20,,76499,17885,2LA
21,,SING,N9,C1',no,N,21,,76499,17885,2LA
22,,SING,C1',C2',no,N,22,,76499,17885,2LA
23,,SING,C1',O4',no,N,23,,76499,17885,2LA
24,,SING,C1',H1',no,N,24,,76499,17885,2LA
25,,SING,C10,N11,no,N,25,,76499,17885,2LA
26,,SING,C10,H10,no,N,26,,76499,17885,2LA
27,,SING,C10,H10A,no,N,27,,76499,17885,2LA
28,,SING,N11,HN11,no,N,28,,76499,17885,2LA
29,,SING,N11,HN1A,no,N,29,,76499,17885,2LA
30,,SING,C2',C3',no,N,30,,76499,17885,2LA
31,,SING,C2',H12',no,N,31,,76499,17885,2LA
32,,SING,C2',H22',no,N,32,,76499,17885,2LA
33,,SING,C3',O3',no,N,33,,76499,17885,2LA
34,,SING,C3',C4',no,N,34,,76499,17885,2LA
35,,SING,C3',H3',no,N,35,,76499,17885,2LA
36,,SING,C4',O4',no,N,36,,76499,17885,2LA
37,,SING,C4',C5',no,N,37,,76499,17885,2LA
38,,SING,C4',H4',no,N,38,,76499,17885,2LA
39,,SING,C5',O5',no,N,39,,76499,17885,2LA
40,,SING,C5',H15',no,N,40,,76499,17885,2LA
41,,SING,C5',H25',no,N,41,,76499,17885,2LA
42,,SING,P,OP3,no,N,42,,76499,17885,2LA
43,,SING,OP2,HOP2,no,N,43,,76499,17885,2LA
44,,SING,O3',HO3',no,N,44,,76499,17885,2LA
45,,SING,OP3,HOP3,no,N,45,,76499,17885,2LA
1,,SING,O23,P24,no,N,1,,76517,17886,PNS
2,,SING,O23,HOP1,no,N,2,,76517,17886,PNS
3,,SING,P24,O25,no,N,3,,76517,17886,PNS
4,,DOUB,P24,O26,no,N,4,,76517,17886,PNS
5,,SING,P24,O27,no,N,5,,76517,17886,PNS
6,,SING,O25,HOP2,no,N,6,,76517,17886,PNS
7,,SING,O27,C28,no,N,7,,76517,17886,PNS
8,,SING,C28,C29,no,N,8,,76517,17886,PNS
9,,SING,C28,H282,no,N,9,,76517,17886,PNS
10,,SING,C28,H281,no,N,10,,76517,17886,PNS
11,,SING,C29,C30,no,N,11,,76517,17886,PNS
12,,SING,C29,C31,no,N,12,,76517,17886,PNS
13,,SING,C29,C32,no,N,13,,76517,17886,PNS
14,,SING,C30,H303,no,N,14,,76517,17886,PNS
15,,SING,C30,H302,no,N,15,,76517,17886,PNS
16,,SING,C30,H301,no,N,16,,76517,17886,PNS
17,,SING,C31,H313,no,N,17,,76517,17886,PNS
18,,SING,C31,H312,no,N,18,,76517,17886,PNS
19,,SING,C31,H311,no,N,19,,76517,17886,PNS
20,,SING,C32,O33,no,N,20,,76517,17886,PNS
21,,SING,C32,C34,no,N,21,,76517,17886,PNS
22,,SING,C32,H32,no,N,22,,76517,17886,PNS
23,,SING,O33,H33,no,N,23,,76517,17886,PNS
24,,DOUB,C34,O35,no,N,24,,76517,17886,PNS
25,,SING,C34,N36,no,N,25,,76517,17886,PNS
26,,SING,N36,C37,no,N,26,,76517,17886,PNS
27,,SING,N36,H36,no,N,27,,76517,17886,PNS
28,,SING,C37,C38,no,N,28,,76517,17886,PNS
29,,SING,C37,H372,no,N,29,,76517,17886,PNS
30,,SING,C37,H371,no,N,30,,76517,17886,PNS
31,,SING,C38,C39,no,N,31,,76517,17886,PNS
32,,SING,C38,H382,no,N,32,,76517,17886,PNS
33,,SING,C38,H381,no,N,33,,76517,17886,PNS
34,,DOUB,C39,O40,no,N,34,,76517,17886,PNS
35,,SING,C39,N41,no,N,35,,76517,17886,PNS
36,,SING,N41,C42,no,N,36,,76517,17886,PNS
37,,SING,N41,H41,no,N,37,,76517,17886,PNS
38,,SING,C42,C43,no,N,38,,76517,17886,PNS
39,,SING,C42,H422,no,N,39,,76517,17886,PNS
40,,SING,C42,H421,no,N,40,,76517,17886,PNS
41,,SING,C43,S44,no,N,41,,76517,17886,PNS
42,,SING,C43,H431,no,N,42,,76517,17886,PNS
43,,SING,C43,H432,no,N,43,,76517,17886,PNS
44,,SING,S44,H44,no,N,44,,76517,17886,PNS
1,,SING,C8A,N9A,yes,N,1,,76533,17887,A3A
2,,DOUB,C8A,N7A,yes,N,2,,76533,17887,A3A
3,,SING,C8A,H8A,no,N,3,,76533,17887,A3A
4,,SING,N9A,C4A,yes,N,4,,76533,17887,A3A
5,,SING,N9A,C1',no,N,5,,76533,17887,A3A
6,,DOUB,C4A,C5A,yes,N,6,,76533,17887,A3A
7,,SING,C4A,N3A,yes,N,7,,76533,17887,A3A
8,,SING,C5A,N7A,yes,N,8,,76533,17887,A3A
9,,SING,C5A,C6A,yes,N,9,,76533,17887,A3A
10,,DOUB,N3A,C2A,yes,N,10,,76533,17887,A3A
11,,SING,C2A,N1A,yes,N,11,,76533,17887,A3A
12,,SING,C2A,H2A,no,N,12,,76533,17887,A3A
13,,DOUB,N1A,C6A,yes,N,13,,76533,17887,A3A
14,,SING,C6A,N6A,no,N,14,,76533,17887,A3A
15,,SING,N6A,HN61,no,N,15,,76533,17887,A3A
16,,SING,N6A,HN62,no,N,16,,76533,17887,A3A
17,,DOUB,P,OP1,no,N,17,,76533,17887,A3A
18,,SING,P,OP2,no,N,18,,76533,17887,A3A
19,,SING,P,O6',no,N,19,,76533,17887,A3A
20,,SING,P,O1,no,N,20,,76533,17887,A3A
21,,SING,OP2,H2P,no,N,21,,76533,17887,A3A
22,,SING,O6',C5',no,N,22,,76533,17887,A3A
23,,SING,C5',C4',no,N,23,,76533,17887,A3A
24,,SING,C5',H5',no,N,24,,76533,17887,A3A
25,,SING,C5',H5'',no,N,25,,76533,17887,A3A
26,,SING,C4',O5',no,N,26,,76533,17887,A3A
27,,SING,C4',C3',no,N,27,,76533,17887,A3A
28,,SING,C4',H4',no,N,28,,76533,17887,A3A
29,,SING,O5',C1',no,N,29,,76533,17887,A3A
30,,SING,C3',O3',no,N,30,,76533,17887,A3A
31,,SING,C3',C2',no,N,31,,76533,17887,A3A
32,,SING,C3',H3',no,N,32,,76533,17887,A3A
33,,SING,O3',H1,no,N,33,,76533,17887,A3A
34,,SING,C2',C1',no,N,34,,76533,17887,A3A
35,,SING,C2',H2',no,N,35,,76533,17887,A3A
36,,SING,C2',H2'',no,N,36,,76533,17887,A3A
37,,SING,C1',H1',no,N,37,,76533,17887,A3A
38,,SING,O1,HO1,no,N,38,,76533,17887,A3A
1,,SING,N,CA,no,N,1,,76555,17888,SEP
2,,SING,N,H,no,N,2,,76555,17888,SEP
3,,SING,N,H2,no,N,3,,76555,17888,SEP
4,,SING,CA,CB,no,N,4,,76555,17888,SEP
5,,SING,CA,C,no,N,5,,76555,17888,SEP
6,,SING,CA,HA,no,N,6,,76555,17888,SEP
7,,SING,CB,OG,no,N,7,,76555,17888,SEP
8,,SING,CB,HB2,no,N,8,,76555,17888,SEP
9,,SING,CB,HB3,no,N,9,,76555,17888,SEP
10,,SING,OG,P,no,N,10,,76555,17888,SEP
11,,DOUB,C,O,no,N,11,,76555,17888,SEP
12,,SING,C,OXT,no,N,12,,76555,17888,SEP
13,,SING,OXT,HXT,no,N,13,,76555,17888,SEP
14,,DOUB,P,O1P,no,N,14,,76555,17888,SEP
15,,SING,P,O2P,no,N,15,,76555,17888,SEP
16,,SING,P,O3P,no,N,16,,76555,17888,SEP
17,,SING,O2P,HOP2,no,N,17,,76555,17888,SEP
18,,SING,O3P,HOP3,no,N,18,,76555,17888,SEP
1,,SING,C1,C2,no,N,1,,76585,1789,AAC
2,,SING,C1,O1,no,N,2,,76585,1789,AAC
3,,DOUB,C1,O2,no,N,3,,76585,1789,AAC
4,,SING,C2,N1,no,N,4,,76585,1789,AAC
5,,SING,C2,HC21,no,N,5,,76585,1789,AAC
6,,SING,C2,HC22,no,N,6,,76585,1789,AAC
7,,SING,C3,C4,no,N,7,,76585,1789,AAC
8,,SING,C3,N1,no,N,8,,76585,1789,AAC
9,,DOUB,C3,O3,no,N,9,,76585,1789,AAC
10,,SING,C4,HC41,no,N,10,,76585,1789,AAC
11,,SING,C4,HC42,no,N,11,,76585,1789,AAC
12,,SING,C4,HC43,no,N,12,,76585,1789,AAC
13,,SING,N1,HN1,no,N,13,,76585,1789,AAC
14,,SING,O1,HO1,no,N,14,,76585,1789,AAC
1,,SING,FE,NA,no,N,1,,76586,1789,HEC
2,,SING,FE,NB,no,N,2,,76586,1789,HEC
3,,SING,FE,NC,no,N,3,,76586,1789,HEC
4,,SING,FE,ND,no,N,4,,76586,1789,HEC
5,,DOUB,CHA,C1A,no,N,5,,76586,1789,HEC
6,,SING,CHA,C4D,no,N,6,,76586,1789,HEC
7,,SING,CHA,HHA,no,N,7,,76586,1789,HEC
8,,DOUB,CHB,C4A,no,N,8,,76586,1789,HEC
9,,SING,CHB,C1B,no,N,9,,76586,1789,HEC
10,,SING,CHB,HHB,no,N,10,,76586,1789,HEC
11,,DOUB,CHC,C4B,no,N,11,,76586,1789,HEC
12,,SING,CHC,C1C,no,N,12,,76586,1789,HEC
13,,SING,CHC,HHC,no,N,13,,76586,1789,HEC
14,,DOUB,CHD,C4C,no,N,14,,76586,1789,HEC
15,,SING,CHD,C1D,no,N,15,,76586,1789,HEC
16,,SING,CHD,HHD,no,N,16,,76586,1789,HEC
17,,SING,NA,C1A,yes,N,17,,76586,1789,HEC
18,,SING,NA,C4A,yes,N,18,,76586,1789,HEC
19,,SING,C1A,C2A,yes,N,19,,76586,1789,HEC
20,,DOUB,C2A,C3A,yes,N,20,,76586,1789,HEC
21,,SING,C2A,CAA,no,N,21,,76586,1789,HEC
22,,SING,C3A,C4A,yes,N,22,,76586,1789,HEC
23,,SING,C3A,CMA,no,N,23,,76586,1789,HEC
24,,SING,CMA,HMA1,no,N,24,,76586,1789,HEC
25,,SING,CMA,HMA2,no,N,25,,76586,1789,HEC
26,,SING,CMA,HMA3,no,N,26,,76586,1789,HEC
27,,SING,CAA,CBA,no,N,27,,76586,1789,HEC
28,,SING,CAA,HAA1,no,N,28,,76586,1789,HEC
29,,SING,CAA,HAA2,no,N,29,,76586,1789,HEC
30,,SING,CBA,CGA,no,N,30,,76586,1789,HEC
31,,SING,CBA,HBA1,no,N,31,,76586,1789,HEC
32,,SING,CBA,HBA2,no,N,32,,76586,1789,HEC
33,,DOUB,CGA,O1A,no,N,33,,76586,1789,HEC
34,,SING,CGA,O2A,no,N,34,,76586,1789,HEC
35,,SING,O2A,H2A,no,N,35,,76586,1789,HEC
36,,SING,NB,C1B,yes,N,36,,76586,1789,HEC
37,,SING,NB,C4B,yes,N,37,,76586,1789,HEC
38,,DOUB,C1B,C2B,yes,N,38,,76586,1789,HEC
39,,SING,C2B,C3B,yes,N,39,,76586,1789,HEC
40,,SING,C2B,CMB,no,N,40,,76586,1789,HEC
41,,SING,C3B,C4B,yes,N,41,,76586,1789,HEC
42,,DOUB,C3B,CAB,no,E,42,,76586,1789,HEC
43,,SING,CMB,HMB1,no,N,43,,76586,1789,HEC
44,,SING,CMB,HMB2,no,N,44,,76586,1789,HEC
45,,SING,CMB,HMB3,no,N,45,,76586,1789,HEC
46,,SING,CAB,CBB,no,N,46,,76586,1789,HEC
47,,SING,CAB,HAB,no,N,47,,76586,1789,HEC
48,,SING,CBB,HBB1,no,N,48,,76586,1789,HEC
49,,SING,CBB,HBB2,no,N,49,,76586,1789,HEC
50,,SING,CBB,HBB3,no,N,50,,76586,1789,HEC
51,,SING,NC,C1C,yes,N,51,,76586,1789,HEC
52,,SING,NC,C4C,yes,N,52,,76586,1789,HEC
53,,DOUB,C1C,C2C,yes,N,53,,76586,1789,HEC
54,,SING,C2C,C3C,yes,N,54,,76586,1789,HEC
55,,SING,C2C,CMC,no,N,55,,76586,1789,HEC
56,,SING,C3C,C4C,yes,N,56,,76586,1789,HEC
57,,DOUB,C3C,CAC,no,E,57,,76586,1789,HEC
58,,SING,CMC,HMC1,no,N,58,,76586,1789,HEC
59,,SING,CMC,HMC2,no,N,59,,76586,1789,HEC
60,,SING,CMC,HMC3,no,N,60,,76586,1789,HEC
61,,SING,CAC,CBC,no,N,61,,76586,1789,HEC
62,,SING,CAC,HAC,no,N,62,,76586,1789,HEC
63,,SING,CBC,HBC1,no,N,63,,76586,1789,HEC
64,,SING,CBC,HBC2,no,N,64,,76586,1789,HEC
65,,SING,CBC,HBC3,no,N,65,,76586,1789,HEC
66,,SING,ND,C1D,yes,N,66,,76586,1789,HEC
67,,SING,ND,C4D,yes,N,67,,76586,1789,HEC
68,,DOUB,C1D,C2D,yes,N,68,,76586,1789,HEC
69,,SING,C2D,C3D,yes,N,69,,76586,1789,HEC
70,,SING,C2D,CMD,no,N,70,,76586,1789,HEC
71,,DOUB,C3D,C4D,yes,N,71,,76586,1789,HEC
72,,SING,C3D,CAD,no,N,72,,76586,1789,HEC
73,,SING,CMD,HMD1,no,N,73,,76586,1789,HEC
74,,SING,CMD,HMD2,no,N,74,,76586,1789,HEC
75,,SING,CMD,HMD3,no,N,75,,76586,1789,HEC
76,,SING,CAD,CBD,no,N,76,,76586,1789,HEC
77,,SING,CAD,HAD1,no,N,77,,76586,1789,HEC
78,,SING,CAD,HAD2,no,N,78,,76586,1789,HEC
79,,SING,CBD,CGD,no,N,79,,76586,1789,HEC
80,,SING,CBD,HBD1,no,N,80,,76586,1789,HEC
81,,SING,CBD,HBD2,no,N,81,,76586,1789,HEC
82,,DOUB,CGD,O1D,no,N,82,,76586,1789,HEC
83,,SING,CGD,O2D,no,N,83,,76586,1789,HEC
84,,SING,O2D,H2D,no,N,84,,76586,1789,HEC
1,,SING,C1,C2,no,N,1,,76829,17902,NAG
2,,SING,C1,O1,no,N,2,,76829,17902,NAG
3,,SING,C1,O5,no,N,3,,76829,17902,NAG
4,,SING,C1,H1,no,N,4,,76829,17902,NAG
5,,SING,C2,C3,no,N,5,,76829,17902,NAG
6,,SING,C2,N2,no,N,6,,76829,17902,NAG
7,,SING,C2,H2,no,N,7,,76829,17902,NAG
8,,SING,C3,C4,no,N,8,,76829,17902,NAG
9,,SING,C3,O3,no,N,9,,76829,17902,NAG
10,,SING,C3,H3,no,N,10,,76829,17902,NAG
11,,SING,C4,C5,no,N,11,,76829,17902,NAG
12,,SING,C4,O4,no,N,12,,76829,17902,NAG
13,,SING,C4,H4,no,N,13,,76829,17902,NAG
14,,SING,C5,C6,no,N,14,,76829,17902,NAG
15,,SING,C5,O5,no,N,15,,76829,17902,NAG
16,,SING,C5,H5,no,N,16,,76829,17902,NAG
17,,SING,C6,O6,no,N,17,,76829,17902,NAG
18,,SING,C6,H61,no,N,18,,76829,17902,NAG
19,,SING,C6,H62,no,N,19,,76829,17902,NAG
20,,SING,C7,C8,no,N,20,,76829,17902,NAG
21,,SING,C7,N2,no,N,21,,76829,17902,NAG
22,,DOUB,C7,O7,no,N,22,,76829,17902,NAG
23,,SING,C8,H81,no,N,23,,76829,17902,NAG
24,,SING,C8,H82,no,N,24,,76829,17902,NAG
25,,SING,C8,H83,no,N,25,,76829,17902,NAG
26,,SING,N2,HN2,no,N,26,,76829,17902,NAG
27,,SING,O1,HO1,no,N,27,,76829,17902,NAG
28,,SING,O3,HO3,no,N,28,,76829,17902,NAG
29,,SING,O4,HO4,no,N,29,,76829,17902,NAG
30,,SING,O6,HO6,no,N,30,,76829,17902,NAG
1,,SING,C1,C2,no,N,1,,76830,17902,MAG
2,,SING,C1,O1,no,N,2,,76830,17902,MAG
3,,SING,C1,O5,no,N,3,,76830,17902,MAG
4,,SING,C1,H1,no,N,4,,76830,17902,MAG
5,,SING,C2,C3,no,N,5,,76830,17902,MAG
6,,SING,C2,N2,no,N,6,,76830,17902,MAG
7,,SING,C2,H2,no,N,7,,76830,17902,MAG
8,,SING,C3,C4,no,N,8,,76830,17902,MAG
9,,SING,C3,O3,no,N,9,,76830,17902,MAG
10,,SING,C3,H3,no,N,10,,76830,17902,MAG
11,,SING,C4,C5,no,N,11,,76830,17902,MAG
12,,SING,C4,O4,no,N,12,,76830,17902,MAG
13,,SING,C4,H4,no,N,13,,76830,17902,MAG
14,,SING,C5,C6,no,N,14,,76830,17902,MAG
15,,SING,C5,O5,no,N,15,,76830,17902,MAG
16,,SING,C5,H5,no,N,16,,76830,17902,MAG
17,,SING,C6,O6,no,N,17,,76830,17902,MAG
18,,SING,C6,H61,no,N,18,,76830,17902,MAG
19,,SING,C6,H62,no,N,19,,76830,17902,MAG
20,,SING,C7,C8,no,N,20,,76830,17902,MAG
21,,SING,C7,N2,no,N,21,,76830,17902,MAG
22,,DOUB,C7,O7,no,N,22,,76830,17902,MAG
23,,SING,C8,H81,no,N,23,,76830,17902,MAG
24,,SING,C8,H82,no,N,24,,76830,17902,MAG
25,,SING,C8,H83,no,N,25,,76830,17902,MAG
26,,SING,N2,HN2,no,N,26,,76830,17902,MAG
27,,SING,O1,CM,no,N,27,,76830,17902,MAG
28,,SING,O3,HO3,no,N,28,,76830,17902,MAG
29,,SING,O4,HO4,no,N,29,,76830,17902,MAG
30,,SING,O6,HO6,no,N,30,,76830,17902,MAG
31,,SING,CM,HM1,no,N,31,,76830,17902,MAG
32,,SING,CM,HM2,no,N,32,,76830,17902,MAG
33,,SING,CM,HM3,no,N,33,,76830,17902,MAG
1,,SING,C1,C2,no,N,1,,76831,17902,FUC
2,,SING,C1,O1,no,N,2,,76831,17902,FUC
3,,SING,C1,O5,no,N,3,,76831,17902,FUC
4,,SING,C1,H1,no,N,4,,76831,17902,FUC
5,,SING,C2,C3,no,N,5,,76831,17902,FUC
6,,SING,C2,O2,no,N,6,,76831,17902,FUC
7,,SING,C2,H2,no,N,7,,76831,17902,FUC
8,,SING,C3,C4,no,N,8,,76831,17902,FUC
9,,SING,C3,O3,no,N,9,,76831,17902,FUC
10,,SING,C3,H3,no,N,10,,76831,17902,FUC
11,,SING,C4,C5,no,N,11,,76831,17902,FUC
12,,SING,C4,O4,no,N,12,,76831,17902,FUC
13,,SING,C4,H4,no,N,13,,76831,17902,FUC
14,,SING,C5,C6,no,N,14,,76831,17902,FUC
15,,SING,C5,O5,no,N,15,,76831,17902,FUC
16,,SING,C5,H5,no,N,16,,76831,17902,FUC
17,,SING,C6,H61,no,N,17,,76831,17902,FUC
18,,SING,C6,H62,no,N,18,,76831,17902,FUC
19,,SING,C6,H63,no,N,19,,76831,17902,FUC
20,,SING,O1,HO1,no,N,20,,76831,17902,FUC
21,,SING,O2,HO2,no,N,21,,76831,17902,FUC
22,,SING,O3,HO3,no,N,22,,76831,17902,FUC
23,,SING,O4,HO4,no,N,23,,76831,17902,FUC
1,,SING,FE,NA,no,N,1,,76858,17903,HEC
2,,SING,FE,NB,no,N,2,,76858,17903,HEC
3,,SING,FE,NC,no,N,3,,76858,17903,HEC
4,,SING,FE,ND,no,N,4,,76858,17903,HEC
5,,DOUB,CHA,C1A,no,N,5,,76858,17903,HEC
6,,SING,CHA,C4D,no,N,6,,76858,17903,HEC
7,,SING,CHA,HHA,no,N,7,,76858,17903,HEC
8,,DOUB,CHB,C4A,no,N,8,,76858,17903,HEC
9,,SING,CHB,C1B,no,N,9,,76858,17903,HEC
10,,SING,CHB,HHB,no,N,10,,76858,17903,HEC
11,,DOUB,CHC,C4B,no,N,11,,76858,17903,HEC
12,,SING,CHC,C1C,no,N,12,,76858,17903,HEC
13,,SING,CHC,HHC,no,N,13,,76858,17903,HEC
14,,DOUB,CHD,C4C,no,N,14,,76858,17903,HEC
15,,SING,CHD,C1D,no,N,15,,76858,17903,HEC
16,,SING,CHD,HHD,no,N,16,,76858,17903,HEC
17,,SING,NA,C1A,yes,N,17,,76858,17903,HEC
18,,SING,NA,C4A,yes,N,18,,76858,17903,HEC
19,,SING,C1A,C2A,yes,N,19,,76858,17903,HEC
20,,DOUB,C2A,C3A,yes,N,20,,76858,17903,HEC
21,,SING,C2A,CAA,no,N,21,,76858,17903,HEC
22,,SING,C3A,C4A,yes,N,22,,76858,17903,HEC
23,,SING,C3A,CMA,no,N,23,,76858,17903,HEC
24,,SING,CMA,HMA1,no,N,24,,76858,17903,HEC
25,,SING,CMA,HMA2,no,N,25,,76858,17903,HEC
26,,SING,CMA,HMA3,no,N,26,,76858,17903,HEC
27,,SING,CAA,CBA,no,N,27,,76858,17903,HEC
28,,SING,CAA,HAA1,no,N,28,,76858,17903,HEC
29,,SING,CAA,HAA2,no,N,29,,76858,17903,HEC
30,,SING,CBA,CGA,no,N,30,,76858,17903,HEC
31,,SING,CBA,HBA1,no,N,31,,76858,17903,HEC
32,,SING,CBA,HBA2,no,N,32,,76858,17903,HEC
33,,DOUB,CGA,O1A,no,N,33,,76858,17903,HEC
34,,SING,CGA,O2A,no,N,34,,76858,17903,HEC
35,,SING,O2A,H2A,no,N,35,,76858,17903,HEC
36,,SING,NB,C1B,yes,N,36,,76858,17903,HEC
37,,SING,NB,C4B,yes,N,37,,76858,17903,HEC
38,,DOUB,C1B,C2B,yes,N,38,,76858,17903,HEC
39,,SING,C2B,C3B,yes,N,39,,76858,17903,HEC
40,,SING,C2B,CMB,no,N,40,,76858,17903,HEC
41,,SING,C3B,C4B,yes,N,41,,76858,17903,HEC
42,,DOUB,C3B,CAB,no,E,42,,76858,17903,HEC
43,,SING,CMB,HMB1,no,N,43,,76858,17903,HEC
44,,SING,CMB,HMB2,no,N,44,,76858,17903,HEC
45,,SING,CMB,HMB3,no,N,45,,76858,17903,HEC
46,,SING,CAB,CBB,no,N,46,,76858,17903,HEC
47,,SING,CAB,HAB,no,N,47,,76858,17903,HEC
48,,SING,CBB,HBB1,no,N,48,,76858,17903,HEC
49,,SING,CBB,HBB2,no,N,49,,76858,17903,HEC
50,,SING,CBB,HBB3,no,N,50,,76858,17903,HEC
51,,SING,NC,C1C,yes,N,51,,76858,17903,HEC
52,,SING,NC,C4C,yes,N,52,,76858,17903,HEC
53,,DOUB,C1C,C2C,yes,N,53,,76858,17903,HEC
54,,SING,C2C,C3C,yes,N,54,,76858,17903,HEC
55,,SING,C2C,CMC,no,N,55,,76858,17903,HEC
56,,SING,C3C,C4C,yes,N,56,,76858,17903,HEC
57,,DOUB,C3C,CAC,no,E,57,,76858,17903,HEC
58,,SING,CMC,HMC1,no,N,58,,76858,17903,HEC
59,,SING,CMC,HMC2,no,N,59,,76858,17903,HEC
60,,SING,CMC,HMC3,no,N,60,,76858,17903,HEC
61,,SING,CAC,CBC,no,N,61,,76858,17903,HEC
62,,SING,CAC,HAC,no,N,62,,76858,17903,HEC
63,,SING,CBC,HBC1,no,N,63,,76858,17903,HEC
64,,SING,CBC,HBC2,no,N,64,,76858,17903,HEC
65,,SING,CBC,HBC3,no,N,65,,76858,17903,HEC
66,,SING,ND,C1D,yes,N,66,,76858,17903,HEC
67,,SING,ND,C4D,yes,N,67,,76858,17903,HEC
68,,DOUB,C1D,C2D,yes,N,68,,76858,17903,HEC
69,,SING,C2D,C3D,yes,N,69,,76858,17903,HEC
70,,SING,C2D,CMD,no,N,70,,76858,17903,HEC
71,,DOUB,C3D,C4D,yes,N,71,,76858,17903,HEC
72,,SING,C3D,CAD,no,N,72,,76858,17903,HEC
73,,SING,CMD,HMD1,no,N,73,,76858,17903,HEC
74,,SING,CMD,HMD2,no,N,74,,76858,17903,HEC
75,,SING,CMD,HMD3,no,N,75,,76858,17903,HEC
76,,SING,CAD,CBD,no,N,76,,76858,17903,HEC
77,,SING,CAD,HAD1,no,N,77,,76858,17903,HEC
78,,SING,CAD,HAD2,no,N,78,,76858,17903,HEC
79,,SING,CBD,CGD,no,N,79,,76858,17903,HEC
80,,SING,CBD,HBD1,no,N,80,,76858,17903,HEC
81,,SING,CBD,HBD2,no,N,81,,76858,17903,HEC
82,,DOUB,CGD,O1D,no,N,82,,76858,17903,HEC
83,,SING,CGD,O2D,no,N,83,,76858,17903,HEC
84,,SING,O2D,H2D,no,N,84,,76858,17903,HEC
1,,SING,FE,NA,no,N,1,,76877,17904,HEC
2,,SING,FE,NB,no,N,2,,76877,17904,HEC
3,,SING,FE,NC,no,N,3,,76877,17904,HEC
4,,SING,FE,ND,no,N,4,,76877,17904,HEC
5,,DOUB,CHA,C1A,no,N,5,,76877,17904,HEC
6,,SING,CHA,C4D,no,N,6,,76877,17904,HEC
7,,SING,CHA,HHA,no,N,7,,76877,17904,HEC
8,,DOUB,CHB,C4A,no,N,8,,76877,17904,HEC
9,,SING,CHB,C1B,no,N,9,,76877,17904,HEC
10,,SING,CHB,HHB,no,N,10,,76877,17904,HEC
11,,DOUB,CHC,C4B,no,N,11,,76877,17904,HEC
12,,SING,CHC,C1C,no,N,12,,76877,17904,HEC
13,,SING,CHC,HHC,no,N,13,,76877,17904,HEC
14,,DOUB,CHD,C4C,no,N,14,,76877,17904,HEC
15,,SING,CHD,C1D,no,N,15,,76877,17904,HEC
16,,SING,CHD,HHD,no,N,16,,76877,17904,HEC
17,,SING,NA,C1A,yes,N,17,,76877,17904,HEC
18,,SING,NA,C4A,yes,N,18,,76877,17904,HEC
19,,SING,C1A,C2A,yes,N,19,,76877,17904,HEC
20,,DOUB,C2A,C3A,yes,N,20,,76877,17904,HEC
21,,SING,C2A,CAA,no,N,21,,76877,17904,HEC
22,,SING,C3A,C4A,yes,N,22,,76877,17904,HEC
23,,SING,C3A,CMA,no,N,23,,76877,17904,HEC
24,,SING,CMA,HMA1,no,N,24,,76877,17904,HEC
25,,SING,CMA,HMA2,no,N,25,,76877,17904,HEC
26,,SING,CMA,HMA3,no,N,26,,76877,17904,HEC
27,,SING,CAA,CBA,no,N,27,,76877,17904,HEC
28,,SING,CAA,HAA1,no,N,28,,76877,17904,HEC
29,,SING,CAA,HAA2,no,N,29,,76877,17904,HEC
30,,SING,CBA,CGA,no,N,30,,76877,17904,HEC
31,,SING,CBA,HBA1,no,N,31,,76877,17904,HEC
32,,SING,CBA,HBA2,no,N,32,,76877,17904,HEC
33,,DOUB,CGA,O1A,no,N,33,,76877,17904,HEC
34,,SING,CGA,O2A,no,N,34,,76877,17904,HEC
35,,SING,O2A,H2A,no,N,35,,76877,17904,HEC
36,,SING,NB,C1B,yes,N,36,,76877,17904,HEC
37,,SING,NB,C4B,yes,N,37,,76877,17904,HEC
38,,DOUB,C1B,C2B,yes,N,38,,76877,17904,HEC
39,,SING,C2B,C3B,yes,N,39,,76877,17904,HEC
40,,SING,C2B,CMB,no,N,40,,76877,17904,HEC
41,,SING,C3B,C4B,yes,N,41,,76877,17904,HEC
42,,DOUB,C3B,CAB,no,E,42,,76877,17904,HEC
43,,SING,CMB,HMB1,no,N,43,,76877,17904,HEC
44,,SING,CMB,HMB2,no,N,44,,76877,17904,HEC
45,,SING,CMB,HMB3,no,N,45,,76877,17904,HEC
46,,SING,CAB,CBB,no,N,46,,76877,17904,HEC
47,,SING,CAB,HAB,no,N,47,,76877,17904,HEC
48,,SING,CBB,HBB1,no,N,48,,76877,17904,HEC
49,,SING,CBB,HBB2,no,N,49,,76877,17904,HEC
50,,SING,CBB,HBB3,no,N,50,,76877,17904,HEC
51,,SING,NC,C1C,yes,N,51,,76877,17904,HEC
52,,SING,NC,C4C,yes,N,52,,76877,17904,HEC
53,,DOUB,C1C,C2C,yes,N,53,,76877,17904,HEC
54,,SING,C2C,C3C,yes,N,54,,76877,17904,HEC
55,,SING,C2C,CMC,no,N,55,,76877,17904,HEC
56,,SING,C3C,C4C,yes,N,56,,76877,17904,HEC
57,,DOUB,C3C,CAC,no,E,57,,76877,17904,HEC
58,,SING,CMC,HMC1,no,N,58,,76877,17904,HEC
59,,SING,CMC,HMC2,no,N,59,,76877,17904,HEC
60,,SING,CMC,HMC3,no,N,60,,76877,17904,HEC
61,,SING,CAC,CBC,no,N,61,,76877,17904,HEC
62,,SING,CAC,HAC,no,N,62,,76877,17904,HEC
63,,SING,CBC,HBC1,no,N,63,,76877,17904,HEC
64,,SING,CBC,HBC2,no,N,64,,76877,17904,HEC
65,,SING,CBC,HBC3,no,N,65,,76877,17904,HEC
66,,SING,ND,C1D,yes,N,66,,76877,17904,HEC
67,,SING,ND,C4D,yes,N,67,,76877,17904,HEC
68,,DOUB,C1D,C2D,yes,N,68,,76877,17904,HEC
69,,SING,C2D,C3D,yes,N,69,,76877,17904,HEC
70,,SING,C2D,CMD,no,N,70,,76877,17904,HEC
71,,DOUB,C3D,C4D,yes,N,71,,76877,17904,HEC
72,,SING,C3D,CAD,no,N,72,,76877,17904,HEC
73,,SING,CMD,HMD1,no,N,73,,76877,17904,HEC
74,,SING,CMD,HMD2,no,N,74,,76877,17904,HEC
75,,SING,CMD,HMD3,no,N,75,,76877,17904,HEC
76,,SING,CAD,CBD,no,N,76,,76877,17904,HEC
77,,SING,CAD,HAD1,no,N,77,,76877,17904,HEC
78,,SING,CAD,HAD2,no,N,78,,76877,17904,HEC
79,,SING,CBD,CGD,no,N,79,,76877,17904,HEC
80,,SING,CBD,HBD1,no,N,80,,76877,17904,HEC
81,,SING,CBD,HBD2,no,N,81,,76877,17904,HEC
82,,DOUB,CGD,O1D,no,N,82,,76877,17904,HEC
83,,SING,CGD,O2D,no,N,83,,76877,17904,HEC
84,,SING,O2D,H2D,no,N,84,,76877,17904,HEC
1,,SING,P,OP1,no,N,1,,76933,17907,SRA
2,,DOUB,P,S2P,no,N,2,,76933,17907,SRA
3,,SING,P,OP3,no,N,3,,76933,17907,SRA
4,,SING,P,O5',no,N,4,,76933,17907,SRA
5,,SING,OP1,HOP1,no,N,5,,76933,17907,SRA
6,,SING,OP3,HOP3,no,N,6,,76933,17907,SRA
7,,SING,O5',C5',no,N,7,,76933,17907,SRA
8,,SING,C5',C4',no,N,8,,76933,17907,SRA
9,,SING,C5',H5',no,N,9,,76933,17907,SRA
10,,SING,C5',H5'',no,N,10,,76933,17907,SRA
11,,SING,C4',O4',no,N,11,,76933,17907,SRA
12,,SING,C4',C3',no,N,12,,76933,17907,SRA
13,,SING,C4',H4',no,N,13,,76933,17907,SRA
14,,SING,O4',C1',no,N,14,,76933,17907,SRA
15,,SING,C3',O3',no,N,15,,76933,17907,SRA
16,,SING,C3',C2',no,N,16,,76933,17907,SRA
17,,SING,C3',H3',no,N,17,,76933,17907,SRA
18,,SING,O3',HO3',no,N,18,,76933,17907,SRA
19,,SING,C2',C1',no,N,19,,76933,17907,SRA
20,,SING,C2',O2',no,N,20,,76933,17907,SRA
21,,SING,C2',H2',no,N,21,,76933,17907,SRA
22,,SING,C1',N9,no,N,22,,76933,17907,SRA
23,,SING,C1',H1',no,N,23,,76933,17907,SRA
24,,SING,N9,C8,yes,N,24,,76933,17907,SRA
25,,SING,N9,C4,yes,N,25,,76933,17907,SRA
26,,DOUB,C8,N7,yes,N,26,,76933,17907,SRA
27,,SING,C8,H8,no,N,27,,76933,17907,SRA
28,,SING,N7,C5,yes,N,28,,76933,17907,SRA
29,,SING,C5,C6,yes,N,29,,76933,17907,SRA
30,,DOUB,C5,C4,yes,N,30,,76933,17907,SRA
31,,SING,C6,N6,no,N,31,,76933,17907,SRA
32,,DOUB,C6,N1,yes,N,32,,76933,17907,SRA
33,,SING,N6,HN61,no,N,33,,76933,17907,SRA
34,,SING,N6,HN62,no,N,34,,76933,17907,SRA
35,,SING,N1,C2,yes,N,35,,76933,17907,SRA
36,,DOUB,C2,N3,yes,N,36,,76933,17907,SRA
37,,SING,C2,H2,no,N,37,,76933,17907,SRA
38,,SING,N3,C4,yes,N,38,,76933,17907,SRA
39,,SING,O2',HO2',no,N,39,,76933,17907,SRA
1,,SING,O23,P24,no,N,1,,76934,17907,PNS
2,,SING,O23,HOP1,no,N,2,,76934,17907,PNS
3,,SING,P24,O25,no,N,3,,76934,17907,PNS
4,,DOUB,P24,O26,no,N,4,,76934,17907,PNS
5,,SING,P24,O27,no,N,5,,76934,17907,PNS
6,,SING,O25,HOP2,no,N,6,,76934,17907,PNS
7,,SING,O27,C28,no,N,7,,76934,17907,PNS
8,,SING,C28,C29,no,N,8,,76934,17907,PNS
9,,SING,C28,H282,no,N,9,,76934,17907,PNS
10,,SING,C28,H281,no,N,10,,76934,17907,PNS
11,,SING,C29,C30,no,N,11,,76934,17907,PNS
12,,SING,C29,C31,no,N,12,,76934,17907,PNS
13,,SING,C29,C32,no,N,13,,76934,17907,PNS
14,,SING,C30,H303,no,N,14,,76934,17907,PNS
15,,SING,C30,H302,no,N,15,,76934,17907,PNS
16,,SING,C30,H301,no,N,16,,76934,17907,PNS
17,,SING,C31,H313,no,N,17,,76934,17907,PNS
18,,SING,C31,H312,no,N,18,,76934,17907,PNS
19,,SING,C31,H311,no,N,19,,76934,17907,PNS
20,,SING,C32,O33,no,N,20,,76934,17907,PNS
21,,SING,C32,C34,no,N,21,,76934,17907,PNS
22,,SING,C32,H32,no,N,22,,76934,17907,PNS
23,,SING,O33,H33,no,N,23,,76934,17907,PNS
24,,DOUB,C34,O35,no,N,24,,76934,17907,PNS
25,,SING,C34,N36,no,N,25,,76934,17907,PNS
26,,SING,N36,C37,no,N,26,,76934,17907,PNS
27,,SING,N36,H36,no,N,27,,76934,17907,PNS
28,,SING,C37,C38,no,N,28,,76934,17907,PNS
29,,SING,C37,H372,no,N,29,,76934,17907,PNS
30,,SING,C37,H371,no,N,30,,76934,17907,PNS
31,,SING,C38,C39,no,N,31,,76934,17907,PNS
32,,SING,C38,H382,no,N,32,,76934,17907,PNS
33,,SING,C38,H381,no,N,33,,76934,17907,PNS
34,,DOUB,C39,O40,no,N,34,,76934,17907,PNS
35,,SING,C39,N41,no,N,35,,76934,17907,PNS
36,,SING,N41,C42,no,N,36,,76934,17907,PNS
37,,SING,N41,H41,no,N,37,,76934,17907,PNS
38,,SING,C42,C43,no,N,38,,76934,17907,PNS
39,,SING,C42,H422,no,N,39,,76934,17907,PNS
40,,SING,C42,H421,no,N,40,,76934,17907,PNS
41,,SING,C43,S44,no,N,41,,76934,17907,PNS
42,,SING,C43,H431,no,N,42,,76934,17907,PNS
43,,SING,C43,H432,no,N,43,,76934,17907,PNS
44,,SING,S44,H44,no,N,44,,76934,17907,PNS
1,,SING,C1,C2,no,N,1,,76935,17907,MAH
2,,SING,C1,O1,no,N,2,,76935,17907,MAH
3,,DOUB,C1,O2,no,N,3,,76935,17907,MAH
4,,SING,C2,C3,no,N,4,,76935,17907,MAH
5,,SING,C2,H21,no,N,5,,76935,17907,MAH
6,,SING,C2,H22,no,N,6,,76935,17907,MAH
7,,SING,C3,C4,no,N,7,,76935,17907,MAH
8,,SING,C3,C6,no,N,8,,76935,17907,MAH
9,,SING,C3,O7,no,N,9,,76935,17907,MAH
10,,SING,C4,C5,no,N,10,,76935,17907,MAH
11,,SING,C4,H41,no,N,11,,76935,17907,MAH
12,,SING,C4,H42,no,N,12,,76935,17907,MAH
13,,DOUB,C5,O3,no,N,13,,76935,17907,MAH
14,,SING,C5,O4,no,N,14,,76935,17907,MAH
15,,SING,C6,H61,no,N,15,,76935,17907,MAH
16,,SING,C6,H62,no,N,16,,76935,17907,MAH
17,,SING,C6,H63,no,N,17,,76935,17907,MAH
18,,SING,O1,HO1,no,N,18,,76935,17907,MAH
19,,SING,O4,HO4,no,N,19,,76935,17907,MAH
20,,SING,O7,HO7,no,N,20,,76935,17907,MAH
1,,SING,FE,NA,no,N,1,,76987,1791,HEC
2,,SING,FE,NB,no,N,2,,76987,1791,HEC
3,,SING,FE,NC,no,N,3,,76987,1791,HEC
4,,SING,FE,ND,no,N,4,,76987,1791,HEC
5,,DOUB,CHA,C1A,no,N,5,,76987,1791,HEC
6,,SING,CHA,C4D,no,N,6,,76987,1791,HEC
7,,SING,CHA,HHA,no,N,7,,76987,1791,HEC
8,,DOUB,CHB,C4A,no,N,8,,76987,1791,HEC
9,,SING,CHB,C1B,no,N,9,,76987,1791,HEC
10,,SING,CHB,HHB,no,N,10,,76987,1791,HEC
11,,DOUB,CHC,C4B,no,N,11,,76987,1791,HEC
12,,SING,CHC,C1C,no,N,12,,76987,1791,HEC
13,,SING,CHC,HHC,no,N,13,,76987,1791,HEC
14,,DOUB,CHD,C4C,no,N,14,,76987,1791,HEC
15,,SING,CHD,C1D,no,N,15,,76987,1791,HEC
16,,SING,CHD,HHD,no,N,16,,76987,1791,HEC
17,,SING,NA,C1A,yes,N,17,,76987,1791,HEC
18,,SING,NA,C4A,yes,N,18,,76987,1791,HEC
19,,SING,C1A,C2A,yes,N,19,,76987,1791,HEC
20,,DOUB,C2A,C3A,yes,N,20,,76987,1791,HEC
21,,SING,C2A,CAA,no,N,21,,76987,1791,HEC
22,,SING,C3A,C4A,yes,N,22,,76987,1791,HEC
23,,SING,C3A,CMA,no,N,23,,76987,1791,HEC
24,,SING,CMA,HMA1,no,N,24,,76987,1791,HEC
25,,SING,CMA,HMA2,no,N,25,,76987,1791,HEC
26,,SING,CMA,HMA3,no,N,26,,76987,1791,HEC
27,,SING,CAA,CBA,no,N,27,,76987,1791,HEC
28,,SING,CAA,HAA1,no,N,28,,76987,1791,HEC
29,,SING,CAA,HAA2,no,N,29,,76987,1791,HEC
30,,SING,CBA,CGA,no,N,30,,76987,1791,HEC
31,,SING,CBA,HBA1,no,N,31,,76987,1791,HEC
32,,SING,CBA,HBA2,no,N,32,,76987,1791,HEC
33,,DOUB,CGA,O1A,no,N,33,,76987,1791,HEC
34,,SING,CGA,O2A,no,N,34,,76987,1791,HEC
35,,SING,O2A,H2A,no,N,35,,76987,1791,HEC
36,,SING,NB,C1B,yes,N,36,,76987,1791,HEC
37,,SING,NB,C4B,yes,N,37,,76987,1791,HEC
38,,DOUB,C1B,C2B,yes,N,38,,76987,1791,HEC
39,,SING,C2B,C3B,yes,N,39,,76987,1791,HEC
40,,SING,C2B,CMB,no,N,40,,76987,1791,HEC
41,,SING,C3B,C4B,yes,N,41,,76987,1791,HEC
42,,DOUB,C3B,CAB,no,E,42,,76987,1791,HEC
43,,SING,CMB,HMB1,no,N,43,,76987,1791,HEC
44,,SING,CMB,HMB2,no,N,44,,76987,1791,HEC
45,,SING,CMB,HMB3,no,N,45,,76987,1791,HEC
46,,SING,CAB,CBB,no,N,46,,76987,1791,HEC
47,,SING,CAB,HAB,no,N,47,,76987,1791,HEC
48,,SING,CBB,HBB1,no,N,48,,76987,1791,HEC
49,,SING,CBB,HBB2,no,N,49,,76987,1791,HEC
50,,SING,CBB,HBB3,no,N,50,,76987,1791,HEC
51,,SING,NC,C1C,yes,N,51,,76987,1791,HEC
52,,SING,NC,C4C,yes,N,52,,76987,1791,HEC
53,,DOUB,C1C,C2C,yes,N,53,,76987,1791,HEC
54,,SING,C2C,C3C,yes,N,54,,76987,1791,HEC
55,,SING,C2C,CMC,no,N,55,,76987,1791,HEC
56,,SING,C3C,C4C,yes,N,56,,76987,1791,HEC
57,,DOUB,C3C,CAC,no,E,57,,76987,1791,HEC
58,,SING,CMC,HMC1,no,N,58,,76987,1791,HEC
59,,SING,CMC,HMC2,no,N,59,,76987,1791,HEC
60,,SING,CMC,HMC3,no,N,60,,76987,1791,HEC
61,,SING,CAC,CBC,no,N,61,,76987,1791,HEC
62,,SING,CAC,HAC,no,N,62,,76987,1791,HEC
63,,SING,CBC,HBC1,no,N,63,,76987,1791,HEC
64,,SING,CBC,HBC2,no,N,64,,76987,1791,HEC
65,,SING,CBC,HBC3,no,N,65,,76987,1791,HEC
66,,SING,ND,C1D,yes,N,66,,76987,1791,HEC
67,,SING,ND,C4D,yes,N,67,,76987,1791,HEC
68,,DOUB,C1D,C2D,yes,N,68,,76987,1791,HEC
69,,SING,C2D,C3D,yes,N,69,,76987,1791,HEC
70,,SING,C2D,CMD,no,N,70,,76987,1791,HEC
71,,DOUB,C3D,C4D,yes,N,71,,76987,1791,HEC
72,,SING,C3D,CAD,no,N,72,,76987,1791,HEC
73,,SING,CMD,HMD1,no,N,73,,76987,1791,HEC
74,,SING,CMD,HMD2,no,N,74,,76987,1791,HEC
75,,SING,CMD,HMD3,no,N,75,,76987,1791,HEC
76,,SING,CAD,CBD,no,N,76,,76987,1791,HEC
77,,SING,CAD,HAD1,no,N,77,,76987,1791,HEC
78,,SING,CAD,HAD2,no,N,78,,76987,1791,HEC
79,,SING,CBD,CGD,no,N,79,,76987,1791,HEC
80,,SING,CBD,HBD1,no,N,80,,76987,1791,HEC
81,,SING,CBD,HBD2,no,N,81,,76987,1791,HEC
82,,DOUB,CGD,O1D,no,N,82,,76987,1791,HEC
83,,SING,CGD,O2D,no,N,83,,76987,1791,HEC
84,,SING,O2D,H2D,no,N,84,,76987,1791,HEC
1,,SING,N,CA,no,N,1,,76988,1791,M3L
2,,SING,N,H,no,N,2,,76988,1791,M3L
3,,SING,N,H2,no,N,3,,76988,1791,M3L
4,,SING,CA,CB,no,N,4,,76988,1791,M3L
5,,SING,CA,C,no,N,5,,76988,1791,M3L
6,,SING,CA,HA,no,N,6,,76988,1791,M3L
7,,SING,CB,CG,no,N,7,,76988,1791,M3L
8,,SING,CB,HB2,no,N,8,,76988,1791,M3L
9,,SING,CB,HB3,no,N,9,,76988,1791,M3L
10,,SING,CG,CD,no,N,10,,76988,1791,M3L
11,,SING,CG,HG2,no,N,11,,76988,1791,M3L
12,,SING,CG,HG3,no,N,12,,76988,1791,M3L
13,,SING,CD,CE,no,N,13,,76988,1791,M3L
14,,SING,CD,HD2,no,N,14,,76988,1791,M3L
15,,SING,CD,HD3,no,N,15,,76988,1791,M3L
16,,SING,CE,NZ,no,N,16,,76988,1791,M3L
17,,SING,CE,HE2,no,N,17,,76988,1791,M3L
18,,SING,CE,HE3,no,N,18,,76988,1791,M3L
19,,SING,NZ,CM1,no,N,19,,76988,1791,M3L
20,,SING,NZ,CM2,no,N,20,,76988,1791,M3L
21,,SING,NZ,CM3,no,N,21,,76988,1791,M3L
22,,DOUB,C,O,no,N,22,,76988,1791,M3L
23,,SING,C,OXT,no,N,23,,76988,1791,M3L
24,,SING,OXT,HXT,no,N,24,,76988,1791,M3L
25,,SING,CM1,HM11,no,N,25,,76988,1791,M3L
26,,SING,CM1,HM12,no,N,26,,76988,1791,M3L
27,,SING,CM1,HM13,no,N,27,,76988,1791,M3L
28,,SING,CM2,HM21,no,N,28,,76988,1791,M3L
29,,SING,CM2,HM22,no,N,29,,76988,1791,M3L
30,,SING,CM2,HM23,no,N,30,,76988,1791,M3L
31,,SING,CM3,HM31,no,N,31,,76988,1791,M3L
32,,SING,CM3,HM32,no,N,32,,76988,1791,M3L
33,,SING,CM3,HM33,no,N,33,,76988,1791,M3L
1,,SING,N,C1,no,N,1,,77067,17914,ANI
2,,SING,N,HN1,no,N,2,,77067,17914,ANI
3,,SING,N,HN2,no,N,3,,77067,17914,ANI
4,,DOUB,C1,C2,yes,N,4,,77067,17914,ANI
5,,SING,C1,C6,yes,N,5,,77067,17914,ANI
6,,SING,C2,C3,yes,N,6,,77067,17914,ANI
7,,SING,C2,H2,no,N,7,,77067,17914,ANI
8,,DOUB,C3,C4,yes,N,8,,77067,17914,ANI
9,,SING,C3,H3,no,N,9,,77067,17914,ANI
10,,SING,C4,C5,yes,N,10,,77067,17914,ANI
11,,SING,C4,C7,no,N,11,,77067,17914,ANI
12,,DOUB,C5,C6,yes,N,12,,77067,17914,ANI
13,,SING,C5,H5,no,N,13,,77067,17914,ANI
14,,SING,C6,H6,no,N,14,,77067,17914,ANI
15,,SING,C7,F1,no,N,15,,77067,17914,ANI
16,,SING,C7,F2,no,N,16,,77067,17914,ANI
17,,SING,C7,F3,no,N,17,,77067,17914,ANI
1,,SING,C22,C20,no,N,1,,77085,17915,LL5
2,,SING,C22,H22,no,N,2,,77085,17915,LL5
3,,SING,C22,H22A,no,N,3,,77085,17915,LL5
4,,SING,C22,H22B,no,N,4,,77085,17915,LL5
5,,SING,C20,C19,no,N,5,,77085,17915,LL5
6,,SING,C20,C21,no,N,6,,77085,17915,LL5
7,,SING,C20,H20,no,N,7,,77085,17915,LL5
8,,SING,C21,H21,no,N,8,,77085,17915,LL5
9,,SING,C21,H21A,no,N,9,,77085,17915,LL5
10,,SING,C21,H21B,no,N,10,,77085,17915,LL5
11,,SING,C7,C19,no,N,11,,77085,17915,LL5
12,,SING,N33,C19,no,N,12,,77085,17915,LL5
13,,SING,C19,H19,no,N,13,,77085,17915,LL5
14,,SING,N33,HN33,no,N,14,,77085,17915,LL5
15,,SING,N33,HN3A,no,N,15,,77085,17915,LL5
16,,DOUB,O32,C7,no,N,16,,77085,17915,LL5
17,,SING,C7,N1,no,N,17,,77085,17915,LL5
18,,SING,C6,N1,no,N,18,,77085,17915,LL5
19,,SING,N1,C2,no,N,19,,77085,17915,LL5
20,,SING,C3,C2,no,N,20,,77085,17915,LL5
21,,SING,C2,H2,no,N,21,,77085,17915,LL5
22,,SING,C2,H2A,no,N,22,,77085,17915,LL5
23,,SING,C4,C3,no,N,23,,77085,17915,LL5
24,,SING,C3,H3,no,N,24,,77085,17915,LL5
25,,SING,C3,H3A,no,N,25,,77085,17915,LL5
26,,SING,C5,C6,no,N,26,,77085,17915,LL5
27,,SING,C6,H6,no,N,27,,77085,17915,LL5
28,,SING,C6,H6A,no,N,28,,77085,17915,LL5
29,,SING,C5,C4,no,N,29,,77085,17915,LL5
30,,SING,C5,H5,no,N,30,,77085,17915,LL5
31,,SING,C5,H5A,no,N,31,,77085,17915,LL5
32,,SING,C14,C4,no,N,32,,77085,17915,LL5
33,,SING,C4,H4,no,N,33,,77085,17915,LL5
34,,SING,O26,C14,yes,N,34,,77085,17915,LL5
35,,DOUB,C14,N23,yes,N,35,,77085,17915,LL5
36,,SING,C24,N23,yes,N,36,,77085,17915,LL5
37,,SING,N25,O26,yes,N,37,,77085,17915,LL5
38,,DOUB,N25,C24,yes,N,38,,77085,17915,LL5
39,,SING,C24,C27,yes,N,39,,77085,17915,LL5
40,,SING,S28,C27,yes,N,40,,77085,17915,LL5
41,,DOUB,C27,C31,yes,N,41,,77085,17915,LL5
42,,SING,C30,C31,yes,N,42,,77085,17915,LL5
43,,SING,C31,H31,no,N,43,,77085,17915,LL5
44,,DOUB,C29,C30,yes,N,44,,77085,17915,LL5
45,,SING,C30,H30,no,N,45,,77085,17915,LL5
46,,SING,S28,C29,yes,N,46,,77085,17915,LL5
47,,SING,C29,H29,no,N,47,,77085,17915,LL5
1,,SING,CA,CB,no,N,1,,77329,17929,RIM
2,,SING,CA,HA1,no,N,2,,77329,17929,RIM
3,,SING,CA,HA2,no,N,3,,77329,17929,RIM
4,,SING,CA,HA3,no,N,4,,77329,17929,RIM
5,,SING,CB,CD,no,N,5,,77329,17929,RIM
6,,SING,CB,NC,no,N,6,,77329,17929,RIM
7,,SING,CB,HB,no,N,7,,77329,17929,RIM
8,,SING,NC,HNC1,no,N,8,,77329,17929,RIM
9,,SING,NC,HNC2,no,N,9,,77329,17929,RIM
10,,SING,CD,CE2,no,N,10,,77329,17929,RIM
11,,SING,CD,CE1,no,N,11,,77329,17929,RIM
12,,SING,CD,CE3,no,N,12,,77329,17929,RIM
13,,SING,CE1,CF1,no,N,13,,77329,17929,RIM
14,,SING,CE1,HE11,no,N,14,,77329,17929,RIM
15,,SING,CE1,HE12,no,N,15,,77329,17929,RIM
16,,SING,CE2,CF2,no,N,16,,77329,17929,RIM
17,,SING,CE2,HE21,no,N,17,,77329,17929,RIM
18,,SING,CE2,HE22,no,N,18,,77329,17929,RIM
19,,SING,CE3,CF3,no,N,19,,77329,17929,RIM
20,,SING,CE3,HE31,no,N,20,,77329,17929,RIM
21,,SING,CE3,HE32,no,N,21,,77329,17929,RIM
22,,SING,CF1,CG1,no,N,22,,77329,17929,RIM
23,,SING,CF1,CG3,no,N,23,,77329,17929,RIM
24,,SING,CF1,HF1,no,N,24,,77329,17929,RIM
25,,SING,CF2,CG1,no,N,25,,77329,17929,RIM
26,,SING,CF2,CG2,no,N,26,,77329,17929,RIM
27,,SING,CF2,HF2,no,N,27,,77329,17929,RIM
28,,SING,CF3,CG2,no,N,28,,77329,17929,RIM
29,,SING,CF3,CG3,no,N,29,,77329,17929,RIM
30,,SING,CF3,HF3,no,N,30,,77329,17929,RIM
31,,SING,CG1,HG11,no,N,31,,77329,17929,RIM
32,,SING,CG1,HG12,no,N,32,,77329,17929,RIM
33,,SING,CG2,HG21,no,N,33,,77329,17929,RIM
34,,SING,CG2,HG22,no,N,34,,77329,17929,RIM
35,,SING,CG3,HG31,no,N,35,,77329,17929,RIM
36,,SING,CG3,HG32,no,N,36,,77329,17929,RIM
1,,SING,FE,NA,no,N,1,,77352,1793,HEC
2,,SING,FE,NB,no,N,2,,77352,1793,HEC
3,,SING,FE,NC,no,N,3,,77352,1793,HEC
4,,SING,FE,ND,no,N,4,,77352,1793,HEC
5,,DOUB,CHA,C1A,no,N,5,,77352,1793,HEC
6,,SING,CHA,C4D,no,N,6,,77352,1793,HEC
7,,SING,CHA,HHA,no,N,7,,77352,1793,HEC
8,,DOUB,CHB,C4A,no,N,8,,77352,1793,HEC
9,,SING,CHB,C1B,no,N,9,,77352,1793,HEC
10,,SING,CHB,HHB,no,N,10,,77352,1793,HEC
11,,DOUB,CHC,C4B,no,N,11,,77352,1793,HEC
12,,SING,CHC,C1C,no,N,12,,77352,1793,HEC
13,,SING,CHC,HHC,no,N,13,,77352,1793,HEC
14,,DOUB,CHD,C4C,no,N,14,,77352,1793,HEC
15,,SING,CHD,C1D,no,N,15,,77352,1793,HEC
16,,SING,CHD,HHD,no,N,16,,77352,1793,HEC
17,,SING,NA,C1A,yes,N,17,,77352,1793,HEC
18,,SING,NA,C4A,yes,N,18,,77352,1793,HEC
19,,SING,C1A,C2A,yes,N,19,,77352,1793,HEC
20,,DOUB,C2A,C3A,yes,N,20,,77352,1793,HEC
21,,SING,C2A,CAA,no,N,21,,77352,1793,HEC
22,,SING,C3A,C4A,yes,N,22,,77352,1793,HEC
23,,SING,C3A,CMA,no,N,23,,77352,1793,HEC
24,,SING,CMA,HMA1,no,N,24,,77352,1793,HEC
25,,SING,CMA,HMA2,no,N,25,,77352,1793,HEC
26,,SING,CMA,HMA3,no,N,26,,77352,1793,HEC
27,,SING,CAA,CBA,no,N,27,,77352,1793,HEC
28,,SING,CAA,HAA1,no,N,28,,77352,1793,HEC
29,,SING,CAA,HAA2,no,N,29,,77352,1793,HEC
30,,SING,CBA,CGA,no,N,30,,77352,1793,HEC
31,,SING,CBA,HBA1,no,N,31,,77352,1793,HEC
32,,SING,CBA,HBA2,no,N,32,,77352,1793,HEC
33,,DOUB,CGA,O1A,no,N,33,,77352,1793,HEC
34,,SING,CGA,O2A,no,N,34,,77352,1793,HEC
35,,SING,O2A,H2A,no,N,35,,77352,1793,HEC
36,,SING,NB,C1B,yes,N,36,,77352,1793,HEC
37,,SING,NB,C4B,yes,N,37,,77352,1793,HEC
38,,DOUB,C1B,C2B,yes,N,38,,77352,1793,HEC
39,,SING,C2B,C3B,yes,N,39,,77352,1793,HEC
40,,SING,C2B,CMB,no,N,40,,77352,1793,HEC
41,,SING,C3B,C4B,yes,N,41,,77352,1793,HEC
42,,DOUB,C3B,CAB,no,E,42,,77352,1793,HEC
43,,SING,CMB,HMB1,no,N,43,,77352,1793,HEC
44,,SING,CMB,HMB2,no,N,44,,77352,1793,HEC
45,,SING,CMB,HMB3,no,N,45,,77352,1793,HEC
46,,SING,CAB,CBB,no,N,46,,77352,1793,HEC
47,,SING,CAB,HAB,no,N,47,,77352,1793,HEC
48,,SING,CBB,HBB1,no,N,48,,77352,1793,HEC
49,,SING,CBB,HBB2,no,N,49,,77352,1793,HEC
50,,SING,CBB,HBB3,no,N,50,,77352,1793,HEC
51,,SING,NC,C1C,yes,N,51,,77352,1793,HEC
52,,SING,NC,C4C,yes,N,52,,77352,1793,HEC
53,,DOUB,C1C,C2C,yes,N,53,,77352,1793,HEC
54,,SING,C2C,C3C,yes,N,54,,77352,1793,HEC
55,,SING,C2C,CMC,no,N,55,,77352,1793,HEC
56,,SING,C3C,C4C,yes,N,56,,77352,1793,HEC
57,,DOUB,C3C,CAC,no,E,57,,77352,1793,HEC
58,,SING,CMC,HMC1,no,N,58,,77352,1793,HEC
59,,SING,CMC,HMC2,no,N,59,,77352,1793,HEC
60,,SING,CMC,HMC3,no,N,60,,77352,1793,HEC
61,,SING,CAC,CBC,no,N,61,,77352,1793,HEC
62,,SING,CAC,HAC,no,N,62,,77352,1793,HEC
63,,SING,CBC,HBC1,no,N,63,,77352,1793,HEC
64,,SING,CBC,HBC2,no,N,64,,77352,1793,HEC
65,,SING,CBC,HBC3,no,N,65,,77352,1793,HEC
66,,SING,ND,C1D,yes,N,66,,77352,1793,HEC
67,,SING,ND,C4D,yes,N,67,,77352,1793,HEC
68,,DOUB,C1D,C2D,yes,N,68,,77352,1793,HEC
69,,SING,C2D,C3D,yes,N,69,,77352,1793,HEC
70,,SING,C2D,CMD,no,N,70,,77352,1793,HEC
71,,DOUB,C3D,C4D,yes,N,71,,77352,1793,HEC
72,,SING,C3D,CAD,no,N,72,,77352,1793,HEC
73,,SING,CMD,HMD1,no,N,73,,77352,1793,HEC
74,,SING,CMD,HMD2,no,N,74,,77352,1793,HEC
75,,SING,CMD,HMD3,no,N,75,,77352,1793,HEC
76,,SING,CAD,CBD,no,N,76,,77352,1793,HEC
77,,SING,CAD,HAD1,no,N,77,,77352,1793,HEC
78,,SING,CAD,HAD2,no,N,78,,77352,1793,HEC
79,,SING,CBD,CGD,no,N,79,,77352,1793,HEC
80,,SING,CBD,HBD1,no,N,80,,77352,1793,HEC
81,,SING,CBD,HBD2,no,N,81,,77352,1793,HEC
82,,DOUB,CGD,O1D,no,N,82,,77352,1793,HEC
83,,SING,CGD,O2D,no,N,83,,77352,1793,HEC
84,,SING,O2D,H2D,no,N,84,,77352,1793,HEC
1,,SING,N,CA,no,N,1,,77353,1793,M3L
2,,SING,N,H,no,N,2,,77353,1793,M3L
3,,SING,N,H2,no,N,3,,77353,1793,M3L
4,,SING,CA,CB,no,N,4,,77353,1793,M3L
5,,SING,CA,C,no,N,5,,77353,1793,M3L
6,,SING,CA,HA,no,N,6,,77353,1793,M3L
7,,SING,CB,CG,no,N,7,,77353,1793,M3L
8,,SING,CB,HB2,no,N,8,,77353,1793,M3L
9,,SING,CB,HB3,no,N,9,,77353,1793,M3L
10,,SING,CG,CD,no,N,10,,77353,1793,M3L
11,,SING,CG,HG2,no,N,11,,77353,1793,M3L
12,,SING,CG,HG3,no,N,12,,77353,1793,M3L
13,,SING,CD,CE,no,N,13,,77353,1793,M3L
14,,SING,CD,HD2,no,N,14,,77353,1793,M3L
15,,SING,CD,HD3,no,N,15,,77353,1793,M3L
16,,SING,CE,NZ,no,N,16,,77353,1793,M3L
17,,SING,CE,HE2,no,N,17,,77353,1793,M3L
18,,SING,CE,HE3,no,N,18,,77353,1793,M3L
19,,SING,NZ,CM1,no,N,19,,77353,1793,M3L
20,,SING,NZ,CM2,no,N,20,,77353,1793,M3L
21,,SING,NZ,CM3,no,N,21,,77353,1793,M3L
22,,DOUB,C,O,no,N,22,,77353,1793,M3L
23,,SING,C,OXT,no,N,23,,77353,1793,M3L
24,,SING,OXT,HXT,no,N,24,,77353,1793,M3L
25,,SING,CM1,HM11,no,N,25,,77353,1793,M3L
26,,SING,CM1,HM12,no,N,26,,77353,1793,M3L
27,,SING,CM1,HM13,no,N,27,,77353,1793,M3L
28,,SING,CM2,HM21,no,N,28,,77353,1793,M3L
29,,SING,CM2,HM22,no,N,29,,77353,1793,M3L
30,,SING,CM2,HM23,no,N,30,,77353,1793,M3L
31,,SING,CM3,HM31,no,N,31,,77353,1793,M3L
32,,SING,CM3,HM32,no,N,32,,77353,1793,M3L
33,,SING,CM3,HM33,no,N,33,,77353,1793,M3L
1,,SING,N,CA,no,N,1,,77367,17930,PTR
2,,SING,N,H,no,N,2,,77367,17930,PTR
3,,SING,N,HN2,no,N,3,,77367,17930,PTR
4,,SING,CA,C,no,N,4,,77367,17930,PTR
5,,SING,CA,CB,no,N,5,,77367,17930,PTR
6,,SING,CA,HA,no,N,6,,77367,17930,PTR
7,,DOUB,C,O,no,N,7,,77367,17930,PTR
8,,SING,C,OXT,no,N,8,,77367,17930,PTR
9,,SING,OXT,HXT,no,N,9,,77367,17930,PTR
10,,SING,CB,CG,no,N,10,,77367,17930,PTR
11,,SING,CB,HB2,no,N,11,,77367,17930,PTR
12,,SING,CB,HB3,no,N,12,,77367,17930,PTR
13,,DOUB,CG,CD1,yes,N,13,,77367,17930,PTR
14,,SING,CG,CD2,yes,N,14,,77367,17930,PTR
15,,SING,CD1,CE1,yes,N,15,,77367,17930,PTR
16,,SING,CD1,HD1,no,N,16,,77367,17930,PTR
17,,DOUB,CD2,CE2,yes,N,17,,77367,17930,PTR
18,,SING,CD2,HD2,no,N,18,,77367,17930,PTR
19,,DOUB,CE1,CZ,yes,N,19,,77367,17930,PTR
20,,SING,CE1,HE1,no,N,20,,77367,17930,PTR
21,,SING,CE2,CZ,yes,N,21,,77367,17930,PTR
22,,SING,CE2,HE2,no,N,22,,77367,17930,PTR
23,,SING,CZ,OH,no,N,23,,77367,17930,PTR
24,,SING,OH,P,no,N,24,,77367,17930,PTR
25,,DOUB,P,O1P,no,N,25,,77367,17930,PTR
26,,SING,P,O2P,no,N,26,,77367,17930,PTR
27,,SING,P,O3P,no,N,27,,77367,17930,PTR
28,,SING,O2P,HO2P,no,N,28,,77367,17930,PTR
29,,SING,O3P,HO3P,no,N,29,,77367,17930,PTR
1,,SING,N,CA,no,N,1,,77385,17931,PTR
2,,SING,N,H,no,N,2,,77385,17931,PTR
3,,SING,N,HN2,no,N,3,,77385,17931,PTR
4,,SING,CA,C,no,N,4,,77385,17931,PTR
5,,SING,CA,CB,no,N,5,,77385,17931,PTR
6,,SING,CA,HA,no,N,6,,77385,17931,PTR
7,,DOUB,C,O,no,N,7,,77385,17931,PTR
8,,SING,C,OXT,no,N,8,,77385,17931,PTR
9,,SING,OXT,HXT,no,N,9,,77385,17931,PTR
10,,SING,CB,CG,no,N,10,,77385,17931,PTR
11,,SING,CB,HB2,no,N,11,,77385,17931,PTR
12,,SING,CB,HB3,no,N,12,,77385,17931,PTR
13,,DOUB,CG,CD1,yes,N,13,,77385,17931,PTR
14,,SING,CG,CD2,yes,N,14,,77385,17931,PTR
15,,SING,CD1,CE1,yes,N,15,,77385,17931,PTR
16,,SING,CD1,HD1,no,N,16,,77385,17931,PTR
17,,DOUB,CD2,CE2,yes,N,17,,77385,17931,PTR
18,,SING,CD2,HD2,no,N,18,,77385,17931,PTR
19,,DOUB,CE1,CZ,yes,N,19,,77385,17931,PTR
20,,SING,CE1,HE1,no,N,20,,77385,17931,PTR
21,,SING,CE2,CZ,yes,N,21,,77385,17931,PTR
22,,SING,CE2,HE2,no,N,22,,77385,17931,PTR
23,,SING,CZ,OH,no,N,23,,77385,17931,PTR
24,,SING,OH,P,no,N,24,,77385,17931,PTR
25,,DOUB,P,O1P,no,N,25,,77385,17931,PTR
26,,SING,P,O2P,no,N,26,,77385,17931,PTR
27,,SING,P,O3P,no,N,27,,77385,17931,PTR
28,,SING,O2P,HO2P,no,N,28,,77385,17931,PTR
29,,SING,O3P,HO3P,no,N,29,,77385,17931,PTR
1,,SING,N,CA,no,N,1,,77404,17932,PTR
2,,SING,N,H,no,N,2,,77404,17932,PTR
3,,SING,N,HN2,no,N,3,,77404,17932,PTR
4,,SING,CA,C,no,N,4,,77404,17932,PTR
5,,SING,CA,CB,no,N,5,,77404,17932,PTR
6,,SING,CA,HA,no,N,6,,77404,17932,PTR
7,,DOUB,C,O,no,N,7,,77404,17932,PTR
8,,SING,C,OXT,no,N,8,,77404,17932,PTR
9,,SING,OXT,HXT,no,N,9,,77404,17932,PTR
10,,SING,CB,CG,no,N,10,,77404,17932,PTR
11,,SING,CB,HB2,no,N,11,,77404,17932,PTR
12,,SING,CB,HB3,no,N,12,,77404,17932,PTR
13,,DOUB,CG,CD1,yes,N,13,,77404,17932,PTR
14,,SING,CG,CD2,yes,N,14,,77404,17932,PTR
15,,SING,CD1,CE1,yes,N,15,,77404,17932,PTR
16,,SING,CD1,HD1,no,N,16,,77404,17932,PTR
17,,DOUB,CD2,CE2,yes,N,17,,77404,17932,PTR
18,,SING,CD2,HD2,no,N,18,,77404,17932,PTR
19,,DOUB,CE1,CZ,yes,N,19,,77404,17932,PTR
20,,SING,CE1,HE1,no,N,20,,77404,17932,PTR
21,,SING,CE2,CZ,yes,N,21,,77404,17932,PTR
22,,SING,CE2,HE2,no,N,22,,77404,17932,PTR
23,,SING,CZ,OH,no,N,23,,77404,17932,PTR
24,,SING,OH,P,no,N,24,,77404,17932,PTR
25,,DOUB,P,O1P,no,N,25,,77404,17932,PTR
26,,SING,P,O2P,no,N,26,,77404,17932,PTR
27,,SING,P,O3P,no,N,27,,77404,17932,PTR
28,,SING,O2P,HO2P,no,N,28,,77404,17932,PTR
29,,SING,O3P,HO3P,no,N,29,,77404,17932,PTR
1,,SING,N,CA,no,N,1,,77563,17942,PCA
2,,SING,N,CD,no,N,2,,77563,17942,PCA
3,,SING,N,H,no,N,3,,77563,17942,PCA
4,,SING,CA,CB,no,N,4,,77563,17942,PCA
5,,SING,CA,C,no,N,5,,77563,17942,PCA
6,,SING,CA,HA,no,N,6,,77563,17942,PCA
7,,SING,CB,CG,no,N,7,,77563,17942,PCA
8,,SING,CB,HB2,no,N,8,,77563,17942,PCA
9,,SING,CB,HB3,no,N,9,,77563,17942,PCA
10,,SING,CG,CD,no,N,10,,77563,17942,PCA
11,,SING,CG,HG2,no,N,11,,77563,17942,PCA
12,,SING,CG,HG3,no,N,12,,77563,17942,PCA
13,,DOUB,CD,OE,no,N,13,,77563,17942,PCA
14,,DOUB,C,O,no,N,14,,77563,17942,PCA
15,,SING,C,OXT,no,N,15,,77563,17942,PCA
16,,SING,OXT,HXT,no,N,16,,77563,17942,PCA
1,,DOUB,PA,O1A,no,N,1,,77636,17946,NAP
2,,SING,PA,O2A,no,N,2,,77636,17946,NAP
3,,SING,PA,O5B,no,N,3,,77636,17946,NAP
4,,SING,PA,O3,no,N,4,,77636,17946,NAP
5,,SING,O2A,HOA2,no,N,5,,77636,17946,NAP
6,,SING,O5B,C5B,no,N,6,,77636,17946,NAP
7,,SING,C5B,C4B,no,N,7,,77636,17946,NAP
8,,SING,C5B,H51A,no,N,8,,77636,17946,NAP
9,,SING,C5B,H52A,no,N,9,,77636,17946,NAP
10,,SING,C4B,O4B,no,N,10,,77636,17946,NAP
11,,SING,C4B,C3B,no,N,11,,77636,17946,NAP
12,,SING,C4B,H4B,no,N,12,,77636,17946,NAP
13,,SING,O4B,C1B,no,N,13,,77636,17946,NAP
14,,SING,C3B,O3B,no,N,14,,77636,17946,NAP
15,,SING,C3B,C2B,no,N,15,,77636,17946,NAP
16,,SING,C3B,H3B,no,N,16,,77636,17946,NAP
17,,SING,O3B,HO3A,no,N,17,,77636,17946,NAP
18,,SING,C2B,O2B,no,N,18,,77636,17946,NAP
19,,SING,C2B,C1B,no,N,19,,77636,17946,NAP
20,,SING,C2B,H2B,no,N,20,,77636,17946,NAP
21,,SING,O2B,P2B,no,N,21,,77636,17946,NAP
22,,SING,C1B,N9A,no,N,22,,77636,17946,NAP
23,,SING,C1B,H1B,no,N,23,,77636,17946,NAP
24,,SING,N9A,C8A,yes,N,24,,77636,17946,NAP
25,,SING,N9A,C4A,yes,N,25,,77636,17946,NAP
26,,DOUB,C8A,N7A,yes,N,26,,77636,17946,NAP
27,,SING,C8A,H8A,no,N,27,,77636,17946,NAP
28,,SING,N7A,C5A,yes,N,28,,77636,17946,NAP
29,,SING,C5A,C6A,yes,N,29,,77636,17946,NAP
30,,DOUB,C5A,C4A,yes,N,30,,77636,17946,NAP
31,,SING,C6A,N6A,no,N,31,,77636,17946,NAP
32,,DOUB,C6A,N1A,yes,N,32,,77636,17946,NAP
33,,SING,N6A,H61A,no,N,33,,77636,17946,NAP
34,,SING,N6A,H62A,no,N,34,,77636,17946,NAP
35,,SING,N1A,C2A,yes,N,35,,77636,17946,NAP
36,,DOUB,C2A,N3A,yes,N,36,,77636,17946,NAP
37,,SING,C2A,H2A,no,N,37,,77636,17946,NAP
38,,SING,N3A,C4A,yes,N,38,,77636,17946,NAP
39,,SING,O3,PN,no,N,39,,77636,17946,NAP
40,,DOUB,PN,O1N,no,N,40,,77636,17946,NAP
41,,SING,PN,O2N,no,N,41,,77636,17946,NAP
42,,SING,PN,O5D,no,N,42,,77636,17946,NAP
43,,SING,O5D,C5D,no,N,43,,77636,17946,NAP
44,,SING,C5D,C4D,no,N,44,,77636,17946,NAP
45,,SING,C5D,H51N,no,N,45,,77636,17946,NAP
46,,SING,C5D,H52N,no,N,46,,77636,17946,NAP
47,,SING,C4D,O4D,no,N,47,,77636,17946,NAP
48,,SING,C4D,C3D,no,N,48,,77636,17946,NAP
49,,SING,C4D,H4D,no,N,49,,77636,17946,NAP
50,,SING,O4D,C1D,no,N,50,,77636,17946,NAP
51,,SING,C3D,O3D,no,N,51,,77636,17946,NAP
52,,SING,C3D,C2D,no,N,52,,77636,17946,NAP
53,,SING,C3D,H3D,no,N,53,,77636,17946,NAP
54,,SING,O3D,HO3N,no,N,54,,77636,17946,NAP
55,,SING,C2D,O2D,no,N,55,,77636,17946,NAP
56,,SING,C2D,C1D,no,N,56,,77636,17946,NAP
57,,SING,C2D,H2D,no,N,57,,77636,17946,NAP
58,,SING,O2D,HO2N,no,N,58,,77636,17946,NAP
59,,SING,C1D,N1N,no,N,59,,77636,17946,NAP
60,,SING,C1D,H1D,no,N,60,,77636,17946,NAP
61,,SING,N1N,C2N,yes,N,61,,77636,17946,NAP
62,,DOUB,N1N,C6N,yes,N,62,,77636,17946,NAP
63,,DOUB,C2N,C3N,yes,N,63,,77636,17946,NAP
64,,SING,C2N,H2N,no,N,64,,77636,17946,NAP
65,,SING,C3N,C7N,no,N,65,,77636,17946,NAP
66,,SING,C3N,C4N,yes,N,66,,77636,17946,NAP
67,,DOUB,C7N,O7N,no,N,67,,77636,17946,NAP
68,,SING,C7N,N7N,no,N,68,,77636,17946,NAP
69,,SING,N7N,H71N,no,N,69,,77636,17946,NAP
70,,SING,N7N,H72N,no,N,70,,77636,17946,NAP
71,,DOUB,C4N,C5N,yes,N,71,,77636,17946,NAP
72,,SING,C4N,H4N,no,N,72,,77636,17946,NAP
73,,SING,C5N,C6N,yes,N,73,,77636,17946,NAP
74,,SING,C5N,H5N,no,N,74,,77636,17946,NAP
75,,SING,C6N,H6N,no,N,75,,77636,17946,NAP
76,,DOUB,P2B,O1X,no,N,76,,77636,17946,NAP
77,,SING,P2B,O2X,no,N,77,,77636,17946,NAP
78,,SING,P2B,O3X,no,N,78,,77636,17946,NAP
79,,SING,O2X,HOP2,no,N,79,,77636,17946,NAP
80,,SING,O3X,HOP3,no,N,80,,77636,17946,NAP
1,,SING,N1,C2,yes,N,1,,77637,17946,FOL
2,,SING,N1,C8A,yes,N,2,,77637,17946,FOL
3,,SING,N1,HN1,no,N,3,,77637,17946,FOL
4,,SING,C2,NA2,no,N,4,,77637,17946,FOL
5,,DOUB,C2,N3,yes,N,5,,77637,17946,FOL
6,,SING,NA2,HN21,no,N,6,,77637,17946,FOL
7,,SING,NA2,HN22,no,N,7,,77637,17946,FOL
8,,SING,N3,C4,yes,N,8,,77637,17946,FOL
9,,DOUB,C4,O4,no,N,9,,77637,17946,FOL
10,,SING,C4,C4A,yes,N,10,,77637,17946,FOL
11,,SING,C4A,N5,yes,N,11,,77637,17946,FOL
12,,DOUB,C4A,C8A,yes,N,12,,77637,17946,FOL
13,,DOUB,N5,C6,yes,N,13,,77637,17946,FOL
14,,SING,C6,C7,yes,N,14,,77637,17946,FOL
15,,SING,C6,C9,no,N,15,,77637,17946,FOL
16,,DOUB,C7,N8,yes,N,16,,77637,17946,FOL
17,,SING,C7,H7,no,N,17,,77637,17946,FOL
18,,SING,N8,C8A,yes,N,18,,77637,17946,FOL
19,,SING,C9,N10,no,N,19,,77637,17946,FOL
20,,SING,C9,H91,no,N,20,,77637,17946,FOL
21,,SING,C9,H92,no,N,21,,77637,17946,FOL
22,,SING,N10,C14,no,N,22,,77637,17946,FOL
23,,SING,N10,HN0,no,N,23,,77637,17946,FOL
24,,DOUB,C11,C12,yes,N,24,,77637,17946,FOL
25,,SING,C11,C16,yes,N,25,,77637,17946,FOL
26,,SING,C11,C,no,N,26,,77637,17946,FOL
27,,SING,C12,C13,yes,N,27,,77637,17946,FOL
28,,SING,C12,H12,no,N,28,,77637,17946,FOL
29,,DOUB,C13,C14,yes,N,29,,77637,17946,FOL
30,,SING,C13,H13,no,N,30,,77637,17946,FOL
31,,SING,C14,C15,yes,N,31,,77637,17946,FOL
32,,DOUB,C15,C16,yes,N,32,,77637,17946,FOL
33,,SING,C15,H15,no,N,33,,77637,17946,FOL
34,,SING,C16,H16,no,N,34,,77637,17946,FOL
35,,DOUB,C,O,no,N,35,,77637,17946,FOL
36,,SING,C,N,no,N,36,,77637,17946,FOL
37,,SING,N,CA,no,N,37,,77637,17946,FOL
38,,SING,N,HN,no,N,38,,77637,17946,FOL
39,,SING,CA,CB,no,N,39,,77637,17946,FOL
40,,SING,CA,CT,no,N,40,,77637,17946,FOL
41,,SING,CA,HA,no,N,41,,77637,17946,FOL
42,,SING,CB,CG,no,N,42,,77637,17946,FOL
43,,SING,CB,HB1,no,N,43,,77637,17946,FOL
44,,SING,CB,HB2,no,N,44,,77637,17946,FOL
45,,SING,CG,CD,no,N,45,,77637,17946,FOL
46,,SING,CG,HG1,no,N,46,,77637,17946,FOL
47,,SING,CG,HG2,no,N,47,,77637,17946,FOL
48,,DOUB,CD,OE1,no,N,48,,77637,17946,FOL
49,,SING,CD,OE2,no,N,49,,77637,17946,FOL
50,,SING,OE2,HOE2,no,N,50,,77637,17946,FOL
51,,DOUB,CT,O1,no,N,51,,77637,17946,FOL
52,,SING,CT,O2,no,N,52,,77637,17946,FOL
53,,SING,O2,HO2,no,N,53,,77637,17946,FOL
1,,SING,FE,NA,no,N,1,,77656,17947,HEB
2,,SING,FE,NB,no,N,2,,77656,17947,HEB
3,,SING,FE,NC,no,N,3,,77656,17947,HEB
4,,SING,FE,ND,no,N,4,,77656,17947,HEB
5,,DOUB,CHA,C1A,yes,N,5,,77656,17947,HEB
6,,SING,CHA,C4D,yes,N,6,,77656,17947,HEB
7,,SING,CHA,HHA,no,N,7,,77656,17947,HEB
8,,DOUB,CHB,C4A,yes,N,8,,77656,17947,HEB
9,,SING,CHB,C1B,yes,N,9,,77656,17947,HEB
10,,SING,CHB,HHB,no,N,10,,77656,17947,HEB
11,,DOUB,CHC,C4B,yes,N,11,,77656,17947,HEB
12,,SING,CHC,C1C,yes,N,12,,77656,17947,HEB
13,,SING,CHC,HHC,no,N,13,,77656,17947,HEB
14,,SING,CHD,C4C,yes,N,14,,77656,17947,HEB
15,,DOUB,CHD,C1D,yes,N,15,,77656,17947,HEB
16,,SING,CHD,HHD,no,N,16,,77656,17947,HEB
17,,SING,NA,C1A,yes,N,17,,77656,17947,HEB
18,,SING,NA,C4A,yes,N,18,,77656,17947,HEB
19,,SING,C1A,C2A,yes,N,19,,77656,17947,HEB
20,,DOUB,C2A,C3A,yes,N,20,,77656,17947,HEB
21,,SING,C2A,CAA,no,N,21,,77656,17947,HEB
22,,SING,C3A,C4A,yes,N,22,,77656,17947,HEB
23,,SING,C3A,CMA,no,N,23,,77656,17947,HEB
24,,SING,CMA,HMA1,no,N,24,,77656,17947,HEB
25,,SING,CMA,HMA2,no,N,25,,77656,17947,HEB
26,,SING,CMA,HMA3,no,N,26,,77656,17947,HEB
27,,SING,CAA,CBA,no,N,27,,77656,17947,HEB
28,,SING,CAA,HAA1,no,N,28,,77656,17947,HEB
29,,SING,CAA,HAA2,no,N,29,,77656,17947,HEB
30,,SING,CBA,CGA,no,N,30,,77656,17947,HEB
31,,SING,CBA,HBA1,no,N,31,,77656,17947,HEB
32,,SING,CBA,HBA2,no,N,32,,77656,17947,HEB
33,,DOUB,CGA,O1A,no,N,33,,77656,17947,HEB
34,,SING,CGA,O2A,no,N,34,,77656,17947,HEB
35,,SING,O2A,H2A,no,N,35,,77656,17947,HEB
36,,DOUB,NB,C1B,yes,N,36,,77656,17947,HEB
37,,SING,NB,C4B,yes,N,37,,77656,17947,HEB
38,,SING,C1B,C2B,no,N,38,,77656,17947,HEB
39,,DOUB,C2B,C3B,no,N,39,,77656,17947,HEB
40,,SING,C2B,CMB,no,N,40,,77656,17947,HEB
41,,SING,C3B,C4B,no,N,41,,77656,17947,HEB
42,,SING,C3B,CAB,no,N,42,,77656,17947,HEB
43,,SING,CMB,HMB1,no,N,43,,77656,17947,HEB
44,,SING,CMB,HMB2,no,N,44,,77656,17947,HEB
45,,SING,CMB,HMB3,no,N,45,,77656,17947,HEB
46,,SING,CAB,CBB,no,N,46,,77656,17947,HEB
47,,SING,CAB,HAB,no,N,47,,77656,17947,HEB
48,,SING,CAB,HAB2,no,N,48,,77656,17947,HEB
49,,SING,CBB,HBB1,no,N,49,,77656,17947,HEB
50,,SING,CBB,HBB2,no,N,50,,77656,17947,HEB
51,,SING,CBB,HBB3,no,N,51,,77656,17947,HEB
52,,SING,NC,C1C,yes,N,52,,77656,17947,HEB
53,,SING,NC,C4C,yes,N,53,,77656,17947,HEB
54,,DOUB,C1C,C2C,yes,N,54,,77656,17947,HEB
55,,SING,C2C,C3C,yes,N,55,,77656,17947,HEB
56,,SING,C2C,CMC,no,N,56,,77656,17947,HEB
57,,DOUB,C3C,C4C,yes,N,57,,77656,17947,HEB
58,,SING,C3C,CAC,no,N,58,,77656,17947,HEB
59,,SING,CMC,HMC1,no,N,59,,77656,17947,HEB
60,,SING,CMC,HMC2,no,N,60,,77656,17947,HEB
61,,SING,CMC,HMC3,no,N,61,,77656,17947,HEB
62,,DOUB,CAC,CBC,no,N,62,,77656,17947,HEB
63,,SING,CAC,HAC,no,N,63,,77656,17947,HEB
64,,SING,CBC,HBC1,no,N,64,,77656,17947,HEB
65,,SING,CBC,HBC2,no,N,65,,77656,17947,HEB
66,,SING,ND,C1D,yes,N,66,,77656,17947,HEB
67,,DOUB,ND,C4D,yes,N,67,,77656,17947,HEB
68,,SING,C1D,C2D,no,N,68,,77656,17947,HEB
69,,DOUB,C2D,C3D,no,N,69,,77656,17947,HEB
70,,SING,C2D,CMD,no,N,70,,77656,17947,HEB
71,,SING,C3D,C4D,no,N,71,,77656,17947,HEB
72,,SING,C3D,CAD,no,N,72,,77656,17947,HEB
73,,SING,CMD,HMD1,no,N,73,,77656,17947,HEB
74,,SING,CMD,HMD2,no,N,74,,77656,17947,HEB
75,,SING,CMD,HMD3,no,N,75,,77656,17947,HEB
76,,SING,CAD,CBD,no,N,76,,77656,17947,HEB
77,,SING,CAD,HAD1,no,N,77,,77656,17947,HEB
78,,SING,CAD,HAD2,no,N,78,,77656,17947,HEB
79,,SING,CBD,CGD,no,N,79,,77656,17947,HEB
80,,SING,CBD,HBD1,no,N,80,,77656,17947,HEB
81,,SING,CBD,HBD2,no,N,81,,77656,17947,HEB
82,,DOUB,CGD,O1D,no,N,82,,77656,17947,HEB
83,,SING,CGD,O2D,no,N,83,,77656,17947,HEB
84,,SING,O2D,H2D,no,N,84,,77656,17947,HEB
1,,SING,FE,NA,no,N,1,,77713,1795,HEC
2,,SING,FE,NB,no,N,2,,77713,1795,HEC
3,,SING,FE,NC,no,N,3,,77713,1795,HEC
4,,SING,FE,ND,no,N,4,,77713,1795,HEC
5,,DOUB,CHA,C1A,no,N,5,,77713,1795,HEC
6,,SING,CHA,C4D,no,N,6,,77713,1795,HEC
7,,SING,CHA,HHA,no,N,7,,77713,1795,HEC
8,,DOUB,CHB,C4A,no,N,8,,77713,1795,HEC
9,,SING,CHB,C1B,no,N,9,,77713,1795,HEC
10,,SING,CHB,HHB,no,N,10,,77713,1795,HEC
11,,DOUB,CHC,C4B,no,N,11,,77713,1795,HEC
12,,SING,CHC,C1C,no,N,12,,77713,1795,HEC
13,,SING,CHC,HHC,no,N,13,,77713,1795,HEC
14,,DOUB,CHD,C4C,no,N,14,,77713,1795,HEC
15,,SING,CHD,C1D,no,N,15,,77713,1795,HEC
16,,SING,CHD,HHD,no,N,16,,77713,1795,HEC
17,,SING,NA,C1A,yes,N,17,,77713,1795,HEC
18,,SING,NA,C4A,yes,N,18,,77713,1795,HEC
19,,SING,C1A,C2A,yes,N,19,,77713,1795,HEC
20,,DOUB,C2A,C3A,yes,N,20,,77713,1795,HEC
21,,SING,C2A,CAA,no,N,21,,77713,1795,HEC
22,,SING,C3A,C4A,yes,N,22,,77713,1795,HEC
23,,SING,C3A,CMA,no,N,23,,77713,1795,HEC
24,,SING,CMA,HMA1,no,N,24,,77713,1795,HEC
25,,SING,CMA,HMA2,no,N,25,,77713,1795,HEC
26,,SING,CMA,HMA3,no,N,26,,77713,1795,HEC
27,,SING,CAA,CBA,no,N,27,,77713,1795,HEC
28,,SING,CAA,HAA1,no,N,28,,77713,1795,HEC
29,,SING,CAA,HAA2,no,N,29,,77713,1795,HEC
30,,SING,CBA,CGA,no,N,30,,77713,1795,HEC
31,,SING,CBA,HBA1,no,N,31,,77713,1795,HEC
32,,SING,CBA,HBA2,no,N,32,,77713,1795,HEC
33,,DOUB,CGA,O1A,no,N,33,,77713,1795,HEC
34,,SING,CGA,O2A,no,N,34,,77713,1795,HEC
35,,SING,O2A,H2A,no,N,35,,77713,1795,HEC
36,,SING,NB,C1B,yes,N,36,,77713,1795,HEC
37,,SING,NB,C4B,yes,N,37,,77713,1795,HEC
38,,DOUB,C1B,C2B,yes,N,38,,77713,1795,HEC
39,,SING,C2B,C3B,yes,N,39,,77713,1795,HEC
40,,SING,C2B,CMB,no,N,40,,77713,1795,HEC
41,,SING,C3B,C4B,yes,N,41,,77713,1795,HEC
42,,DOUB,C3B,CAB,no,E,42,,77713,1795,HEC
43,,SING,CMB,HMB1,no,N,43,,77713,1795,HEC
44,,SING,CMB,HMB2,no,N,44,,77713,1795,HEC
45,,SING,CMB,HMB3,no,N,45,,77713,1795,HEC
46,,SING,CAB,CBB,no,N,46,,77713,1795,HEC
47,,SING,CAB,HAB,no,N,47,,77713,1795,HEC
48,,SING,CBB,HBB1,no,N,48,,77713,1795,HEC
49,,SING,CBB,HBB2,no,N,49,,77713,1795,HEC
50,,SING,CBB,HBB3,no,N,50,,77713,1795,HEC
51,,SING,NC,C1C,yes,N,51,,77713,1795,HEC
52,,SING,NC,C4C,yes,N,52,,77713,1795,HEC
53,,DOUB,C1C,C2C,yes,N,53,,77713,1795,HEC
54,,SING,C2C,C3C,yes,N,54,,77713,1795,HEC
55,,SING,C2C,CMC,no,N,55,,77713,1795,HEC
56,,SING,C3C,C4C,yes,N,56,,77713,1795,HEC
57,,DOUB,C3C,CAC,no,E,57,,77713,1795,HEC
58,,SING,CMC,HMC1,no,N,58,,77713,1795,HEC
59,,SING,CMC,HMC2,no,N,59,,77713,1795,HEC
60,,SING,CMC,HMC3,no,N,60,,77713,1795,HEC
61,,SING,CAC,CBC,no,N,61,,77713,1795,HEC
62,,SING,CAC,HAC,no,N,62,,77713,1795,HEC
63,,SING,CBC,HBC1,no,N,63,,77713,1795,HEC
64,,SING,CBC,HBC2,no,N,64,,77713,1795,HEC
65,,SING,CBC,HBC3,no,N,65,,77713,1795,HEC
66,,SING,ND,C1D,yes,N,66,,77713,1795,HEC
67,,SING,ND,C4D,yes,N,67,,77713,1795,HEC
68,,DOUB,C1D,C2D,yes,N,68,,77713,1795,HEC
69,,SING,C2D,C3D,yes,N,69,,77713,1795,HEC
70,,SING,C2D,CMD,no,N,70,,77713,1795,HEC
71,,DOUB,C3D,C4D,yes,N,71,,77713,1795,HEC
72,,SING,C3D,CAD,no,N,72,,77713,1795,HEC
73,,SING,CMD,HMD1,no,N,73,,77713,1795,HEC
74,,SING,CMD,HMD2,no,N,74,,77713,1795,HEC
75,,SING,CMD,HMD3,no,N,75,,77713,1795,HEC
76,,SING,CAD,CBD,no,N,76,,77713,1795,HEC
77,,SING,CAD,HAD1,no,N,77,,77713,1795,HEC
78,,SING,CAD,HAD2,no,N,78,,77713,1795,HEC
79,,SING,CBD,CGD,no,N,79,,77713,1795,HEC
80,,SING,CBD,HBD1,no,N,80,,77713,1795,HEC
81,,SING,CBD,HBD2,no,N,81,,77713,1795,HEC
82,,DOUB,CGD,O1D,no,N,82,,77713,1795,HEC
83,,SING,CGD,O2D,no,N,83,,77713,1795,HEC
84,,SING,O2D,H2D,no,N,84,,77713,1795,HEC
1,,SING,N,CA,no,N,1,,77714,1795,M3L
2,,SING,N,H,no,N,2,,77714,1795,M3L
3,,SING,N,H2,no,N,3,,77714,1795,M3L
4,,SING,CA,CB,no,N,4,,77714,1795,M3L
5,,SING,CA,C,no,N,5,,77714,1795,M3L
6,,SING,CA,HA,no,N,6,,77714,1795,M3L
7,,SING,CB,CG,no,N,7,,77714,1795,M3L
8,,SING,CB,HB2,no,N,8,,77714,1795,M3L
9,,SING,CB,HB3,no,N,9,,77714,1795,M3L
10,,SING,CG,CD,no,N,10,,77714,1795,M3L
11,,SING,CG,HG2,no,N,11,,77714,1795,M3L
12,,SING,CG,HG3,no,N,12,,77714,1795,M3L
13,,SING,CD,CE,no,N,13,,77714,1795,M3L
14,,SING,CD,HD2,no,N,14,,77714,1795,M3L
15,,SING,CD,HD3,no,N,15,,77714,1795,M3L
16,,SING,CE,NZ,no,N,16,,77714,1795,M3L
17,,SING,CE,HE2,no,N,17,,77714,1795,M3L
18,,SING,CE,HE3,no,N,18,,77714,1795,M3L
19,,SING,NZ,CM1,no,N,19,,77714,1795,M3L
20,,SING,NZ,CM2,no,N,20,,77714,1795,M3L
21,,SING,NZ,CM3,no,N,21,,77714,1795,M3L
22,,DOUB,C,O,no,N,22,,77714,1795,M3L
23,,SING,C,OXT,no,N,23,,77714,1795,M3L
24,,SING,OXT,HXT,no,N,24,,77714,1795,M3L
25,,SING,CM1,HM11,no,N,25,,77714,1795,M3L
26,,SING,CM1,HM12,no,N,26,,77714,1795,M3L
27,,SING,CM1,HM13,no,N,27,,77714,1795,M3L
28,,SING,CM2,HM21,no,N,28,,77714,1795,M3L
29,,SING,CM2,HM22,no,N,29,,77714,1795,M3L
30,,SING,CM2,HM23,no,N,30,,77714,1795,M3L
31,,SING,CM3,HM31,no,N,31,,77714,1795,M3L
32,,SING,CM3,HM32,no,N,32,,77714,1795,M3L
33,,SING,CM3,HM33,no,N,33,,77714,1795,M3L
1,,SING,N,CA,no,N,1,,77794,17956,PCA
2,,SING,N,CD,no,N,2,,77794,17956,PCA
3,,SING,N,H,no,N,3,,77794,17956,PCA
4,,SING,CA,CB,no,N,4,,77794,17956,PCA
5,,SING,CA,C,no,N,5,,77794,17956,PCA
6,,SING,CA,HA,no,N,6,,77794,17956,PCA
7,,SING,CB,CG,no,N,7,,77794,17956,PCA
8,,SING,CB,HB2,no,N,8,,77794,17956,PCA
9,,SING,CB,HB3,no,N,9,,77794,17956,PCA
10,,SING,CG,CD,no,N,10,,77794,17956,PCA
11,,SING,CG,HG2,no,N,11,,77794,17956,PCA
12,,SING,CG,HG3,no,N,12,,77794,17956,PCA
13,,DOUB,CD,OE,no,N,13,,77794,17956,PCA
14,,DOUB,C,O,no,N,14,,77794,17956,PCA
15,,SING,C,OXT,no,N,15,,77794,17956,PCA
16,,SING,OXT,HXT,no,N,16,,77794,17956,PCA
1,,DOUB,C,O,no,N,1,,78054,17969,ACE
2,,SING,C,CH3,no,N,2,,78054,17969,ACE
3,,SING,C,H,no,N,3,,78054,17969,ACE
4,,SING,CH3,H1,no,N,4,,78054,17969,ACE
5,,SING,CH3,H2,no,N,5,,78054,17969,ACE
6,,SING,CH3,H3,no,N,6,,78054,17969,ACE
1,,SING,N,HN1,no,N,1,,78055,17969,NH2
2,,SING,N,HN2,no,N,2,,78055,17969,NH2
1,,SING,FE,NA,no,N,1,,78073,1797,HEC
2,,SING,FE,NB,no,N,2,,78073,1797,HEC
3,,SING,FE,NC,no,N,3,,78073,1797,HEC
4,,SING,FE,ND,no,N,4,,78073,1797,HEC
5,,DOUB,CHA,C1A,no,N,5,,78073,1797,HEC
6,,SING,CHA,C4D,no,N,6,,78073,1797,HEC
7,,SING,CHA,HHA,no,N,7,,78073,1797,HEC
8,,DOUB,CHB,C4A,no,N,8,,78073,1797,HEC
9,,SING,CHB,C1B,no,N,9,,78073,1797,HEC
10,,SING,CHB,HHB,no,N,10,,78073,1797,HEC
11,,DOUB,CHC,C4B,no,N,11,,78073,1797,HEC
12,,SING,CHC,C1C,no,N,12,,78073,1797,HEC
13,,SING,CHC,HHC,no,N,13,,78073,1797,HEC
14,,DOUB,CHD,C4C,no,N,14,,78073,1797,HEC
15,,SING,CHD,C1D,no,N,15,,78073,1797,HEC
16,,SING,CHD,HHD,no,N,16,,78073,1797,HEC
17,,SING,NA,C1A,yes,N,17,,78073,1797,HEC
18,,SING,NA,C4A,yes,N,18,,78073,1797,HEC
19,,SING,C1A,C2A,yes,N,19,,78073,1797,HEC
20,,DOUB,C2A,C3A,yes,N,20,,78073,1797,HEC
21,,SING,C2A,CAA,no,N,21,,78073,1797,HEC
22,,SING,C3A,C4A,yes,N,22,,78073,1797,HEC
23,,SING,C3A,CMA,no,N,23,,78073,1797,HEC
24,,SING,CMA,HMA1,no,N,24,,78073,1797,HEC
25,,SING,CMA,HMA2,no,N,25,,78073,1797,HEC
26,,SING,CMA,HMA3,no,N,26,,78073,1797,HEC
27,,SING,CAA,CBA,no,N,27,,78073,1797,HEC
28,,SING,CAA,HAA1,no,N,28,,78073,1797,HEC
29,,SING,CAA,HAA2,no,N,29,,78073,1797,HEC
30,,SING,CBA,CGA,no,N,30,,78073,1797,HEC
31,,SING,CBA,HBA1,no,N,31,,78073,1797,HEC
32,,SING,CBA,HBA2,no,N,32,,78073,1797,HEC
33,,DOUB,CGA,O1A,no,N,33,,78073,1797,HEC
34,,SING,CGA,O2A,no,N,34,,78073,1797,HEC
35,,SING,O2A,H2A,no,N,35,,78073,1797,HEC
36,,SING,NB,C1B,yes,N,36,,78073,1797,HEC
37,,SING,NB,C4B,yes,N,37,,78073,1797,HEC
38,,DOUB,C1B,C2B,yes,N,38,,78073,1797,HEC
39,,SING,C2B,C3B,yes,N,39,,78073,1797,HEC
40,,SING,C2B,CMB,no,N,40,,78073,1797,HEC
41,,SING,C3B,C4B,yes,N,41,,78073,1797,HEC
42,,DOUB,C3B,CAB,no,E,42,,78073,1797,HEC
43,,SING,CMB,HMB1,no,N,43,,78073,1797,HEC
44,,SING,CMB,HMB2,no,N,44,,78073,1797,HEC
45,,SING,CMB,HMB3,no,N,45,,78073,1797,HEC
46,,SING,CAB,CBB,no,N,46,,78073,1797,HEC
47,,SING,CAB,HAB,no,N,47,,78073,1797,HEC
48,,SING,CBB,HBB1,no,N,48,,78073,1797,HEC
49,,SING,CBB,HBB2,no,N,49,,78073,1797,HEC
50,,SING,CBB,HBB3,no,N,50,,78073,1797,HEC
51,,SING,NC,C1C,yes,N,51,,78073,1797,HEC
52,,SING,NC,C4C,yes,N,52,,78073,1797,HEC
53,,DOUB,C1C,C2C,yes,N,53,,78073,1797,HEC
54,,SING,C2C,C3C,yes,N,54,,78073,1797,HEC
55,,SING,C2C,CMC,no,N,55,,78073,1797,HEC
56,,SING,C3C,C4C,yes,N,56,,78073,1797,HEC
57,,DOUB,C3C,CAC,no,E,57,,78073,1797,HEC
58,,SING,CMC,HMC1,no,N,58,,78073,1797,HEC
59,,SING,CMC,HMC2,no,N,59,,78073,1797,HEC
60,,SING,CMC,HMC3,no,N,60,,78073,1797,HEC
61,,SING,CAC,CBC,no,N,61,,78073,1797,HEC
62,,SING,CAC,HAC,no,N,62,,78073,1797,HEC
63,,SING,CBC,HBC1,no,N,63,,78073,1797,HEC
64,,SING,CBC,HBC2,no,N,64,,78073,1797,HEC
65,,SING,CBC,HBC3,no,N,65,,78073,1797,HEC
66,,SING,ND,C1D,yes,N,66,,78073,1797,HEC
67,,SING,ND,C4D,yes,N,67,,78073,1797,HEC
68,,DOUB,C1D,C2D,yes,N,68,,78073,1797,HEC
69,,SING,C2D,C3D,yes,N,69,,78073,1797,HEC
70,,SING,C2D,CMD,no,N,70,,78073,1797,HEC
71,,DOUB,C3D,C4D,yes,N,71,,78073,1797,HEC
72,,SING,C3D,CAD,no,N,72,,78073,1797,HEC
73,,SING,CMD,HMD1,no,N,73,,78073,1797,HEC
74,,SING,CMD,HMD2,no,N,74,,78073,1797,HEC
75,,SING,CMD,HMD3,no,N,75,,78073,1797,HEC
76,,SING,CAD,CBD,no,N,76,,78073,1797,HEC
77,,SING,CAD,HAD1,no,N,77,,78073,1797,HEC
78,,SING,CAD,HAD2,no,N,78,,78073,1797,HEC
79,,SING,CBD,CGD,no,N,79,,78073,1797,HEC
80,,SING,CBD,HBD1,no,N,80,,78073,1797,HEC
81,,SING,CBD,HBD2,no,N,81,,78073,1797,HEC
82,,DOUB,CGD,O1D,no,N,82,,78073,1797,HEC
83,,SING,CGD,O2D,no,N,83,,78073,1797,HEC
84,,SING,O2D,H2D,no,N,84,,78073,1797,HEC
1,,SING,N,CA,no,N,1,,78074,1797,M3L
2,,SING,N,H,no,N,2,,78074,1797,M3L
3,,SING,N,H2,no,N,3,,78074,1797,M3L
4,,SING,CA,CB,no,N,4,,78074,1797,M3L
5,,SING,CA,C,no,N,5,,78074,1797,M3L
6,,SING,CA,HA,no,N,6,,78074,1797,M3L
7,,SING,CB,CG,no,N,7,,78074,1797,M3L
8,,SING,CB,HB2,no,N,8,,78074,1797,M3L
9,,SING,CB,HB3,no,N,9,,78074,1797,M3L
10,,SING,CG,CD,no,N,10,,78074,1797,M3L
11,,SING,CG,HG2,no,N,11,,78074,1797,M3L
12,,SING,CG,HG3,no,N,12,,78074,1797,M3L
13,,SING,CD,CE,no,N,13,,78074,1797,M3L
14,,SING,CD,HD2,no,N,14,,78074,1797,M3L
15,,SING,CD,HD3,no,N,15,,78074,1797,M3L
16,,SING,CE,NZ,no,N,16,,78074,1797,M3L
17,,SING,CE,HE2,no,N,17,,78074,1797,M3L
18,,SING,CE,HE3,no,N,18,,78074,1797,M3L
19,,SING,NZ,CM1,no,N,19,,78074,1797,M3L
20,,SING,NZ,CM2,no,N,20,,78074,1797,M3L
21,,SING,NZ,CM3,no,N,21,,78074,1797,M3L
22,,DOUB,C,O,no,N,22,,78074,1797,M3L
23,,SING,C,OXT,no,N,23,,78074,1797,M3L
24,,SING,OXT,HXT,no,N,24,,78074,1797,M3L
25,,SING,CM1,HM11,no,N,25,,78074,1797,M3L
26,,SING,CM1,HM12,no,N,26,,78074,1797,M3L
27,,SING,CM1,HM13,no,N,27,,78074,1797,M3L
28,,SING,CM2,HM21,no,N,28,,78074,1797,M3L
29,,SING,CM2,HM22,no,N,29,,78074,1797,M3L
30,,SING,CM2,HM23,no,N,30,,78074,1797,M3L
31,,SING,CM3,HM31,no,N,31,,78074,1797,M3L
32,,SING,CM3,HM32,no,N,32,,78074,1797,M3L
33,,SING,CM3,HM33,no,N,33,,78074,1797,M3L
1,,DOUB,C,O,no,N,1,,78090,17970,ACE
2,,SING,C,CH3,no,N,2,,78090,17970,ACE
3,,SING,C,H,no,N,3,,78090,17970,ACE
4,,SING,CH3,H1,no,N,4,,78090,17970,ACE
5,,SING,CH3,H2,no,N,5,,78090,17970,ACE
6,,SING,CH3,H3,no,N,6,,78090,17970,ACE
1,,SING,N,HN1,no,N,1,,78091,17970,NH2
2,,SING,N,HN2,no,N,2,,78091,17970,NH2
1,,SING,H1,C1,no,N,1,,78092,17970,AQN
2,,DOUB,C1,C14,yes,N,2,,78092,17970,AQN
3,,SING,C1,C2,yes,N,3,,78092,17970,AQN
4,,SING,C3,C2,no,N,4,,78092,17970,AQN
5,,DOUB,C2,C11,yes,N,5,,78092,17970,AQN
6,,DOUB,O3,C3,no,N,6,,78092,17970,AQN
7,,SING,C3,C4,no,N,7,,78092,17970,AQN
8,,DOUB,C5,C4,yes,N,8,,78092,17970,AQN
9,,SING,C4,C9,yes,N,9,,78092,17970,AQN
10,,SING,H5,C5,no,N,10,,78092,17970,AQN
11,,SING,C5,C6,yes,N,11,,78092,17970,AQN
12,,SING,H6,C6,no,N,12,,78092,17970,AQN
13,,DOUB,C6,C7,yes,N,13,,78092,17970,AQN
14,,SING,C7,H7,no,N,14,,78092,17970,AQN
15,,SING,C7,C8,yes,N,15,,78092,17970,AQN
16,,DOUB,C9,C8,yes,N,16,,78092,17970,AQN
17,,SING,C8,H8,no,N,17,,78092,17970,AQN
18,,SING,C9,C10,no,N,18,,78092,17970,AQN
19,,SING,C11,C10,no,N,19,,78092,17970,AQN
20,,DOUB,C10,O10,no,N,20,,78092,17970,AQN
21,,SING,C11,C12,yes,N,21,,78092,17970,AQN
22,,DOUB,C13,C12,yes,N,22,,78092,17970,AQN
23,,SING,C12,H12,no,N,23,,78092,17970,AQN
24,,SING,C14,C13,yes,N,24,,78092,17970,AQN
25,,SING,C13,H13,no,N,25,,78092,17970,AQN
26,,SING,S15,C14,no,N,26,,78092,17970,AQN
27,,DOUB,OS1,S15,no,N,27,,78092,17970,AQN
28,,DOUB,OS2,S15,no,N,28,,78092,17970,AQN
29,,SING,S15,OS3,no,N,29,,78092,17970,AQN
30,,SING,OS3,HOS3,no,N,30,,78092,17970,AQN
1,,SING,N,CA,no,N,1,,78192,17973,DAS
2,,SING,N,H,no,N,2,,78192,17973,DAS
3,,SING,N,H2,no,N,3,,78192,17973,DAS
4,,SING,CA,C,no,N,4,,78192,17973,DAS
5,,SING,CA,CB,no,N,5,,78192,17973,DAS
6,,SING,CA,HA,no,N,6,,78192,17973,DAS
7,,DOUB,C,O,no,N,7,,78192,17973,DAS
8,,SING,C,OXT,no,N,8,,78192,17973,DAS
9,,SING,CB,CG,no,N,9,,78192,17973,DAS
10,,SING,CB,HB2,no,N,10,,78192,17973,DAS
11,,SING,CB,HB3,no,N,11,,78192,17973,DAS
12,,DOUB,CG,OD1,no,N,12,,78192,17973,DAS
13,,SING,CG,OD2,no,N,13,,78192,17973,DAS
14,,SING,OD2,HD2,no,N,14,,78192,17973,DAS
15,,SING,OXT,HXT,no,N,15,,78192,17973,DAS
1,,SING,OAD,CAY,no,N,1,,78229,17975,240
2,,SING,OAD,HOAD,no,N,2,,78229,17975,240
3,,DOUB,CAY,OAF,no,N,3,,78229,17975,240
4,,SING,CAY,CBJ,no,N,4,,78229,17975,240
5,,SING,CBJ,CAC,no,N,5,,78229,17975,240
6,,SING,CBJ,OAW,no,N,6,,78229,17975,240
7,,SING,CBJ,HBJ,no,N,7,,78229,17975,240
8,,SING,CAC,HAC1,no,N,8,,78229,17975,240
9,,SING,CAC,HAC2,no,N,9,,78229,17975,240
10,,SING,CAC,HAC3,no,N,10,,78229,17975,240
11,,SING,OAW,CBF,no,N,11,,78229,17975,240
12,,SING,CBF,CAO,yes,N,12,,78229,17975,240
13,,DOUB,CBF,CBE,yes,N,13,,78229,17975,240
14,,DOUB,CAO,CAK,yes,N,14,,78229,17975,240
15,,SING,CAO,HAO,no,N,15,,78229,17975,240
16,,SING,CAK,CAJ,yes,N,16,,78229,17975,240
17,,SING,CAK,HAK,no,N,17,,78229,17975,240
18,,DOUB,CAJ,CAN,yes,N,18,,78229,17975,240
19,,SING,CAJ,HAJ,no,N,19,,78229,17975,240
20,,SING,CAN,CBE,yes,N,20,,78229,17975,240
21,,SING,CAN,HAN,no,N,21,,78229,17975,240
22,,SING,CBE,CAU,no,N,22,,78229,17975,240
23,,SING,CAU,CBG,no,N,23,,78229,17975,240
24,,SING,CAU,HAU1,no,N,24,,78229,17975,240
25,,SING,CAU,HAU2,no,N,25,,78229,17975,240
26,,DOUB,CBG,CBA,yes,N,26,,78229,17975,240
27,,SING,CBG,CBH,yes,N,27,,78229,17975,240
28,,SING,CBA,CAB,no,N,28,,78229,17975,240
29,,SING,CBA,NBK,yes,N,29,,78229,17975,240
30,,SING,CAB,HAB1,no,N,30,,78229,17975,240
31,,SING,CAB,HAB2,no,N,31,,78229,17975,240
32,,SING,CAB,HAB3,no,N,32,,78229,17975,240
33,,DOUB,CBH,CBI,yes,N,33,,78229,17975,240
34,,SING,CBH,CAT,yes,N,34,,78229,17975,240
35,,DOUB,CAT,CBC,yes,N,35,,78229,17975,240
36,,SING,CAT,HAT,no,N,36,,78229,17975,240
37,,SING,CBC,CAR,yes,N,37,,78229,17975,240
38,,SING,CBC,OAX,no,N,38,,78229,17975,240
39,,SING,OAX,CBL,no,N,39,,78229,17975,240
40,,SING,CBL,FAH,no,N,40,,78229,17975,240
41,,SING,CBL,FAI,no,N,41,,78229,17975,240
42,,SING,CBL,FAG,no,N,42,,78229,17975,240
43,,DOUB,CAR,CAS,yes,N,43,,78229,17975,240
44,,SING,CAR,HAR,no,N,44,,78229,17975,240
45,,SING,CAS,CBI,yes,N,45,,78229,17975,240
46,,SING,CAS,HAS,no,N,46,,78229,17975,240
47,,SING,CBI,NBK,yes,N,47,,78229,17975,240
48,,SING,NBK,CAZ,no,N,48,,78229,17975,240
49,,SING,CAZ,CBD,no,N,49,,78229,17975,240
50,,DOUB,CAZ,OAE,no,N,50,,78229,17975,240
51,,DOUB,CBD,CAP,yes,N,51,,78229,17975,240
52,,SING,CBD,CAQ,yes,N,52,,78229,17975,240
53,,DOUB,CAQ,CAM,yes,N,53,,78229,17975,240
54,,SING,CAQ,HAQ,no,N,54,,78229,17975,240
55,,SING,CAM,CBB,yes,N,55,,78229,17975,240
56,,SING,CAM,HAM,no,N,56,,78229,17975,240
57,,SING,CAP,CAL,yes,N,57,,78229,17975,240
58,,SING,CAP,HAP,no,N,58,,78229,17975,240
59,,DOUB,CAL,CBB,yes,N,59,,78229,17975,240
60,,SING,CAL,HAL,no,N,60,,78229,17975,240
61,,SING,CBB,OAV,no,N,61,,78229,17975,240
62,,SING,OAV,CAA,no,N,62,,78229,17975,240
63,,SING,CAA,HAA1,no,N,63,,78229,17975,240
64,,SING,CAA,HAA2,no,N,64,,78229,17975,240
65,,SING,CAA,HAA3,no,N,65,,78229,17975,240
1,,SING,CAA,OAV,no,N,1,,78248,17976,241
2,,SING,CAA,HAA1,no,N,2,,78248,17976,241
3,,SING,CAA,HAA2,no,N,3,,78248,17976,241
4,,SING,CAA,HAA3,no,N,4,,78248,17976,241
5,,SING,OAV,CBC,no,N,5,,78248,17976,241
6,,DOUB,CBC,CAN,yes,N,6,,78248,17976,241
7,,SING,CBC,CAM,yes,N,7,,78248,17976,241
8,,DOUB,CAM,CAO,yes,N,8,,78248,17976,241
9,,SING,CAM,HAM,no,N,9,,78248,17976,241
10,,SING,CAO,CBF,yes,N,10,,78248,17976,241
11,,SING,CAO,HAO,no,N,11,,78248,17976,241
12,,SING,CAN,CAP,yes,N,12,,78248,17976,241
13,,SING,CAN,HAN,no,N,13,,78248,17976,241
14,,DOUB,CAP,CBF,yes,N,14,,78248,17976,241
15,,SING,CAP,HAP,no,N,15,,78248,17976,241
16,,SING,CBF,CAZ,no,N,16,,78248,17976,241
17,,DOUB,CAZ,OAE,no,N,17,,78248,17976,241
18,,SING,CAZ,NBK,no,N,18,,78248,17976,241
19,,SING,NBK,CBB,yes,N,19,,78248,17976,241
20,,SING,NBK,CBI,yes,N,20,,78248,17976,241
21,,SING,CBB,CAB,no,N,21,,78248,17976,241
22,,DOUB,CBB,CBG,yes,N,22,,78248,17976,241
23,,SING,CAB,HAB1,no,N,23,,78248,17976,241
24,,SING,CAB,HAB2,no,N,24,,78248,17976,241
25,,SING,CAB,HAB3,no,N,25,,78248,17976,241
26,,DOUB,CBI,CBH,yes,N,26,,78248,17976,241
27,,SING,CBI,CAR,yes,N,27,,78248,17976,241
28,,DOUB,CAR,CAQ,yes,N,28,,78248,17976,241
29,,SING,CAR,HAR,no,N,29,,78248,17976,241
30,,SING,CAQ,CBE,yes,N,30,,78248,17976,241
31,,SING,CAQ,HAQ,no,N,31,,78248,17976,241
32,,DOUB,CBE,CAT,yes,N,32,,78248,17976,241
33,,SING,CBE,OAX,no,N,33,,78248,17976,241
34,,SING,OAX,CBL,no,N,34,,78248,17976,241
35,,SING,CBL,FAG,no,N,35,,78248,17976,241
36,,SING,CBL,FAI,no,N,36,,78248,17976,241
37,,SING,CBL,FAH,no,N,37,,78248,17976,241
38,,SING,CAT,CBH,yes,N,38,,78248,17976,241
39,,SING,CAT,HAT,no,N,39,,78248,17976,241
40,,SING,CBH,CBG,yes,N,40,,78248,17976,241
41,,SING,CBG,CAU,no,N,41,,78248,17976,241
42,,SING,CAU,CBA,no,N,42,,78248,17976,241
43,,SING,CAU,HAU1,no,N,43,,78248,17976,241
44,,SING,CAU,HAU2,no,N,44,,78248,17976,241
45,,DOUB,CBA,CAK,yes,N,45,,78248,17976,241
46,,SING,CBA,CAS,yes,N,46,,78248,17976,241
47,,DOUB,CAS,CBD,yes,N,47,,78248,17976,241
48,,SING,CAS,HAS,no,N,48,,78248,17976,241
49,,SING,CAK,CAJ,yes,N,49,,78248,17976,241
50,,SING,CAK,HAK,no,N,50,,78248,17976,241
51,,DOUB,CAJ,CAL,yes,N,51,,78248,17976,241
52,,SING,CAJ,HAJ,no,N,52,,78248,17976,241
53,,SING,CAL,CBD,yes,N,53,,78248,17976,241
54,,SING,CAL,HAL,no,N,54,,78248,17976,241
55,,SING,CBD,OAW,no,N,55,,78248,17976,241
56,,SING,OAW,CBJ,no,N,56,,78248,17976,241
57,,SING,CBJ,CAC,no,N,57,,78248,17976,241
58,,SING,CBJ,CAY,no,N,58,,78248,17976,241
59,,SING,CBJ,HBJ,no,N,59,,78248,17976,241
60,,SING,CAC,HAC1,no,N,60,,78248,17976,241
61,,SING,CAC,HAC2,no,N,61,,78248,17976,241
62,,SING,CAC,HAC3,no,N,62,,78248,17976,241
63,,DOUB,CAY,OAF,no,N,63,,78248,17976,241
64,,SING,CAY,OAD,no,N,64,,78248,17976,241
65,,SING,OAD,HOAD,no,N,65,,78248,17976,241
1,,SING,OAD,CAY,no,N,1,,78267,17977,240
2,,SING,OAD,HOAD,no,N,2,,78267,17977,240
3,,DOUB,CAY,OAF,no,N,3,,78267,17977,240
4,,SING,CAY,CBJ,no,N,4,,78267,17977,240
5,,SING,CBJ,CAC,no,N,5,,78267,17977,240
6,,SING,CBJ,OAW,no,N,6,,78267,17977,240
7,,SING,CBJ,HBJ,no,N,7,,78267,17977,240
8,,SING,CAC,HAC1,no,N,8,,78267,17977,240
9,,SING,CAC,HAC2,no,N,9,,78267,17977,240
10,,SING,CAC,HAC3,no,N,10,,78267,17977,240
11,,SING,OAW,CBF,no,N,11,,78267,17977,240
12,,SING,CBF,CAO,yes,N,12,,78267,17977,240
13,,DOUB,CBF,CBE,yes,N,13,,78267,17977,240
14,,DOUB,CAO,CAK,yes,N,14,,78267,17977,240
15,,SING,CAO,HAO,no,N,15,,78267,17977,240
16,,SING,CAK,CAJ,yes,N,16,,78267,17977,240
17,,SING,CAK,HAK,no,N,17,,78267,17977,240
18,,DOUB,CAJ,CAN,yes,N,18,,78267,17977,240
19,,SING,CAJ,HAJ,no,N,19,,78267,17977,240
20,,SING,CAN,CBE,yes,N,20,,78267,17977,240
21,,SING,CAN,HAN,no,N,21,,78267,17977,240
22,,SING,CBE,CAU,no,N,22,,78267,17977,240
23,,SING,CAU,CBG,no,N,23,,78267,17977,240
24,,SING,CAU,HAU1,no,N,24,,78267,17977,240
25,,SING,CAU,HAU2,no,N,25,,78267,17977,240
26,,DOUB,CBG,CBA,yes,N,26,,78267,17977,240
27,,SING,CBG,CBH,yes,N,27,,78267,17977,240
28,,SING,CBA,CAB,no,N,28,,78267,17977,240
29,,SING,CBA,NBK,yes,N,29,,78267,17977,240
30,,SING,CAB,HAB1,no,N,30,,78267,17977,240
31,,SING,CAB,HAB2,no,N,31,,78267,17977,240
32,,SING,CAB,HAB3,no,N,32,,78267,17977,240
33,,DOUB,CBH,CBI,yes,N,33,,78267,17977,240
34,,SING,CBH,CAT,yes,N,34,,78267,17977,240
35,,DOUB,CAT,CBC,yes,N,35,,78267,17977,240
36,,SING,CAT,HAT,no,N,36,,78267,17977,240
37,,SING,CBC,CAR,yes,N,37,,78267,17977,240
38,,SING,CBC,OAX,no,N,38,,78267,17977,240
39,,SING,OAX,CBL,no,N,39,,78267,17977,240
40,,SING,CBL,FAH,no,N,40,,78267,17977,240
41,,SING,CBL,FAI,no,N,41,,78267,17977,240
42,,SING,CBL,FAG,no,N,42,,78267,17977,240
43,,DOUB,CAR,CAS,yes,N,43,,78267,17977,240
44,,SING,CAR,HAR,no,N,44,,78267,17977,240
45,,SING,CAS,CBI,yes,N,45,,78267,17977,240
46,,SING,CAS,HAS,no,N,46,,78267,17977,240
47,,SING,CBI,NBK,yes,N,47,,78267,17977,240
48,,SING,NBK,CAZ,no,N,48,,78267,17977,240
49,,SING,CAZ,CBD,no,N,49,,78267,17977,240
50,,DOUB,CAZ,OAE,no,N,50,,78267,17977,240
51,,DOUB,CBD,CAP,yes,N,51,,78267,17977,240
52,,SING,CBD,CAQ,yes,N,52,,78267,17977,240
53,,DOUB,CAQ,CAM,yes,N,53,,78267,17977,240
54,,SING,CAQ,HAQ,no,N,54,,78267,17977,240
55,,SING,CAM,CBB,yes,N,55,,78267,17977,240
56,,SING,CAM,HAM,no,N,56,,78267,17977,240
57,,SING,CAP,CAL,yes,N,57,,78267,17977,240
58,,SING,CAP,HAP,no,N,58,,78267,17977,240
59,,DOUB,CAL,CBB,yes,N,59,,78267,17977,240
60,,SING,CAL,HAL,no,N,60,,78267,17977,240
61,,SING,CBB,OAV,no,N,61,,78267,17977,240
62,,SING,OAV,CAA,no,N,62,,78267,17977,240
63,,SING,CAA,HAA1,no,N,63,,78267,17977,240
64,,SING,CAA,HAA2,no,N,64,,78267,17977,240
65,,SING,CAA,HAA3,no,N,65,,78267,17977,240
1,,SING,O23,P24,no,N,1,,78586,17995,PNS
2,,SING,O23,HOP1,no,N,2,,78586,17995,PNS
3,,SING,P24,O25,no,N,3,,78586,17995,PNS
4,,DOUB,P24,O26,no,N,4,,78586,17995,PNS
5,,SING,P24,O27,no,N,5,,78586,17995,PNS
6,,SING,O25,HOP2,no,N,6,,78586,17995,PNS
7,,SING,O27,C28,no,N,7,,78586,17995,PNS
8,,SING,C28,C29,no,N,8,,78586,17995,PNS
9,,SING,C28,H282,no,N,9,,78586,17995,PNS
10,,SING,C28,H281,no,N,10,,78586,17995,PNS
11,,SING,C29,C30,no,N,11,,78586,17995,PNS
12,,SING,C29,C31,no,N,12,,78586,17995,PNS
13,,SING,C29,C32,no,N,13,,78586,17995,PNS
14,,SING,C30,H303,no,N,14,,78586,17995,PNS
15,,SING,C30,H302,no,N,15,,78586,17995,PNS
16,,SING,C30,H301,no,N,16,,78586,17995,PNS
17,,SING,C31,H313,no,N,17,,78586,17995,PNS
18,,SING,C31,H312,no,N,18,,78586,17995,PNS
19,,SING,C31,H311,no,N,19,,78586,17995,PNS
20,,SING,C32,O33,no,N,20,,78586,17995,PNS
21,,SING,C32,C34,no,N,21,,78586,17995,PNS
22,,SING,C32,H32,no,N,22,,78586,17995,PNS
23,,SING,O33,H33,no,N,23,,78586,17995,PNS
24,,DOUB,C34,O35,no,N,24,,78586,17995,PNS
25,,SING,C34,N36,no,N,25,,78586,17995,PNS
26,,SING,N36,C37,no,N,26,,78586,17995,PNS
27,,SING,N36,H36,no,N,27,,78586,17995,PNS
28,,SING,C37,C38,no,N,28,,78586,17995,PNS
29,,SING,C37,H372,no,N,29,,78586,17995,PNS
30,,SING,C37,H371,no,N,30,,78586,17995,PNS
31,,SING,C38,C39,no,N,31,,78586,17995,PNS
32,,SING,C38,H382,no,N,32,,78586,17995,PNS
33,,SING,C38,H381,no,N,33,,78586,17995,PNS
34,,DOUB,C39,O40,no,N,34,,78586,17995,PNS
35,,SING,C39,N41,no,N,35,,78586,17995,PNS
36,,SING,N41,C42,no,N,36,,78586,17995,PNS
37,,SING,N41,H41,no,N,37,,78586,17995,PNS
38,,SING,C42,C43,no,N,38,,78586,17995,PNS
39,,SING,C42,H422,no,N,39,,78586,17995,PNS
40,,SING,C42,H421,no,N,40,,78586,17995,PNS
41,,SING,C43,S44,no,N,41,,78586,17995,PNS
42,,SING,C43,H431,no,N,42,,78586,17995,PNS
43,,SING,C43,H432,no,N,43,,78586,17995,PNS
44,,SING,S44,H44,no,N,44,,78586,17995,PNS
1,,SING,N,CN,no,N,1,,78679,18,THC
2,,SING,N,CA,no,N,2,,78679,18,THC
3,,SING,N,H,no,N,3,,78679,18,THC
4,,DOUB,CN,ON,no,N,4,,78679,18,THC
5,,SING,CN,CM,no,N,5,,78679,18,THC
6,,SING,CM,HM1,no,N,6,,78679,18,THC
7,,SING,CM,HM2,no,N,7,,78679,18,THC
8,,SING,CM,HM3,no,N,8,,78679,18,THC
9,,SING,CA,CB,no,N,9,,78679,18,THC
10,,SING,CA,C,no,N,10,,78679,18,THC
11,,SING,CA,HA,no,N,11,,78679,18,THC
12,,SING,CB,OG1,no,N,12,,78679,18,THC
13,,SING,CB,CG2,no,N,13,,78679,18,THC
14,,SING,CB,HB,no,N,14,,78679,18,THC
15,,SING,OG1,HG1,no,N,15,,78679,18,THC
16,,SING,CG2,HG21,no,N,16,,78679,18,THC
17,,SING,CG2,HG22,no,N,17,,78679,18,THC
18,,SING,CG2,HG23,no,N,18,,78679,18,THC
19,,DOUB,C,O,no,N,19,,78679,18,THC
20,,SING,C,OXT,no,N,20,,78679,18,THC
21,,SING,OXT,HXT,no,N,21,,78679,18,THC
1,,SING,C1,O1,no,N,1,,78758,18002,4IP
2,,SING,C1,C2,no,N,2,,78758,18002,4IP
3,,SING,C1,C6,no,N,3,,78758,18002,4IP
4,,SING,C1,H1,no,N,4,,78758,18002,4IP
5,,SING,O1,P1,no,N,5,,78758,18002,4IP
6,,SING,C2,O2,no,N,6,,78758,18002,4IP
7,,SING,C2,C3,no,N,7,,78758,18002,4IP
8,,SING,C2,H2,no,N,8,,78758,18002,4IP
9,,SING,O2,HO2,no,N,9,,78758,18002,4IP
10,,SING,C3,O3,no,N,10,,78758,18002,4IP
11,,SING,C3,C4,no,N,11,,78758,18002,4IP
12,,SING,C3,H3,no,N,12,,78758,18002,4IP
13,,SING,O3,P3,no,N,13,,78758,18002,4IP
14,,SING,C4,O4,no,N,14,,78758,18002,4IP
15,,SING,C4,C5,no,N,15,,78758,18002,4IP
16,,SING,C4,H4,no,N,16,,78758,18002,4IP
17,,SING,O4,P4,no,N,17,,78758,18002,4IP
18,,SING,C5,O5,no,N,18,,78758,18002,4IP
19,,SING,C5,C6,no,N,19,,78758,18002,4IP
20,,SING,C5,H5,no,N,20,,78758,18002,4IP
21,,SING,O5,P5,no,N,21,,78758,18002,4IP
22,,SING,C6,O6,no,N,22,,78758,18002,4IP
23,,SING,C6,H6,no,N,23,,78758,18002,4IP
24,,SING,O6,HO6,no,N,24,,78758,18002,4IP
25,,DOUB,P1,O1P,no,N,25,,78758,18002,4IP
26,,SING,P1,O2P,no,N,26,,78758,18002,4IP
27,,SING,P1,O3P,no,N,27,,78758,18002,4IP
28,,SING,O2P,HO2P,no,N,28,,78758,18002,4IP
29,,SING,O3P,HO3P,no,N,29,,78758,18002,4IP
30,,DOUB,P3,O4P,no,N,30,,78758,18002,4IP
31,,SING,P3,O5P,no,N,31,,78758,18002,4IP
32,,SING,P3,O6P,no,N,32,,78758,18002,4IP
33,,SING,O5P,HO5P,no,N,33,,78758,18002,4IP
34,,SING,O6P,HO6P,no,N,34,,78758,18002,4IP
35,,SING,P4,O7P,no,N,35,,78758,18002,4IP
36,,SING,P4,O8P,no,N,36,,78758,18002,4IP
37,,DOUB,P4,O9P,no,N,37,,78758,18002,4IP
38,,SING,O7P,HO7P,no,N,38,,78758,18002,4IP
39,,SING,O8P,HO8P,no,N,39,,78758,18002,4IP
40,,SING,P5,OPF,no,N,40,,78758,18002,4IP
41,,DOUB,P5,OPG,no,N,41,,78758,18002,4IP
42,,SING,P5,OPH,no,N,42,,78758,18002,4IP
43,,SING,OPF,HOP1,no,N,43,,78758,18002,4IP
44,,SING,OPH,HOP3,no,N,44,,78758,18002,4IP
1,,SING,N,CA,no,N,1,,78825,18005,2MR
2,,SING,N,H,no,N,2,,78825,18005,2MR
3,,SING,N,H2,no,N,3,,78825,18005,2MR
4,,SING,CA,CB,no,N,4,,78825,18005,2MR
5,,SING,CA,C,no,N,5,,78825,18005,2MR
6,,SING,CA,HA,no,N,6,,78825,18005,2MR
7,,SING,CB,CG,no,N,7,,78825,18005,2MR
8,,SING,CB,HB2,no,N,8,,78825,18005,2MR
9,,SING,CB,HB3,no,N,9,,78825,18005,2MR
10,,SING,CG,CD,no,N,10,,78825,18005,2MR
11,,SING,CG,HG2,no,N,11,,78825,18005,2MR
12,,SING,CG,HG3,no,N,12,,78825,18005,2MR
13,,SING,CD,NE,no,N,13,,78825,18005,2MR
14,,SING,CD,HD2,no,N,14,,78825,18005,2MR
15,,SING,CD,HD3,no,N,15,,78825,18005,2MR
16,,SING,NE,CZ,no,N,16,,78825,18005,2MR
17,,SING,NE,HE,no,N,17,,78825,18005,2MR
18,,DOUB,CZ,NH1,no,N,18,,78825,18005,2MR
19,,SING,CZ,NH2,no,N,19,,78825,18005,2MR
20,,SING,NH1,CQ1,no,N,20,,78825,18005,2MR
21,,SING,CQ1,HQ11,no,N,21,,78825,18005,2MR
22,,SING,CQ1,HQ12,no,N,22,,78825,18005,2MR
23,,SING,CQ1,HQ13,no,N,23,,78825,18005,2MR
24,,SING,NH2,CQ2,no,N,24,,78825,18005,2MR
25,,SING,NH2,HH2,no,N,25,,78825,18005,2MR
26,,SING,CQ2,HQ21,no,N,26,,78825,18005,2MR
27,,SING,CQ2,HQ22,no,N,27,,78825,18005,2MR
28,,SING,CQ2,HQ23,no,N,28,,78825,18005,2MR
29,,DOUB,C,O,no,N,29,,78825,18005,2MR
30,,SING,C,OXT,no,N,30,,78825,18005,2MR
31,,SING,OXT,HXT,no,N,31,,78825,18005,2MR
1,,SING,N,CA,no,N,1,,78846,18006,2MR
2,,SING,N,H,no,N,2,,78846,18006,2MR
3,,SING,N,H2,no,N,3,,78846,18006,2MR
4,,SING,CA,CB,no,N,4,,78846,18006,2MR
5,,SING,CA,C,no,N,5,,78846,18006,2MR
6,,SING,CA,HA,no,N,6,,78846,18006,2MR
7,,SING,CB,CG,no,N,7,,78846,18006,2MR
8,,SING,CB,HB2,no,N,8,,78846,18006,2MR
9,,SING,CB,HB3,no,N,9,,78846,18006,2MR
10,,SING,CG,CD,no,N,10,,78846,18006,2MR
11,,SING,CG,HG2,no,N,11,,78846,18006,2MR
12,,SING,CG,HG3,no,N,12,,78846,18006,2MR
13,,SING,CD,NE,no,N,13,,78846,18006,2MR
14,,SING,CD,HD2,no,N,14,,78846,18006,2MR
15,,SING,CD,HD3,no,N,15,,78846,18006,2MR
16,,SING,NE,CZ,no,N,16,,78846,18006,2MR
17,,SING,NE,HE,no,N,17,,78846,18006,2MR
18,,DOUB,CZ,NH1,no,N,18,,78846,18006,2MR
19,,SING,CZ,NH2,no,N,19,,78846,18006,2MR
20,,SING,NH1,CQ1,no,N,20,,78846,18006,2MR
21,,SING,CQ1,HQ11,no,N,21,,78846,18006,2MR
22,,SING,CQ1,HQ12,no,N,22,,78846,18006,2MR
23,,SING,CQ1,HQ13,no,N,23,,78846,18006,2MR
24,,SING,NH2,CQ2,no,N,24,,78846,18006,2MR
25,,SING,NH2,HH2,no,N,25,,78846,18006,2MR
26,,SING,CQ2,HQ21,no,N,26,,78846,18006,2MR
27,,SING,CQ2,HQ22,no,N,27,,78846,18006,2MR
28,,SING,CQ2,HQ23,no,N,28,,78846,18006,2MR
29,,DOUB,C,O,no,N,29,,78846,18006,2MR
30,,SING,C,OXT,no,N,30,,78846,18006,2MR
31,,SING,OXT,HXT,no,N,31,,78846,18006,2MR
1,,SING,C1,NH1,no,N,1,,78867,18007,DA2
2,,SING,C1,HC11,no,N,2,,78867,18007,DA2
3,,SING,C1,HC12,no,N,3,,78867,18007,DA2
4,,SING,C1,HC13,no,N,4,,78867,18007,DA2
5,,SING,C2,NH1,no,N,5,,78867,18007,DA2
6,,SING,C2,HC21,no,N,6,,78867,18007,DA2
7,,SING,C2,HC22,no,N,7,,78867,18007,DA2
8,,SING,C2,HC23,no,N,8,,78867,18007,DA2
9,,SING,N,CA,no,N,9,,78867,18007,DA2
10,,SING,N,HN1,no,N,10,,78867,18007,DA2
11,,SING,N,HN2,no,N,11,,78867,18007,DA2
12,,SING,CA,CB,no,N,12,,78867,18007,DA2
13,,SING,CA,C,no,N,13,,78867,18007,DA2
14,,SING,CA,HCA,no,N,14,,78867,18007,DA2
15,,SING,CB,CG,no,N,15,,78867,18007,DA2
16,,SING,CB,HCB1,no,N,16,,78867,18007,DA2
17,,SING,CB,HCB2,no,N,17,,78867,18007,DA2
18,,SING,CG,CD,no,N,18,,78867,18007,DA2
19,,SING,CG,HCG1,no,N,19,,78867,18007,DA2
20,,SING,CG,HCG2,no,N,20,,78867,18007,DA2
21,,SING,CD,NE,no,N,21,,78867,18007,DA2
22,,SING,CD,HCD1,no,N,22,,78867,18007,DA2
23,,SING,CD,HCD2,no,N,23,,78867,18007,DA2
24,,SING,NE,CZ,no,N,24,,78867,18007,DA2
25,,SING,NE,HNE,no,N,25,,78867,18007,DA2
26,,DOUB,CZ,NH2,no,Z,26,,78867,18007,DA2
27,,SING,CZ,NH1,no,N,27,,78867,18007,DA2
28,,SING,NH2,HNH2,no,N,28,,78867,18007,DA2
29,,DOUB,C,OA1,no,N,29,,78867,18007,DA2
30,,SING,C,OA2,no,N,30,,78867,18007,DA2
31,,SING,OA2,HOA2,no,N,31,,78867,18007,DA2
1,,SING,C1,NH1,no,N,1,,78888,18008,DA2
2,,SING,C1,HC11,no,N,2,,78888,18008,DA2
3,,SING,C1,HC12,no,N,3,,78888,18008,DA2
4,,SING,C1,HC13,no,N,4,,78888,18008,DA2
5,,SING,C2,NH1,no,N,5,,78888,18008,DA2
6,,SING,C2,HC21,no,N,6,,78888,18008,DA2
7,,SING,C2,HC22,no,N,7,,78888,18008,DA2
8,,SING,C2,HC23,no,N,8,,78888,18008,DA2
9,,SING,N,CA,no,N,9,,78888,18008,DA2
10,,SING,N,HN1,no,N,10,,78888,18008,DA2
11,,SING,N,HN2,no,N,11,,78888,18008,DA2
12,,SING,CA,CB,no,N,12,,78888,18008,DA2
13,,SING,CA,C,no,N,13,,78888,18008,DA2
14,,SING,CA,HCA,no,N,14,,78888,18008,DA2
15,,SING,CB,CG,no,N,15,,78888,18008,DA2
16,,SING,CB,HCB1,no,N,16,,78888,18008,DA2
17,,SING,CB,HCB2,no,N,17,,78888,18008,DA2
18,,SING,CG,CD,no,N,18,,78888,18008,DA2
19,,SING,CG,HCG1,no,N,19,,78888,18008,DA2
20,,SING,CG,HCG2,no,N,20,,78888,18008,DA2
21,,SING,CD,NE,no,N,21,,78888,18008,DA2
22,,SING,CD,HCD1,no,N,22,,78888,18008,DA2
23,,SING,CD,HCD2,no,N,23,,78888,18008,DA2
24,,SING,NE,CZ,no,N,24,,78888,18008,DA2
25,,SING,NE,HNE,no,N,25,,78888,18008,DA2
26,,DOUB,CZ,NH2,no,Z,26,,78888,18008,DA2
27,,SING,CZ,NH1,no,N,27,,78888,18008,DA2
28,,SING,NH2,HNH2,no,N,28,,78888,18008,DA2
29,,DOUB,C,OA1,no,N,29,,78888,18008,DA2
30,,SING,C,OA2,no,N,30,,78888,18008,DA2
31,,SING,OA2,HOA2,no,N,31,,78888,18008,DA2
1,,DOUB,P,O1P,no,N,1,,79204,18024,CMP
2,,SING,P,O2P,no,N,2,,79204,18024,CMP
3,,SING,P,O5',no,N,3,,79204,18024,CMP
4,,SING,P,O3',no,N,4,,79204,18024,CMP
5,,SING,O2P,HOP2,no,N,5,,79204,18024,CMP
6,,SING,O5',C5',no,N,6,,79204,18024,CMP
7,,SING,C5',C4',no,N,7,,79204,18024,CMP
8,,SING,C5',H5'1,no,N,8,,79204,18024,CMP
9,,SING,C5',H5'2,no,N,9,,79204,18024,CMP
10,,SING,C4',O4',no,N,10,,79204,18024,CMP
11,,SING,C4',C3',no,N,11,,79204,18024,CMP
12,,SING,C4',H4',no,N,12,,79204,18024,CMP
13,,SING,O4',C1',no,N,13,,79204,18024,CMP
14,,SING,C3',O3',no,N,14,,79204,18024,CMP
15,,SING,C3',C2',no,N,15,,79204,18024,CMP
16,,SING,C3',H3',no,N,16,,79204,18024,CMP
17,,SING,C2',O2',no,N,17,,79204,18024,CMP
18,,SING,C2',C1',no,N,18,,79204,18024,CMP
19,,SING,C2',H2',no,N,19,,79204,18024,CMP
20,,SING,O2',HO2',no,N,20,,79204,18024,CMP
21,,SING,C1',N9,no,N,21,,79204,18024,CMP
22,,SING,C1',H1',no,N,22,,79204,18024,CMP
23,,SING,N9,C8,yes,N,23,,79204,18024,CMP
24,,SING,N9,C4,yes,N,24,,79204,18024,CMP
25,,DOUB,C8,N7,yes,N,25,,79204,18024,CMP
26,,SING,C8,H8,no,N,26,,79204,18024,CMP
27,,SING,N7,C5,yes,N,27,,79204,18024,CMP
28,,SING,C5,C6,yes,N,28,,79204,18024,CMP
29,,DOUB,C5,C4,yes,N,29,,79204,18024,CMP
30,,SING,C6,N6,no,N,30,,79204,18024,CMP
31,,DOUB,C6,N1,yes,N,31,,79204,18024,CMP
32,,SING,N6,HN61,no,N,32,,79204,18024,CMP
33,,SING,N6,HN62,no,N,33,,79204,18024,CMP
34,,SING,N1,C2,yes,N,34,,79204,18024,CMP
35,,DOUB,C2,N3,yes,N,35,,79204,18024,CMP
36,,SING,C2,H2,no,N,36,,79204,18024,CMP
37,,SING,N3,C4,yes,N,37,,79204,18024,CMP
1,,DOUB,PA,O1A,no,N,1,,79287,18029,FAD
2,,SING,PA,O2A,no,N,2,,79287,18029,FAD
3,,SING,PA,O5B,no,N,3,,79287,18029,FAD
4,,SING,PA,O3P,no,N,4,,79287,18029,FAD
5,,SING,O2A,HOA2,no,N,5,,79287,18029,FAD
6,,SING,O5B,C5B,no,N,6,,79287,18029,FAD
7,,SING,C5B,C4B,no,N,7,,79287,18029,FAD
8,,SING,C5B,H51A,no,N,8,,79287,18029,FAD
9,,SING,C5B,H52A,no,N,9,,79287,18029,FAD
10,,SING,C4B,O4B,no,N,10,,79287,18029,FAD
11,,SING,C4B,C3B,no,N,11,,79287,18029,FAD
12,,SING,C4B,H4B,no,N,12,,79287,18029,FAD
13,,SING,O4B,C1B,no,N,13,,79287,18029,FAD
14,,SING,C3B,O3B,no,N,14,,79287,18029,FAD
15,,SING,C3B,C2B,no,N,15,,79287,18029,FAD
16,,SING,C3B,H3B,no,N,16,,79287,18029,FAD
17,,SING,O3B,HO3A,no,N,17,,79287,18029,FAD
18,,SING,C2B,O2B,no,N,18,,79287,18029,FAD
19,,SING,C2B,C1B,no,N,19,,79287,18029,FAD
20,,SING,C2B,H2B,no,N,20,,79287,18029,FAD
21,,SING,O2B,HO2A,no,N,21,,79287,18029,FAD
22,,SING,C1B,N9A,no,N,22,,79287,18029,FAD
23,,SING,C1B,H1B,no,N,23,,79287,18029,FAD
24,,SING,N9A,C8A,yes,N,24,,79287,18029,FAD
25,,SING,N9A,C4A,yes,N,25,,79287,18029,FAD
26,,DOUB,C8A,N7A,yes,N,26,,79287,18029,FAD
27,,SING,C8A,H8A,no,N,27,,79287,18029,FAD
28,,SING,N7A,C5A,yes,N,28,,79287,18029,FAD
29,,SING,C5A,C6A,yes,N,29,,79287,18029,FAD
30,,DOUB,C5A,C4A,yes,N,30,,79287,18029,FAD
31,,SING,C6A,N6A,no,N,31,,79287,18029,FAD
32,,DOUB,C6A,N1A,yes,N,32,,79287,18029,FAD
33,,SING,N6A,H61A,no,N,33,,79287,18029,FAD
34,,SING,N6A,H62A,no,N,34,,79287,18029,FAD
35,,SING,N1A,C2A,yes,N,35,,79287,18029,FAD
36,,DOUB,C2A,N3A,yes,N,36,,79287,18029,FAD
37,,SING,C2A,H2A,no,N,37,,79287,18029,FAD
38,,SING,N3A,C4A,yes,N,38,,79287,18029,FAD
39,,SING,N1,C2,no,N,39,,79287,18029,FAD
40,,DOUB,N1,C10,no,N,40,,79287,18029,FAD
41,,DOUB,C2,O2,no,N,41,,79287,18029,FAD
42,,SING,C2,N3,no,N,42,,79287,18029,FAD
43,,SING,N3,C4,no,N,43,,79287,18029,FAD
44,,SING,N3,HN3,no,N,44,,79287,18029,FAD
45,,DOUB,C4,O4,no,N,45,,79287,18029,FAD
46,,SING,C4,C4X,no,N,46,,79287,18029,FAD
47,,DOUB,C4X,N5,no,N,47,,79287,18029,FAD
48,,SING,C4X,C10,no,N,48,,79287,18029,FAD
49,,SING,N5,C5X,no,N,49,,79287,18029,FAD
50,,DOUB,C5X,C6,yes,N,50,,79287,18029,FAD
51,,SING,C5X,C9A,yes,N,51,,79287,18029,FAD
52,,SING,C6,C7,yes,N,52,,79287,18029,FAD
53,,SING,C6,H6,no,N,53,,79287,18029,FAD
54,,SING,C7,C7M,no,N,54,,79287,18029,FAD
55,,DOUB,C7,C8,yes,N,55,,79287,18029,FAD
56,,SING,C7M,HM71,no,N,56,,79287,18029,FAD
57,,SING,C7M,HM72,no,N,57,,79287,18029,FAD
58,,SING,C7M,HM73,no,N,58,,79287,18029,FAD
59,,SING,C8,C8M,no,N,59,,79287,18029,FAD
60,,SING,C8,C9,yes,N,60,,79287,18029,FAD
61,,SING,C8M,HM81,no,N,61,,79287,18029,FAD
62,,SING,C8M,HM82,no,N,62,,79287,18029,FAD
63,,SING,C8M,HM83,no,N,63,,79287,18029,FAD
64,,DOUB,C9,C9A,yes,N,64,,79287,18029,FAD
65,,SING,C9,H9,no,N,65,,79287,18029,FAD
66,,SING,C9A,N10,no,N,66,,79287,18029,FAD
67,,SING,N10,C10,no,N,67,,79287,18029,FAD
68,,SING,N10,C1',no,N,68,,79287,18029,FAD
69,,SING,C1',C2',no,N,69,,79287,18029,FAD
70,,SING,C1',H1'1,no,N,70,,79287,18029,FAD
71,,SING,C1',H1'2,no,N,71,,79287,18029,FAD
72,,SING,C2',O2',no,N,72,,79287,18029,FAD
73,,SING,C2',C3',no,N,73,,79287,18029,FAD
74,,SING,C2',H2',no,N,74,,79287,18029,FAD
75,,SING,O2',HO2',no,N,75,,79287,18029,FAD
76,,SING,C3',O3',no,N,76,,79287,18029,FAD
77,,SING,C3',C4',no,N,77,,79287,18029,FAD
78,,SING,C3',H3',no,N,78,,79287,18029,FAD
79,,SING,O3',HO3',no,N,79,,79287,18029,FAD
80,,SING,C4',O4',no,N,80,,79287,18029,FAD
81,,SING,C4',C5',no,N,81,,79287,18029,FAD
82,,SING,C4',H4',no,N,82,,79287,18029,FAD
83,,SING,O4',HO4',no,N,83,,79287,18029,FAD
84,,SING,C5',O5',no,N,84,,79287,18029,FAD
85,,SING,C5',H5'1,no,N,85,,79287,18029,FAD
86,,SING,C5',H5'2,no,N,86,,79287,18029,FAD
87,,SING,O5',P,no,N,87,,79287,18029,FAD
88,,DOUB,P,O1P,no,N,88,,79287,18029,FAD
89,,SING,P,O2P,no,N,89,,79287,18029,FAD
90,,SING,P,O3P,no,N,90,,79287,18029,FAD
91,,SING,O2P,HOP2,no,N,91,,79287,18029,FAD
1,,DOUB,PA,O1A,no,N,1,,79318,18031,AP5
2,,SING,PA,O2A,no,N,2,,79318,18031,AP5
3,,SING,PA,O3A,no,N,3,,79318,18031,AP5
4,,SING,PA,O5F,no,N,4,,79318,18031,AP5
5,,SING,O2A,HOA2,no,N,5,,79318,18031,AP5
6,,SING,O3A,PB,no,N,6,,79318,18031,AP5
7,,DOUB,PB,O1B,no,N,7,,79318,18031,AP5
8,,SING,PB,O2B,no,N,8,,79318,18031,AP5
9,,SING,PB,O3B,no,N,9,,79318,18031,AP5
10,,SING,O2B,HOB2,no,N,10,,79318,18031,AP5
11,,SING,O3B,PG,no,N,11,,79318,18031,AP5
12,,DOUB,PG,O1G,no,N,12,,79318,18031,AP5
13,,SING,PG,O2G,no,N,13,,79318,18031,AP5
14,,SING,PG,O3G,no,N,14,,79318,18031,AP5
15,,SING,O2G,HOG2,no,N,15,,79318,18031,AP5
16,,SING,O3G,PD,no,N,16,,79318,18031,AP5
17,,DOUB,PD,O1D,no,N,17,,79318,18031,AP5
18,,SING,PD,O2D,no,N,18,,79318,18031,AP5
19,,SING,PD,O3D,no,N,19,,79318,18031,AP5
20,,SING,O2D,HOD2,no,N,20,,79318,18031,AP5
21,,SING,O3D,PE,no,N,21,,79318,18031,AP5
22,,DOUB,PE,O1E,no,N,22,,79318,18031,AP5
23,,SING,PE,O2E,no,N,23,,79318,18031,AP5
24,,SING,PE,O5J,no,N,24,,79318,18031,AP5
25,,SING,O2E,HOE2,no,N,25,,79318,18031,AP5
26,,SING,O5F,C5F,no,N,26,,79318,18031,AP5
27,,SING,C5F,C4F,no,N,27,,79318,18031,AP5
28,,SING,C5F,H51A,no,N,28,,79318,18031,AP5
29,,SING,C5F,H52A,no,N,29,,79318,18031,AP5
30,,SING,C4F,O4F,no,N,30,,79318,18031,AP5
31,,SING,C4F,C3F,no,N,31,,79318,18031,AP5
32,,SING,C4F,H4F,no,N,32,,79318,18031,AP5
33,,SING,O4F,C1F,no,N,33,,79318,18031,AP5
34,,SING,C3F,O3F,no,N,34,,79318,18031,AP5
35,,SING,C3F,C2F,no,N,35,,79318,18031,AP5
36,,SING,C3F,H3F,no,N,36,,79318,18031,AP5
37,,SING,O3F,HO3A,no,N,37,,79318,18031,AP5
38,,SING,C2F,O2F,no,N,38,,79318,18031,AP5
39,,SING,C2F,C1F,no,N,39,,79318,18031,AP5
40,,SING,C2F,H2F,no,N,40,,79318,18031,AP5
41,,SING,O2F,HO2A,no,N,41,,79318,18031,AP5
42,,SING,C1F,N9A,no,N,42,,79318,18031,AP5
43,,SING,C1F,H1F,no,N,43,,79318,18031,AP5
44,,SING,N9A,C8A,yes,N,44,,79318,18031,AP5
45,,SING,N9A,C4A,yes,N,45,,79318,18031,AP5
46,,DOUB,C8A,N7A,yes,N,46,,79318,18031,AP5
47,,SING,C8A,H8A,no,N,47,,79318,18031,AP5
48,,SING,N7A,C5A,yes,N,48,,79318,18031,AP5
49,,SING,C5A,C6A,yes,N,49,,79318,18031,AP5
50,,DOUB,C5A,C4A,yes,N,50,,79318,18031,AP5
51,,SING,C6A,N6A,no,N,51,,79318,18031,AP5
52,,DOUB,C6A,N1A,yes,N,52,,79318,18031,AP5
53,,SING,N6A,H61A,no,N,53,,79318,18031,AP5
54,,SING,N6A,H62A,no,N,54,,79318,18031,AP5
55,,SING,N1A,C2A,yes,N,55,,79318,18031,AP5
56,,DOUB,C2A,N3A,yes,N,56,,79318,18031,AP5
57,,SING,C2A,H2A,no,N,57,,79318,18031,AP5
58,,SING,N3A,C4A,yes,N,58,,79318,18031,AP5
59,,SING,O5J,C5J,no,N,59,,79318,18031,AP5
60,,SING,C5J,C4J,no,N,60,,79318,18031,AP5
61,,SING,C5J,H51B,no,N,61,,79318,18031,AP5
62,,SING,C5J,H52B,no,N,62,,79318,18031,AP5
63,,SING,C4J,O4J,no,N,63,,79318,18031,AP5
64,,SING,C4J,C3J,no,N,64,,79318,18031,AP5
65,,SING,C4J,H4J,no,N,65,,79318,18031,AP5
66,,SING,O4J,C1J,no,N,66,,79318,18031,AP5
67,,SING,C3J,O3J,no,N,67,,79318,18031,AP5
68,,SING,C3J,C2J,no,N,68,,79318,18031,AP5
69,,SING,C3J,H3J,no,N,69,,79318,18031,AP5
70,,SING,O3J,HO3B,no,N,70,,79318,18031,AP5
71,,SING,C2J,O2J,no,N,71,,79318,18031,AP5
72,,SING,C2J,C1J,no,N,72,,79318,18031,AP5
73,,SING,C2J,H2J,no,N,73,,79318,18031,AP5
74,,SING,O2J,HO2B,no,N,74,,79318,18031,AP5
75,,SING,C1J,N9B,no,N,75,,79318,18031,AP5
76,,SING,C1J,H1J,no,N,76,,79318,18031,AP5
77,,SING,N9B,C8B,yes,N,77,,79318,18031,AP5
78,,SING,N9B,C4B,yes,N,78,,79318,18031,AP5
79,,DOUB,C8B,N7B,yes,N,79,,79318,18031,AP5
80,,SING,C8B,H8B,no,N,80,,79318,18031,AP5
81,,SING,N7B,C5B,yes,N,81,,79318,18031,AP5
82,,SING,C5B,C6B,yes,N,82,,79318,18031,AP5
83,,DOUB,C5B,C4B,yes,N,83,,79318,18031,AP5
84,,SING,C6B,N6B,no,N,84,,79318,18031,AP5
85,,DOUB,C6B,N1B,yes,N,85,,79318,18031,AP5
86,,SING,N6B,H61B,no,N,86,,79318,18031,AP5
87,,SING,N6B,H62B,no,N,87,,79318,18031,AP5
88,,SING,N1B,C2B,yes,N,88,,79318,18031,AP5
89,,DOUB,C2B,N3B,yes,N,89,,79318,18031,AP5
90,,SING,C2B,H2B,no,N,90,,79318,18031,AP5
91,,SING,N3B,C4B,yes,N,91,,79318,18031,AP5
1,,SING,O23,P24,no,N,1,,79339,18032,PNS
2,,SING,O23,HOP1,no,N,2,,79339,18032,PNS
3,,SING,P24,O25,no,N,3,,79339,18032,PNS
4,,DOUB,P24,O26,no,N,4,,79339,18032,PNS
5,,SING,P24,O27,no,N,5,,79339,18032,PNS
6,,SING,O25,HOP2,no,N,6,,79339,18032,PNS
7,,SING,O27,C28,no,N,7,,79339,18032,PNS
8,,SING,C28,C29,no,N,8,,79339,18032,PNS
9,,SING,C28,H282,no,N,9,,79339,18032,PNS
10,,SING,C28,H281,no,N,10,,79339,18032,PNS
11,,SING,C29,C30,no,N,11,,79339,18032,PNS
12,,SING,C29,C31,no,N,12,,79339,18032,PNS
13,,SING,C29,C32,no,N,13,,79339,18032,PNS
14,,SING,C30,H303,no,N,14,,79339,18032,PNS
15,,SING,C30,H302,no,N,15,,79339,18032,PNS
16,,SING,C30,H301,no,N,16,,79339,18032,PNS
17,,SING,C31,H313,no,N,17,,79339,18032,PNS
18,,SING,C31,H312,no,N,18,,79339,18032,PNS
19,,SING,C31,H311,no,N,19,,79339,18032,PNS
20,,SING,C32,O33,no,N,20,,79339,18032,PNS
21,,SING,C32,C34,no,N,21,,79339,18032,PNS
22,,SING,C32,H32,no,N,22,,79339,18032,PNS
23,,SING,O33,H33,no,N,23,,79339,18032,PNS
24,,DOUB,C34,O35,no,N,24,,79339,18032,PNS
25,,SING,C34,N36,no,N,25,,79339,18032,PNS
26,,SING,N36,C37,no,N,26,,79339,18032,PNS
27,,SING,N36,H36,no,N,27,,79339,18032,PNS
28,,SING,C37,C38,no,N,28,,79339,18032,PNS
29,,SING,C37,H372,no,N,29,,79339,18032,PNS
30,,SING,C37,H371,no,N,30,,79339,18032,PNS
31,,SING,C38,C39,no,N,31,,79339,18032,PNS
32,,SING,C38,H382,no,N,32,,79339,18032,PNS
33,,SING,C38,H381,no,N,33,,79339,18032,PNS
34,,DOUB,C39,O40,no,N,34,,79339,18032,PNS
35,,SING,C39,N41,no,N,35,,79339,18032,PNS
36,,SING,N41,C42,no,N,36,,79339,18032,PNS
37,,SING,N41,H41,no,N,37,,79339,18032,PNS
38,,SING,C42,C43,no,N,38,,79339,18032,PNS
39,,SING,C42,H422,no,N,39,,79339,18032,PNS
40,,SING,C42,H421,no,N,40,,79339,18032,PNS
41,,SING,C43,S44,no,N,41,,79339,18032,PNS
42,,SING,C43,H431,no,N,42,,79339,18032,PNS
43,,SING,C43,H432,no,N,43,,79339,18032,PNS
44,,SING,S44,H44,no,N,44,,79339,18032,PNS
1,,DOUB,C1,C2,yes,N,1,,79682,18050,LLJ
2,,SING,C1,C3,yes,N,2,,79682,18050,LLJ
3,,SING,C1,H1,no,N,3,,79682,18050,LLJ
4,,SING,N1,C11,no,N,4,,79682,18050,LLJ
5,,SING,N1,C22,no,N,5,,79682,18050,LLJ
6,,SING,N1,HN1,no,N,6,,79682,18050,LLJ
7,,SING,N1,HN1A,no,N,7,,79682,18050,LLJ
8,,SING,O1,C23,no,N,8,,79682,18050,LLJ
9,,SING,O1,C24,no,N,9,,79682,18050,LLJ
10,,SING,C2,C6,yes,N,10,,79682,18050,LLJ
11,,SING,C2,C26,no,N,11,,79682,18050,LLJ
12,,SING,N2,C25,no,N,12,,79682,18050,LLJ
13,,SING,N2,C26,no,N,13,,79682,18050,LLJ
14,,SING,N2,H3N2,no,N,14,,79682,18050,LLJ
15,,SING,N2,H4N2,no,N,15,,79682,18050,LLJ
16,,SING,O2,C29,no,N,16,,79682,18050,LLJ
17,,SING,O2,C30,no,N,17,,79682,18050,LLJ
18,,DOUB,C3,C4,yes,N,18,,79682,18050,LLJ
19,,SING,C3,H3,no,N,19,,79682,18050,LLJ
20,,SING,N3,C27,no,N,20,,79682,18050,LLJ
21,,SING,N3,C28,no,N,21,,79682,18050,LLJ
22,,SING,N3,HN3,no,N,22,,79682,18050,LLJ
23,,SING,N3,HN3A,no,N,23,,79682,18050,LLJ
24,,SING,C4,C5,yes,N,24,,79682,18050,LLJ
25,,SING,C4,C7,yes,N,25,,79682,18050,LLJ
26,,SING,N4,C31,no,N,26,,79682,18050,LLJ
27,,SING,N4,C32,no,N,27,,79682,18050,LLJ
28,,SING,N4,HN4,no,N,28,,79682,18050,LLJ
29,,SING,N4,HN4A,no,N,29,,79682,18050,LLJ
30,,DOUB,C5,C6,yes,N,30,,79682,18050,LLJ
31,,SING,C5,C10,yes,N,31,,79682,18050,LLJ
32,,SING,C6,H6,no,N,32,,79682,18050,LLJ
33,,DOUB,C7,C8,yes,N,33,,79682,18050,LLJ
34,,SING,C7,H17,no,N,34,,79682,18050,LLJ
35,,SING,C8,C9,yes,N,35,,79682,18050,LLJ
36,,SING,C8,H18,no,N,36,,79682,18050,LLJ
37,,DOUB,C9,C10,yes,N,37,,79682,18050,LLJ
38,,SING,C9,C32,no,N,38,,79682,18050,LLJ
39,,SING,C10,H10,no,N,39,,79682,18050,LLJ
40,,SING,C11,C20,no,N,40,,79682,18050,LLJ
41,,SING,C11,H111,no,N,41,,79682,18050,LLJ
42,,SING,C11,H211,no,N,42,,79682,18050,LLJ
43,,DOUB,C12,C13,yes,N,43,,79682,18050,LLJ
44,,SING,C12,C17,yes,N,44,,79682,18050,LLJ
45,,SING,C12,H12,no,N,45,,79682,18050,LLJ
46,,SING,C13,C14,yes,N,46,,79682,18050,LLJ
47,,SING,C13,C27,no,N,47,,79682,18050,LLJ
48,,DOUB,C14,C15,yes,N,48,,79682,18050,LLJ
49,,SING,C14,H14,no,N,49,,79682,18050,LLJ
50,,SING,C15,C16,yes,N,50,,79682,18050,LLJ
51,,SING,C15,H15,no,N,51,,79682,18050,LLJ
52,,DOUB,C16,C17,yes,N,52,,79682,18050,LLJ
53,,SING,C16,C18,yes,N,53,,79682,18050,LLJ
54,,SING,C17,C21,yes,N,54,,79682,18050,LLJ
55,,DOUB,C18,C19,yes,N,55,,79682,18050,LLJ
56,,SING,C18,H18A,no,N,56,,79682,18050,LLJ
57,,SING,C19,C20,yes,N,57,,79682,18050,LLJ
58,,SING,C19,H19,no,N,58,,79682,18050,LLJ
59,,DOUB,C20,C21,yes,N,59,,79682,18050,LLJ
60,,SING,C21,H21,no,N,60,,79682,18050,LLJ
61,,SING,C22,C23,no,N,61,,79682,18050,LLJ
62,,SING,C22,H122,no,N,62,,79682,18050,LLJ
63,,SING,C22,H222,no,N,63,,79682,18050,LLJ
64,,SING,C23,H123,no,N,64,,79682,18050,LLJ
65,,SING,C23,H223,no,N,65,,79682,18050,LLJ
66,,SING,C24,C25,no,N,66,,79682,18050,LLJ
67,,SING,C24,H124,no,N,67,,79682,18050,LLJ
68,,SING,C24,H224,no,N,68,,79682,18050,LLJ
69,,SING,C25,H125,no,N,69,,79682,18050,LLJ
70,,SING,C25,H225,no,N,70,,79682,18050,LLJ
71,,SING,C26,H126,no,N,71,,79682,18050,LLJ
72,,SING,C26,H226,no,N,72,,79682,18050,LLJ
73,,SING,C27,H127,no,N,73,,79682,18050,LLJ
74,,SING,C27,H227,no,N,74,,79682,18050,LLJ
75,,SING,C28,C29,no,N,75,,79682,18050,LLJ
76,,SING,C28,H128,no,N,76,,79682,18050,LLJ
77,,SING,C28,H228,no,N,77,,79682,18050,LLJ
78,,SING,C29,H129,no,N,78,,79682,18050,LLJ
79,,SING,C29,H229,no,N,79,,79682,18050,LLJ
80,,SING,C30,C31,no,N,80,,79682,18050,LLJ
81,,SING,C30,H130,no,N,81,,79682,18050,LLJ
82,,SING,C30,H230,no,N,82,,79682,18050,LLJ
83,,SING,C31,H131,no,N,83,,79682,18050,LLJ
84,,SING,C31,H231,no,N,84,,79682,18050,LLJ
85,,SING,C32,H132,no,N,85,,79682,18050,LLJ
86,,SING,C32,H232,no,N,86,,79682,18050,LLJ
1,,SING,N,CA,no,N,1,,79723,18052,PCA
2,,SING,N,CD,no,N,2,,79723,18052,PCA
3,,SING,N,H,no,N,3,,79723,18052,PCA
4,,SING,CA,CB,no,N,4,,79723,18052,PCA
5,,SING,CA,C,no,N,5,,79723,18052,PCA
6,,SING,CA,HA,no,N,6,,79723,18052,PCA
7,,SING,CB,CG,no,N,7,,79723,18052,PCA
8,,SING,CB,HB2,no,N,8,,79723,18052,PCA
9,,SING,CB,HB3,no,N,9,,79723,18052,PCA
10,,SING,CG,CD,no,N,10,,79723,18052,PCA
11,,SING,CG,HG2,no,N,11,,79723,18052,PCA
12,,SING,CG,HG3,no,N,12,,79723,18052,PCA
13,,DOUB,CD,OE,no,N,13,,79723,18052,PCA
14,,DOUB,C,O,no,N,14,,79723,18052,PCA
15,,SING,C,OXT,no,N,15,,79723,18052,PCA
16,,SING,OXT,HXT,no,N,16,,79723,18052,PCA
1,,SING,O5',C5',no,N,1,,80139,18079,GMP
2,,SING,O5',HO5',no,N,2,,80139,18079,GMP
3,,SING,C5',C4',no,N,3,,80139,18079,GMP
4,,SING,C5',H5'1,no,N,4,,80139,18079,GMP
5,,SING,C5',H5'2,no,N,5,,80139,18079,GMP
6,,SING,C4',O4',no,N,6,,80139,18079,GMP
7,,SING,C4',C3',no,N,7,,80139,18079,GMP
8,,SING,C4',H4',no,N,8,,80139,18079,GMP
9,,SING,O4',C1',no,N,9,,80139,18079,GMP
10,,SING,C3',O3',no,N,10,,80139,18079,GMP
11,,SING,C3',C2',no,N,11,,80139,18079,GMP
12,,SING,C3',H3',no,N,12,,80139,18079,GMP
13,,SING,O3',HO3',no,N,13,,80139,18079,GMP
14,,SING,C2',O2',no,N,14,,80139,18079,GMP
15,,SING,C2',C1',no,N,15,,80139,18079,GMP
16,,SING,C2',H2',no,N,16,,80139,18079,GMP
17,,SING,O2',HO2',no,N,17,,80139,18079,GMP
18,,SING,C1',N9,no,N,18,,80139,18079,GMP
19,,SING,C1',H1',no,N,19,,80139,18079,GMP
20,,SING,N9,C8,yes,N,20,,80139,18079,GMP
21,,SING,N9,C4,yes,N,21,,80139,18079,GMP
22,,DOUB,C8,N7,yes,N,22,,80139,18079,GMP
23,,SING,C8,H8,no,N,23,,80139,18079,GMP
24,,SING,N7,C5,yes,N,24,,80139,18079,GMP
25,,SING,C5,C6,no,N,25,,80139,18079,GMP
26,,DOUB,C5,C4,yes,N,26,,80139,18079,GMP
27,,DOUB,C6,O6,no,N,27,,80139,18079,GMP
28,,SING,C6,N1,no,N,28,,80139,18079,GMP
29,,SING,N1,C2,no,N,29,,80139,18079,GMP
30,,SING,N1,HN1,no,N,30,,80139,18079,GMP
31,,SING,C2,N2,no,N,31,,80139,18079,GMP
32,,DOUB,C2,N3,no,N,32,,80139,18079,GMP
33,,SING,N2,HN21,no,N,33,,80139,18079,GMP
34,,SING,N2,HN22,no,N,34,,80139,18079,GMP
35,,SING,N3,C4,no,N,35,,80139,18079,GMP
1,,SING,N,CA,no,N,1,,80156,1808,PCA
2,,SING,N,CD,no,N,2,,80156,1808,PCA
3,,SING,N,H,no,N,3,,80156,1808,PCA
4,,SING,CA,CB,no,N,4,,80156,1808,PCA
5,,SING,CA,C,no,N,5,,80156,1808,PCA
6,,SING,CA,HA,no,N,6,,80156,1808,PCA
7,,SING,CB,CG,no,N,7,,80156,1808,PCA
8,,SING,CB,HB2,no,N,8,,80156,1808,PCA
9,,SING,CB,HB3,no,N,9,,80156,1808,PCA
10,,SING,CG,CD,no,N,10,,80156,1808,PCA
11,,SING,CG,HG2,no,N,11,,80156,1808,PCA
12,,SING,CG,HG3,no,N,12,,80156,1808,PCA
13,,DOUB,CD,OE,no,N,13,,80156,1808,PCA
14,,DOUB,C,O,no,N,14,,80156,1808,PCA
15,,SING,C,OXT,no,N,15,,80156,1808,PCA
16,,SING,OXT,HXT,no,N,16,,80156,1808,PCA
1,,SING,N,CA,no,N,1,,80335,18088,SNC
2,,SING,N,H,no,N,2,,80335,18088,SNC
3,,SING,N,H2,no,N,3,,80335,18088,SNC
4,,SING,CA,CB,no,N,4,,80335,18088,SNC
5,,SING,CA,C,no,N,5,,80335,18088,SNC
6,,SING,CA,HA,no,N,6,,80335,18088,SNC
7,,SING,CB,SG,no,N,7,,80335,18088,SNC
8,,SING,CB,HB2,no,N,8,,80335,18088,SNC
9,,SING,CB,HB3,no,N,9,,80335,18088,SNC
10,,SING,SG,ND,no,N,10,,80335,18088,SNC
11,,DOUB,ND,OE,no,N,11,,80335,18088,SNC
12,,DOUB,C,O,no,N,12,,80335,18088,SNC
13,,SING,C,OXT,no,N,13,,80335,18088,SNC
14,,SING,OXT,HXT,no,N,14,,80335,18088,SNC
1,,SING,N,C1,no,N,1,,80465,18094,ANI
2,,SING,N,HN1,no,N,2,,80465,18094,ANI
3,,SING,N,HN2,no,N,3,,80465,18094,ANI
4,,DOUB,C1,C2,yes,N,4,,80465,18094,ANI
5,,SING,C1,C6,yes,N,5,,80465,18094,ANI
6,,SING,C2,C3,yes,N,6,,80465,18094,ANI
7,,SING,C2,H2,no,N,7,,80465,18094,ANI
8,,DOUB,C3,C4,yes,N,8,,80465,18094,ANI
9,,SING,C3,H3,no,N,9,,80465,18094,ANI
10,,SING,C4,C5,yes,N,10,,80465,18094,ANI
11,,SING,C4,C7,no,N,11,,80465,18094,ANI
12,,DOUB,C5,C6,yes,N,12,,80465,18094,ANI
13,,SING,C5,H5,no,N,13,,80465,18094,ANI
14,,SING,C6,H6,no,N,14,,80465,18094,ANI
15,,SING,C7,F1,no,N,15,,80465,18094,ANI
16,,SING,C7,F2,no,N,16,,80465,18094,ANI
17,,SING,C7,F3,no,N,17,,80465,18094,ANI
1,,SING,PG,O3B,no,N,1,,80657,18103,GSP
2,,DOUB,PG,S1G,no,N,2,,80657,18103,GSP
3,,SING,PG,O2G,no,N,3,,80657,18103,GSP
4,,SING,PG,O3G,no,N,4,,80657,18103,GSP
5,,SING,O3B,PB,no,N,5,,80657,18103,GSP
6,,SING,O2G,HOG2,no,N,6,,80657,18103,GSP
7,,SING,O3G,HOG3,no,N,7,,80657,18103,GSP
8,,DOUB,PB,O1B,no,N,8,,80657,18103,GSP
9,,SING,PB,O2B,no,N,9,,80657,18103,GSP
10,,SING,PB,O3A,no,N,10,,80657,18103,GSP
11,,SING,O2B,HOB2,no,N,11,,80657,18103,GSP
12,,DOUB,PA,O1A,no,N,12,,80657,18103,GSP
13,,SING,PA,O2A,no,N,13,,80657,18103,GSP
14,,SING,PA,O3A,no,N,14,,80657,18103,GSP
15,,SING,PA,O5',no,N,15,,80657,18103,GSP
16,,SING,O2A,HOA2,no,N,16,,80657,18103,GSP
17,,SING,O5',C5',no,N,17,,80657,18103,GSP
18,,SING,C5',C4',no,N,18,,80657,18103,GSP
19,,SING,C5',H5'1,no,N,19,,80657,18103,GSP
20,,SING,C5',H5'2,no,N,20,,80657,18103,GSP
21,,SING,C4',O4',no,N,21,,80657,18103,GSP
22,,SING,C4',C3',no,N,22,,80657,18103,GSP
23,,SING,C4',H4',no,N,23,,80657,18103,GSP
24,,SING,O4',C1',no,N,24,,80657,18103,GSP
25,,SING,C3',O3',no,N,25,,80657,18103,GSP
26,,SING,C3',C2',no,N,26,,80657,18103,GSP
27,,SING,C3',H3',no,N,27,,80657,18103,GSP
28,,SING,O3',HO3',no,N,28,,80657,18103,GSP
29,,SING,C2',O2',no,N,29,,80657,18103,GSP
30,,SING,C2',C1',no,N,30,,80657,18103,GSP
31,,SING,C2',H2',no,N,31,,80657,18103,GSP
32,,SING,O2',HO2',no,N,32,,80657,18103,GSP
33,,SING,C1',N9,no,N,33,,80657,18103,GSP
34,,SING,C1',H1',no,N,34,,80657,18103,GSP
35,,SING,N9,C8,yes,N,35,,80657,18103,GSP
36,,SING,N9,C4,yes,N,36,,80657,18103,GSP
37,,DOUB,C8,N7,yes,N,37,,80657,18103,GSP
38,,SING,C8,H8,no,N,38,,80657,18103,GSP
39,,SING,N7,C5,yes,N,39,,80657,18103,GSP
40,,SING,C5,C6,no,N,40,,80657,18103,GSP
41,,DOUB,C5,C4,yes,N,41,,80657,18103,GSP
42,,DOUB,C6,O6,no,N,42,,80657,18103,GSP
43,,SING,C6,N1,no,N,43,,80657,18103,GSP
44,,SING,N1,C2,no,N,44,,80657,18103,GSP
45,,SING,N1,HN1,no,N,45,,80657,18103,GSP
46,,SING,C2,N2,no,N,46,,80657,18103,GSP
47,,DOUB,C2,N3,no,N,47,,80657,18103,GSP
48,,SING,N2,HN21,no,N,48,,80657,18103,GSP
49,,SING,N2,HN22,no,N,49,,80657,18103,GSP
50,,SING,N3,C4,no,N,50,,80657,18103,GSP
1,,SING,N,CA,no,N,1,,80698,18105,SEP
2,,SING,N,H,no,N,2,,80698,18105,SEP
3,,SING,N,H2,no,N,3,,80698,18105,SEP
4,,SING,CA,CB,no,N,4,,80698,18105,SEP
5,,SING,CA,C,no,N,5,,80698,18105,SEP
6,,SING,CA,HA,no,N,6,,80698,18105,SEP
7,,SING,CB,OG,no,N,7,,80698,18105,SEP
8,,SING,CB,HB2,no,N,8,,80698,18105,SEP
9,,SING,CB,HB3,no,N,9,,80698,18105,SEP
10,,SING,OG,P,no,N,10,,80698,18105,SEP
11,,DOUB,C,O,no,N,11,,80698,18105,SEP
12,,SING,C,OXT,no,N,12,,80698,18105,SEP
13,,SING,OXT,HXT,no,N,13,,80698,18105,SEP
14,,DOUB,P,O1P,no,N,14,,80698,18105,SEP
15,,SING,P,O2P,no,N,15,,80698,18105,SEP
16,,SING,P,O3P,no,N,16,,80698,18105,SEP
17,,SING,O2P,HOP2,no,N,17,,80698,18105,SEP
18,,SING,O3P,HOP3,no,N,18,,80698,18105,SEP
1,,SING,N16,C8,no,N,1,,80721,18106,3C3
2,,SING,N16,H161,no,N,2,,80721,18106,3C3
3,,SING,N16,H162,no,N,3,,80721,18106,3C3
4,,SING,C8,N10,no,N,4,,80721,18106,3C3
5,,DOUB,C8,C4,no,N,5,,80721,18106,3C3
6,,SING,N10,O14,no,N,6,,80721,18106,3C3
7,,SING,N10,H10,no,N,7,,80721,18106,3C3
8,,SING,O14,N12,no,N,8,,80721,18106,3C3
9,,SING,N12,C4,no,N,9,,80721,18106,3C3
10,,SING,N12,H12,no,N,10,,80721,18106,3C3
11,,SING,C4,C1,no,N,11,,80721,18106,3C3
12,,DOUB,C1,N3,yes,N,12,,80721,18106,3C3
13,,SING,C1,N7,yes,N,13,,80721,18106,3C3
14,,SING,N3,C2,yes,N,14,,80721,18106,3C3
15,,SING,N7,C18,no,N,15,,80721,18106,3C3
16,,SING,N7,N5,yes,N,16,,80721,18106,3C3
17,,SING,C18,C19,no,N,17,,80721,18106,3C3
18,,SING,C18,H181,no,N,18,,80721,18106,3C3
19,,SING,C18,H182,no,N,19,,80721,18106,3C3
20,,SING,C19,C20,no,N,20,,80721,18106,3C3
21,,SING,C19,H191,no,N,21,,80721,18106,3C3
22,,SING,C19,H192,no,N,22,,80721,18106,3C3
23,,SING,C20,H201,no,N,23,,80721,18106,3C3
24,,SING,C20,H202,no,N,24,,80721,18106,3C3
25,,SING,C20,H203,no,N,25,,80721,18106,3C3
26,,DOUB,N5,C2,yes,N,26,,80721,18106,3C3
27,,SING,C2,C6,no,N,27,,80721,18106,3C3
28,,SING,C6,N13,no,N,28,,80721,18106,3C3
29,,DOUB,C6,C9,no,N,29,,80721,18106,3C3
30,,SING,N13,O15,no,N,30,,80721,18106,3C3
31,,SING,N13,H13,no,N,31,,80721,18106,3C3
32,,SING,O15,N11,no,N,32,,80721,18106,3C3
33,,SING,N11,C9,no,N,33,,80721,18106,3C3
34,,SING,N11,H11,no,N,34,,80721,18106,3C3
35,,SING,C9,N17,no,N,35,,80721,18106,3C3
36,,SING,N17,H171,no,N,36,,80721,18106,3C3
37,,SING,N17,H172,no,N,37,,80721,18106,3C3
1,,SING,N,CA,no,N,1,,80722,18106,SEP
2,,SING,N,H,no,N,2,,80722,18106,SEP
3,,SING,N,H2,no,N,3,,80722,18106,SEP
4,,SING,CA,CB,no,N,4,,80722,18106,SEP
5,,SING,CA,C,no,N,5,,80722,18106,SEP
6,,SING,CA,HA,no,N,6,,80722,18106,SEP
7,,SING,CB,OG,no,N,7,,80722,18106,SEP
8,,SING,CB,HB2,no,N,8,,80722,18106,SEP
9,,SING,CB,HB3,no,N,9,,80722,18106,SEP
10,,SING,OG,P,no,N,10,,80722,18106,SEP
11,,DOUB,C,O,no,N,11,,80722,18106,SEP
12,,SING,C,OXT,no,N,12,,80722,18106,SEP
13,,SING,OXT,HXT,no,N,13,,80722,18106,SEP
14,,DOUB,P,O1P,no,N,14,,80722,18106,SEP
15,,SING,P,O2P,no,N,15,,80722,18106,SEP
16,,SING,P,O3P,no,N,16,,80722,18106,SEP
17,,SING,O2P,HOP2,no,N,17,,80722,18106,SEP
18,,SING,O3P,HOP3,no,N,18,,80722,18106,SEP
1,,DOUB,C1,O1,no,N,1,,81022,18122,HC4
2,,SING,C1,O2,no,N,2,,81022,18122,HC4
3,,SING,C1,C2,no,N,3,,81022,18122,HC4
4,,SING,O2,HO2,no,N,4,,81022,18122,HC4
5,,DOUB,C2,C3,no,E,5,,81022,18122,HC4
6,,SING,C2,H2,no,N,6,,81022,18122,HC4
7,,SING,C3,C1',no,N,7,,81022,18122,HC4
8,,SING,C3,H3,no,N,8,,81022,18122,HC4
9,,DOUB,C1',C2',yes,N,9,,81022,18122,HC4
10,,SING,C1',C6',yes,N,10,,81022,18122,HC4
11,,SING,C2',C3',yes,N,11,,81022,18122,HC4
12,,SING,C2',H2',no,N,12,,81022,18122,HC4
13,,DOUB,C3',C4',yes,N,13,,81022,18122,HC4
14,,SING,C3',H3',no,N,14,,81022,18122,HC4
15,,SING,C4',C5',yes,N,15,,81022,18122,HC4
16,,SING,C4',O4',no,N,16,,81022,18122,HC4
17,,DOUB,C5',C6',yes,N,17,,81022,18122,HC4
18,,SING,C5',H5',no,N,18,,81022,18122,HC4
19,,SING,C6',H6',no,N,19,,81022,18122,HC4
20,,SING,O4',HO4',no,N,20,,81022,18122,HC4
1,,DOUB,C11,O11,no,N,1,,81072,18125,BTN
2,,SING,C11,O12,no,N,2,,81072,18125,BTN
3,,SING,C11,C10,no,N,3,,81072,18125,BTN
4,,SING,O12,HO2,no,N,4,,81072,18125,BTN
5,,SING,C10,C9,no,N,5,,81072,18125,BTN
6,,SING,C10,H101,no,N,6,,81072,18125,BTN
7,,SING,C10,H102,no,N,7,,81072,18125,BTN
8,,SING,C9,C8,no,N,8,,81072,18125,BTN
9,,SING,C9,H91,no,N,9,,81072,18125,BTN
10,,SING,C9,H92,no,N,10,,81072,18125,BTN
11,,SING,C8,C7,no,N,11,,81072,18125,BTN
12,,SING,C8,H81,no,N,12,,81072,18125,BTN
13,,SING,C8,H82,no,N,13,,81072,18125,BTN
14,,SING,C7,C2,no,N,14,,81072,18125,BTN
15,,SING,C7,H71,no,N,15,,81072,18125,BTN
16,,SING,C7,H72,no,N,16,,81072,18125,BTN
17,,SING,C2,S1,no,N,17,,81072,18125,BTN
18,,SING,C2,C4,no,N,18,,81072,18125,BTN
19,,SING,C2,H2,no,N,19,,81072,18125,BTN
20,,SING,S1,C6,no,N,20,,81072,18125,BTN
21,,SING,C6,C5,no,N,21,,81072,18125,BTN
22,,SING,C6,H61,no,N,22,,81072,18125,BTN
23,,SING,C6,H62,no,N,23,,81072,18125,BTN
24,,SING,C5,N1,no,N,24,,81072,18125,BTN
25,,SING,C5,C4,no,N,25,,81072,18125,BTN
26,,SING,C5,H5,no,N,26,,81072,18125,BTN
27,,SING,N1,C3,no,N,27,,81072,18125,BTN
28,,SING,N1,HN1,no,N,28,,81072,18125,BTN
29,,DOUB,C3,O3,no,N,29,,81072,18125,BTN
30,,SING,C3,N2,no,N,30,,81072,18125,BTN
31,,SING,N2,C4,no,N,31,,81072,18125,BTN
32,,SING,N2,HN2,no,N,32,,81072,18125,BTN
33,,SING,C4,H4,no,N,33,,81072,18125,BTN
1,,SING,O,C5,no,N,1,,81243,18135,A2G
2,,SING,C1,O,no,N,2,,81243,18135,A2G
3,,SING,C1,C2,no,N,3,,81243,18135,A2G
4,,SING,C1,H1,no,N,4,,81243,18135,A2G
5,,SING,O1,C1,no,N,5,,81243,18135,A2G
6,,SING,O1,HO1,no,N,6,,81243,18135,A2G
7,,SING,C2,C3,no,N,7,,81243,18135,A2G
8,,SING,C2,H2,no,N,8,,81243,18135,A2G
9,,SING,N2,C2,no,N,9,,81243,18135,A2G
10,,SING,N2,HN2,no,N,10,,81243,18135,A2G
11,,SING,C3,C4,no,N,11,,81243,18135,A2G
12,,SING,C3,O3,no,N,12,,81243,18135,A2G
13,,SING,C3,H3,no,N,13,,81243,18135,A2G
14,,SING,O3,HO3,no,N,14,,81243,18135,A2G
15,,SING,C4,O4,no,N,15,,81243,18135,A2G
16,,SING,C4,H4,no,N,16,,81243,18135,A2G
17,,SING,O4,HO4,no,N,17,,81243,18135,A2G
18,,SING,C5,C4,no,N,18,,81243,18135,A2G
19,,SING,C5,C6,no,N,19,,81243,18135,A2G
20,,SING,C5,H5,no,N,20,,81243,18135,A2G
21,,SING,C6,O6,no,N,21,,81243,18135,A2G
22,,SING,C6,H6,no,N,22,,81243,18135,A2G
23,,SING,C7,N2,no,N,23,,81243,18135,A2G
24,,DOUB,O7,C7,no,N,24,,81243,18135,A2G
25,,SING,C8,C7,no,N,25,,81243,18135,A2G
26,,SING,C8,H8,no,N,26,,81243,18135,A2G
27,,SING,C8,H8A,no,N,27,,81243,18135,A2G
28,,SING,C8,H8B,no,N,28,,81243,18135,A2G
29,,SING,C6,H14,no,N,29,,81243,18135,A2G
30,,SING,O6,H15,no,N,30,,81243,18135,A2G
1,,SING,N,HN1,no,N,1,,81387,18146,NH2
2,,SING,N,HN2,no,N,2,,81387,18146,NH2
1,,DOUB,C,O,no,N,1,,81637,18159,ACE
2,,SING,C,CH3,no,N,2,,81637,18159,ACE
3,,SING,C,H,no,N,3,,81637,18159,ACE
4,,SING,CH3,H1,no,N,4,,81637,18159,ACE
5,,SING,CH3,H2,no,N,5,,81637,18159,ACE
6,,SING,CH3,H3,no,N,6,,81637,18159,ACE
1,,DOUB,C,O,no,N,1,,81668,18160,ACE
2,,SING,C,CH3,no,N,2,,81668,18160,ACE
3,,SING,C,H,no,N,3,,81668,18160,ACE
4,,SING,CH3,H1,no,N,4,,81668,18160,ACE
5,,SING,CH3,H2,no,N,5,,81668,18160,ACE
6,,SING,CH3,H3,no,N,6,,81668,18160,ACE
1,,SING,N,C1,no,N,1,,81868,18170,ANI
2,,SING,N,HN1,no,N,2,,81868,18170,ANI
3,,SING,N,HN2,no,N,3,,81868,18170,ANI
4,,DOUB,C1,C2,yes,N,4,,81868,18170,ANI
5,,SING,C1,C6,yes,N,5,,81868,18170,ANI
6,,SING,C2,C3,yes,N,6,,81868,18170,ANI
7,,SING,C2,H2,no,N,7,,81868,18170,ANI
8,,DOUB,C3,C4,yes,N,8,,81868,18170,ANI
9,,SING,C3,H3,no,N,9,,81868,18170,ANI
10,,SING,C4,C5,yes,N,10,,81868,18170,ANI
11,,SING,C4,C7,no,N,11,,81868,18170,ANI
12,,DOUB,C5,C6,yes,N,12,,81868,18170,ANI
13,,SING,C5,H5,no,N,13,,81868,18170,ANI
14,,SING,C6,H6,no,N,14,,81868,18170,ANI
15,,SING,C7,F1,no,N,15,,81868,18170,ANI
16,,SING,C7,F2,no,N,16,,81868,18170,ANI
17,,SING,C7,F3,no,N,17,,81868,18170,ANI
1,,SING,N,CA,no,N,1,,82046,18182,PTR
2,,SING,N,H,no,N,2,,82046,18182,PTR
3,,SING,N,HN2,no,N,3,,82046,18182,PTR
4,,SING,CA,C,no,N,4,,82046,18182,PTR
5,,SING,CA,CB,no,N,5,,82046,18182,PTR
6,,SING,CA,HA,no,N,6,,82046,18182,PTR
7,,DOUB,C,O,no,N,7,,82046,18182,PTR
8,,SING,C,OXT,no,N,8,,82046,18182,PTR
9,,SING,OXT,HXT,no,N,9,,82046,18182,PTR
10,,SING,CB,CG,no,N,10,,82046,18182,PTR
11,,SING,CB,HB2,no,N,11,,82046,18182,PTR
12,,SING,CB,HB3,no,N,12,,82046,18182,PTR
13,,DOUB,CG,CD1,yes,N,13,,82046,18182,PTR
14,,SING,CG,CD2,yes,N,14,,82046,18182,PTR
15,,SING,CD1,CE1,yes,N,15,,82046,18182,PTR
16,,SING,CD1,HD1,no,N,16,,82046,18182,PTR
17,,DOUB,CD2,CE2,yes,N,17,,82046,18182,PTR
18,,SING,CD2,HD2,no,N,18,,82046,18182,PTR
19,,DOUB,CE1,CZ,yes,N,19,,82046,18182,PTR
20,,SING,CE1,HE1,no,N,20,,82046,18182,PTR
21,,SING,CE2,CZ,yes,N,21,,82046,18182,PTR
22,,SING,CE2,HE2,no,N,22,,82046,18182,PTR
23,,SING,CZ,OH,no,N,23,,82046,18182,PTR
24,,SING,OH,P,no,N,24,,82046,18182,PTR
25,,DOUB,P,O1P,no,N,25,,82046,18182,PTR
26,,SING,P,O2P,no,N,26,,82046,18182,PTR
27,,SING,P,O3P,no,N,27,,82046,18182,PTR
28,,SING,O2P,HO2P,no,N,28,,82046,18182,PTR
29,,SING,O3P,HO3P,no,N,29,,82046,18182,PTR
1,,SING,N1A,C2A,yes,N,1,,82468,18202,ACO
2,,DOUB,N1A,C6A,yes,N,2,,82468,18202,ACO
3,,DOUB,C2A,N3A,yes,N,3,,82468,18202,ACO
4,,SING,C2A,H2A,no,N,4,,82468,18202,ACO
5,,SING,N3A,C4A,yes,N,5,,82468,18202,ACO
6,,DOUB,C4A,C5A,yes,N,6,,82468,18202,ACO
7,,SING,C4A,N9A,yes,N,7,,82468,18202,ACO
8,,SING,C5A,C6A,yes,N,8,,82468,18202,ACO
9,,SING,C5A,N7A,yes,N,9,,82468,18202,ACO
10,,SING,C6A,N6A,no,N,10,,82468,18202,ACO
11,,SING,N6A,H61A,no,N,11,,82468,18202,ACO
12,,SING,N6A,H62A,no,N,12,,82468,18202,ACO
13,,DOUB,N7A,C8A,yes,N,13,,82468,18202,ACO
14,,SING,C8A,N9A,yes,N,14,,82468,18202,ACO
15,,SING,C8A,H8A,no,N,15,,82468,18202,ACO
16,,SING,N9A,C1B,no,N,16,,82468,18202,ACO
17,,SING,C1B,C2B,no,N,17,,82468,18202,ACO
18,,SING,C1B,O4B,no,N,18,,82468,18202,ACO
19,,SING,C1B,H1B,no,N,19,,82468,18202,ACO
20,,SING,C2B,O2B,no,N,20,,82468,18202,ACO
21,,SING,C2B,C3B,no,N,21,,82468,18202,ACO
22,,SING,C2B,H2B,no,N,22,,82468,18202,ACO
23,,SING,O2B,HO2A,no,N,23,,82468,18202,ACO
24,,SING,C3B,O3B,no,N,24,,82468,18202,ACO
25,,SING,C3B,C4B,no,N,25,,82468,18202,ACO
26,,SING,C3B,H3B,no,N,26,,82468,18202,ACO
27,,SING,O3B,P3B,no,N,27,,82468,18202,ACO
28,,DOUB,P3B,O7A,no,N,28,,82468,18202,ACO
29,,SING,P3B,O8A,no,N,29,,82468,18202,ACO
30,,SING,P3B,O9A,no,N,30,,82468,18202,ACO
31,,SING,O8A,HOA8,no,N,31,,82468,18202,ACO
32,,SING,O9A,HOA9,no,N,32,,82468,18202,ACO
33,,SING,C4B,O4B,no,N,33,,82468,18202,ACO
34,,SING,C4B,C5B,no,N,34,,82468,18202,ACO
35,,SING,C4B,H4B,no,N,35,,82468,18202,ACO
36,,SING,C5B,O5B,no,N,36,,82468,18202,ACO
37,,SING,C5B,H51A,no,N,37,,82468,18202,ACO
38,,SING,C5B,H52A,no,N,38,,82468,18202,ACO
39,,SING,O5B,P1A,no,N,39,,82468,18202,ACO
40,,DOUB,P1A,O1A,no,N,40,,82468,18202,ACO
41,,SING,P1A,O2A,no,N,41,,82468,18202,ACO
42,,SING,P1A,O3A,no,N,42,,82468,18202,ACO
43,,SING,O2A,HOA2,no,N,43,,82468,18202,ACO
44,,SING,O3A,P2A,no,N,44,,82468,18202,ACO
45,,DOUB,P2A,O4A,no,N,45,,82468,18202,ACO
46,,SING,P2A,O5A,no,N,46,,82468,18202,ACO
47,,SING,P2A,O6A,no,N,47,,82468,18202,ACO
48,,SING,O5A,HOA5,no,N,48,,82468,18202,ACO
49,,SING,O6A,CCP,no,N,49,,82468,18202,ACO
50,,SING,CBP,CCP,no,N,50,,82468,18202,ACO
51,,SING,CBP,CDP,no,N,51,,82468,18202,ACO
52,,SING,CBP,CEP,no,N,52,,82468,18202,ACO
53,,SING,CBP,CAP,no,N,53,,82468,18202,ACO
54,,SING,CCP,H121,no,N,54,,82468,18202,ACO
55,,SING,CCP,H122,no,N,55,,82468,18202,ACO
56,,SING,CDP,H131,no,N,56,,82468,18202,ACO
57,,SING,CDP,H132,no,N,57,,82468,18202,ACO
58,,SING,CDP,H133,no,N,58,,82468,18202,ACO
59,,SING,CEP,H141,no,N,59,,82468,18202,ACO
60,,SING,CEP,H142,no,N,60,,82468,18202,ACO
61,,SING,CEP,H143,no,N,61,,82468,18202,ACO
62,,SING,CAP,OAP,no,N,62,,82468,18202,ACO
63,,SING,CAP,C9P,no,N,63,,82468,18202,ACO
64,,SING,CAP,H10,no,N,64,,82468,18202,ACO
65,,SING,OAP,HO1,no,N,65,,82468,18202,ACO
66,,DOUB,C9P,O9P,no,N,66,,82468,18202,ACO
67,,SING,C9P,N8P,no,N,67,,82468,18202,ACO
68,,SING,N8P,C7P,no,N,68,,82468,18202,ACO
69,,SING,N8P,HN8,no,N,69,,82468,18202,ACO
70,,SING,C7P,C6P,no,N,70,,82468,18202,ACO
71,,SING,C7P,H71,no,N,71,,82468,18202,ACO
72,,SING,C7P,H72,no,N,72,,82468,18202,ACO
73,,SING,C6P,C5P,no,N,73,,82468,18202,ACO
74,,SING,C6P,H61,no,N,74,,82468,18202,ACO
75,,SING,C6P,H62,no,N,75,,82468,18202,ACO
76,,DOUB,C5P,O5P,no,N,76,,82468,18202,ACO
77,,SING,C5P,N4P,no,N,77,,82468,18202,ACO
78,,SING,N4P,C3P,no,N,78,,82468,18202,ACO
79,,SING,N4P,HN4,no,N,79,,82468,18202,ACO
80,,SING,C3P,C2P,no,N,80,,82468,18202,ACO
81,,SING,C3P,H31,no,N,81,,82468,18202,ACO
82,,SING,C3P,H32,no,N,82,,82468,18202,ACO
83,,SING,C2P,S1P,no,N,83,,82468,18202,ACO
84,,SING,C2P,H21,no,N,84,,82468,18202,ACO
85,,SING,C2P,H22,no,N,85,,82468,18202,ACO
86,,SING,S1P,C,no,N,86,,82468,18202,ACO
87,,DOUB,C,O,no,N,87,,82468,18202,ACO
88,,SING,C,CH3,no,N,88,,82468,18202,ACO
89,,SING,CH3,HH31,no,N,89,,82468,18202,ACO
90,,SING,CH3,HH32,no,N,90,,82468,18202,ACO
91,,SING,CH3,HH33,no,N,91,,82468,18202,ACO
1,,SING,N,CA,no,N,1,,82469,18202,MSE
2,,SING,N,H,no,N,2,,82469,18202,MSE
3,,SING,N,HN2,no,N,3,,82469,18202,MSE
4,,SING,CA,C,no,N,4,,82469,18202,MSE
5,,SING,CA,CB,no,N,5,,82469,18202,MSE
6,,SING,CA,HA,no,N,6,,82469,18202,MSE
7,,DOUB,C,O,no,N,7,,82469,18202,MSE
8,,SING,C,OXT,no,N,8,,82469,18202,MSE
9,,SING,OXT,HXT,no,N,9,,82469,18202,MSE
10,,SING,CB,CG,no,N,10,,82469,18202,MSE
11,,SING,CB,HB2,no,N,11,,82469,18202,MSE
12,,SING,CB,HB3,no,N,12,,82469,18202,MSE
13,,SING,CG,SE,no,N,13,,82469,18202,MSE
14,,SING,CG,HG2,no,N,14,,82469,18202,MSE
15,,SING,CG,HG3,no,N,15,,82469,18202,MSE
16,,SING,SE,CE,no,N,16,,82469,18202,MSE
17,,SING,CE,HE1,no,N,17,,82469,18202,MSE
18,,SING,CE,HE2,no,N,18,,82469,18202,MSE
19,,SING,CE,HE3,no,N,19,,82469,18202,MSE
1,,SING,N,C1,no,N,1,,82612,18210,ANI
2,,SING,N,HN1,no,N,2,,82612,18210,ANI
3,,SING,N,HN2,no,N,3,,82612,18210,ANI
4,,DOUB,C1,C2,yes,N,4,,82612,18210,ANI
5,,SING,C1,C6,yes,N,5,,82612,18210,ANI
6,,SING,C2,C3,yes,N,6,,82612,18210,ANI
7,,SING,C2,H2,no,N,7,,82612,18210,ANI
8,,DOUB,C3,C4,yes,N,8,,82612,18210,ANI
9,,SING,C3,H3,no,N,9,,82612,18210,ANI
10,,SING,C4,C5,yes,N,10,,82612,18210,ANI
11,,SING,C4,C7,no,N,11,,82612,18210,ANI
12,,DOUB,C5,C6,yes,N,12,,82612,18210,ANI
13,,SING,C5,H5,no,N,13,,82612,18210,ANI
14,,SING,C6,H6,no,N,14,,82612,18210,ANI
15,,SING,C7,F1,no,N,15,,82612,18210,ANI
16,,SING,C7,F2,no,N,16,,82612,18210,ANI
17,,SING,C7,F3,no,N,17,,82612,18210,ANI
1,,SING,N,CA,no,N,1,,83086,18230,HCS
2,,SING,N,H,no,N,2,,83086,18230,HCS
3,,SING,N,H2,no,N,3,,83086,18230,HCS
4,,SING,CA,CB,no,N,4,,83086,18230,HCS
5,,SING,CA,C,no,N,5,,83086,18230,HCS
6,,SING,CA,HCA,no,N,6,,83086,18230,HCS
7,,SING,CB,CG,no,N,7,,83086,18230,HCS
8,,SING,CB,HB2,no,N,8,,83086,18230,HCS
9,,SING,CB,HB3,no,N,9,,83086,18230,HCS
10,,SING,CG,SD,no,N,10,,83086,18230,HCS
11,,SING,CG,HG2,no,N,11,,83086,18230,HCS
12,,SING,CG,HG3,no,N,12,,83086,18230,HCS
13,,SING,SD,HD,no,N,13,,83086,18230,HCS
14,,SING,C,OXT,no,N,14,,83086,18230,HCS
15,,DOUB,C,O,no,N,15,,83086,18230,HCS
16,,SING,OXT,HXT,no,N,16,,83086,18230,HCS
1,,SING,C39,C40,no,N,1,,83204,18236,D1R
2,,SING,C39,N3,no,N,2,,83204,18236,D1R
3,,SING,C39,H391,no,N,3,,83204,18236,D1R
4,,SING,C39,H392,no,N,4,,83204,18236,D1R
5,,SING,C40,N4,no,N,5,,83204,18236,D1R
6,,SING,C40,H401,no,N,6,,83204,18236,D1R
7,,SING,C40,H402,no,N,7,,83204,18236,D1R
8,,SING,N4,C33,no,N,8,,83204,18236,D1R
9,,SING,N4,C49,no,N,9,,83204,18236,D1R
10,,SING,C33,H331,no,N,10,,83204,18236,D1R
11,,SING,C33,H332,no,N,11,,83204,18236,D1R
12,,SING,C33,H333,no,N,12,,83204,18236,D1R
13,,SING,C49,C48,no,N,13,,83204,18236,D1R
14,,SING,C49,H491,no,N,14,,83204,18236,D1R
15,,SING,C49,H492,no,N,15,,83204,18236,D1R
16,,SING,C48,N3,no,N,16,,83204,18236,D1R
17,,SING,C48,H481,no,N,17,,83204,18236,D1R
18,,SING,C48,H482,no,N,18,,83204,18236,D1R
19,,SING,N3,C8,no,N,19,,83204,18236,D1R
20,,SING,C8,N1,no,N,20,,83204,18236,D1R
21,,DOUB,C8,O2,no,N,21,,83204,18236,D1R
22,,SING,N1,C9,no,N,22,,83204,18236,D1R
23,,SING,N1,HN1,no,N,23,,83204,18236,D1R
24,,SING,C9,C17,no,N,24,,83204,18236,D1R
25,,SING,C9,C10,no,N,25,,83204,18236,D1R
26,,SING,C9,H9,no,N,26,,83204,18236,D1R
27,,SING,C10,C11,no,N,27,,83204,18236,D1R
28,,SING,C10,H101,no,N,28,,83204,18236,D1R
29,,SING,C10,H102,no,N,29,,83204,18236,D1R
30,,SING,C11,C12,yes,N,30,,83204,18236,D1R
31,,DOUB,C11,C16,yes,N,31,,83204,18236,D1R
32,,DOUB,C12,C13,yes,N,32,,83204,18236,D1R
33,,SING,C12,H12,no,N,33,,83204,18236,D1R
34,,SING,C13,C14,yes,N,34,,83204,18236,D1R
35,,SING,C13,H13,no,N,35,,83204,18236,D1R
36,,DOUB,C14,C15,yes,N,36,,83204,18236,D1R
37,,SING,C14,H14,no,N,37,,83204,18236,D1R
38,,SING,C15,C16,yes,N,38,,83204,18236,D1R
39,,SING,C15,H15,no,N,39,,83204,18236,D1R
40,,SING,C16,H16,no,N,40,,83204,18236,D1R
41,,DOUB,C17,O3,no,N,41,,83204,18236,D1R
42,,SING,C17,N2,no,N,42,,83204,18236,D1R
43,,SING,N2,C18,no,N,43,,83204,18236,D1R
44,,SING,N2,HN2,no,N,44,,83204,18236,D1R
45,,SING,C18,C19,no,N,45,,83204,18236,D1R
46,,SING,C18,C27,no,N,46,,83204,18236,D1R
47,,SING,C18,H18,no,N,47,,83204,18236,D1R
48,,SING,C19,C20,no,N,48,,83204,18236,D1R
49,,SING,C19,H191,no,N,49,,83204,18236,D1R
50,,SING,C19,H192,no,N,50,,83204,18236,D1R
51,,SING,C20,C21,no,N,51,,83204,18236,D1R
52,,SING,C20,H201,no,N,52,,83204,18236,D1R
53,,SING,C20,H202,no,N,53,,83204,18236,D1R
54,,SING,C21,C22,yes,N,54,,83204,18236,D1R
55,,DOUB,C21,C26,yes,N,55,,83204,18236,D1R
56,,DOUB,C22,C23,yes,N,56,,83204,18236,D1R
57,,SING,C22,H22,no,N,57,,83204,18236,D1R
58,,SING,C23,C24,yes,N,58,,83204,18236,D1R
59,,SING,C23,H23,no,N,59,,83204,18236,D1R
60,,DOUB,C24,C25,yes,N,60,,83204,18236,D1R
61,,SING,C24,H24,no,N,61,,83204,18236,D1R
62,,SING,C25,C26,yes,N,62,,83204,18236,D1R
63,,SING,C25,H25,no,N,63,,83204,18236,D1R
64,,SING,C26,H26,no,N,64,,83204,18236,D1R
65,,SING,C27,C28,no,N,65,,83204,18236,D1R
66,,SING,C27,H271,no,N,66,,83204,18236,D1R
67,,SING,C27,H272,no,N,67,,83204,18236,D1R
68,,SING,C28,S1,no,N,68,,83204,18236,D1R
69,,SING,C28,H281,no,N,69,,83204,18236,D1R
70,,SING,C28,H282,no,N,70,,83204,18236,D1R
71,,DOUB,S1,O4,no,N,71,,83204,18236,D1R
72,,DOUB,S1,O5,no,N,72,,83204,18236,D1R
73,,SING,S1,CAB,no,N,73,,83204,18236,D1R
74,,DOUB,CAB,CAA,yes,N,74,,83204,18236,D1R
75,,SING,CAB,CAD,yes,N,75,,83204,18236,D1R
76,,SING,CAA,CAC,yes,N,76,,83204,18236,D1R
77,,SING,CAA,HAA,no,N,77,,83204,18236,D1R
78,,DOUB,CAC,CAE,yes,N,78,,83204,18236,D1R
79,,SING,CAC,HAC,no,N,79,,83204,18236,D1R
80,,SING,CAE,CAF,yes,N,80,,83204,18236,D1R
81,,SING,CAE,HAE,no,N,81,,83204,18236,D1R
82,,DOUB,CAF,CAD,yes,N,82,,83204,18236,D1R
83,,SING,CAF,HAF,no,N,83,,83204,18236,D1R
84,,SING,CAD,HAD,no,N,84,,83204,18236,D1R
1,,DOUB,C,O,no,N,1,,83239,18238,ACE
2,,SING,C,CH3,no,N,2,,83239,18238,ACE
3,,SING,C,H,no,N,3,,83239,18238,ACE
4,,SING,CH3,H1,no,N,4,,83239,18238,ACE
5,,SING,CH3,H2,no,N,5,,83239,18238,ACE
6,,SING,CH3,H3,no,N,6,,83239,18238,ACE
1,,SING,N,HN1,no,N,1,,83240,18238,NH2
2,,SING,N,HN2,no,N,2,,83240,18238,NH2
1,,SING,C1,C2,no,N,1,,83241,18238,33B
2,,SING,C1,H1,no,N,2,,83241,18238,33B
3,,SING,C1,H1A,no,N,3,,83241,18238,33B
4,,SING,C2,N3,no,N,4,,83241,18238,33B
5,,DOUB,O2,C2,no,N,5,,83241,18238,33B
6,,SING,N3,HN3,no,N,6,,83241,18238,33B
7,,SING,C4,N3,no,N,7,,83241,18238,33B
8,,SING,C4,C5,yes,N,8,,83241,18238,33B
9,,SING,C5,H5,no,N,9,,83241,18238,33B
10,,DOUB,C6,C4,yes,N,10,,83241,18238,33B
11,,SING,S6,C6,no,N,11,,83241,18238,33B
12,,SING,S6,O62,no,N,12,,83241,18238,33B
13,,DOUB,C7,C5,yes,N,13,,83241,18238,33B
14,,SING,C7,H7,no,N,14,,83241,18238,33B
15,,SING,C8,C6,yes,N,15,,83241,18238,33B
16,,DOUB,C8,C9,yes,N,16,,83241,18238,33B
17,,SING,C9,C7,yes,N,17,,83241,18238,33B
18,,SING,N10,C9,no,N,18,,83241,18238,33B
19,,DOUB,N10,N11,no,N,19,,83241,18238,33B
20,,SING,C12,N11,no,N,20,,83241,18238,33B
21,,SING,C12,C13,yes,N,21,,83241,18238,33B
22,,SING,C13,H13,no,N,22,,83241,18238,33B
23,,DOUB,C14,C12,yes,N,23,,83241,18238,33B
24,,DOUB,C15,C13,yes,N,24,,83241,18238,33B
25,,SING,C15,H15,no,N,25,,83241,18238,33B
26,,SING,C16,C14,yes,N,26,,83241,18238,33B
27,,DOUB,C16,C17,yes,N,27,,83241,18238,33B
28,,SING,C17,C15,yes,N,28,,83241,18238,33B
29,,SING,S17,C16,no,N,29,,83241,18238,33B
30,,SING,N18,C17,no,N,30,,83241,18238,33B
31,,SING,N18,C19,no,N,31,,83241,18238,33B
32,,DOUB,C19,O19,no,N,32,,83241,18238,33B
33,,SING,C20,C19,no,N,33,,83241,18238,33B
34,,SING,C20,CL2,no,N,34,,83241,18238,33B
35,,SING,C20,H20A,no,N,35,,83241,18238,33B
36,,DOUB,O61,S6,no,N,36,,83241,18238,33B
37,,SING,O62,HO62,no,N,37,,83241,18238,33B
38,,DOUB,O63,S6,no,N,38,,83241,18238,33B
39,,DOUB,O71,S17,no,N,39,,83241,18238,33B
40,,SING,O72,S17,no,N,40,,83241,18238,33B
41,,SING,O72,HO72,no,N,41,,83241,18238,33B
42,,DOUB,O73,S17,no,N,42,,83241,18238,33B
43,,SING,H8,C8,no,N,43,,83241,18238,33B
44,,SING,CL1,C1,no,N,44,,83241,18238,33B
45,,SING,H14,C14,no,N,45,,83241,18238,33B
46,,SING,HN18,N18,no,N,46,,83241,18238,33B
47,,SING,H20,C20,no,N,47,,83241,18238,33B
1,,DOUB,PG,O1G,no,N,1,,83443,18251,GCP
2,,SING,PG,O2G,no,N,2,,83443,18251,GCP
3,,SING,PG,O3G,no,N,3,,83443,18251,GCP
4,,SING,PG,C3B,no,N,4,,83443,18251,GCP
5,,SING,O2G,HOG2,no,N,5,,83443,18251,GCP
6,,SING,O3G,HOG3,no,N,6,,83443,18251,GCP
7,,SING,C3B,PB,no,N,7,,83443,18251,GCP
8,,SING,C3B,H3B1,no,N,8,,83443,18251,GCP
9,,SING,C3B,H3B2,no,N,9,,83443,18251,GCP
10,,DOUB,PB,O1B,no,N,10,,83443,18251,GCP
11,,SING,PB,O2B,no,N,11,,83443,18251,GCP
12,,SING,PB,O3A,no,N,12,,83443,18251,GCP
13,,SING,O2B,HOB2,no,N,13,,83443,18251,GCP
14,,SING,O3A,PA,no,N,14,,83443,18251,GCP
15,,DOUB,PA,O1A,no,N,15,,83443,18251,GCP
16,,SING,PA,O2A,no,N,16,,83443,18251,GCP
17,,SING,PA,O5',no,N,17,,83443,18251,GCP
18,,SING,O2A,HOA2,no,N,18,,83443,18251,GCP
19,,SING,O5',C5',no,N,19,,83443,18251,GCP
20,,SING,C5',C4',no,N,20,,83443,18251,GCP
21,,SING,C5',H5'2,no,N,21,,83443,18251,GCP
22,,SING,C5',H5'1,no,N,22,,83443,18251,GCP
23,,SING,C4',O4',no,N,23,,83443,18251,GCP
24,,SING,C4',C3',no,N,24,,83443,18251,GCP
25,,SING,C4',H4',no,N,25,,83443,18251,GCP
26,,SING,O4',C1',no,N,26,,83443,18251,GCP
27,,SING,C3',O3',no,N,27,,83443,18251,GCP
28,,SING,C3',C2',no,N,28,,83443,18251,GCP
29,,SING,C3',H3',no,N,29,,83443,18251,GCP
30,,SING,O3',HO3',no,N,30,,83443,18251,GCP
31,,SING,C2',O2',no,N,31,,83443,18251,GCP
32,,SING,C2',C1',no,N,32,,83443,18251,GCP
33,,SING,C2',H2',no,N,33,,83443,18251,GCP
34,,SING,O2',HO2',no,N,34,,83443,18251,GCP
35,,SING,C1',N9,no,N,35,,83443,18251,GCP
36,,SING,C1',H1',no,N,36,,83443,18251,GCP
37,,SING,N9,C8,yes,N,37,,83443,18251,GCP
38,,SING,N9,C4,yes,N,38,,83443,18251,GCP
39,,DOUB,C8,N7,yes,N,39,,83443,18251,GCP
40,,SING,C8,H8,no,N,40,,83443,18251,GCP
41,,SING,N7,C5,yes,N,41,,83443,18251,GCP
42,,SING,C5,C6,yes,N,42,,83443,18251,GCP
43,,DOUB,C5,C4,yes,N,43,,83443,18251,GCP
44,,DOUB,C6,O6,no,N,44,,83443,18251,GCP
45,,SING,C6,N1,yes,N,45,,83443,18251,GCP
46,,SING,N1,C2,yes,N,46,,83443,18251,GCP
47,,SING,N1,HN1,no,N,47,,83443,18251,GCP
48,,SING,C2,N2,no,N,48,,83443,18251,GCP
49,,DOUB,C2,N3,yes,N,49,,83443,18251,GCP
50,,SING,N2,HN21,no,N,50,,83443,18251,GCP
51,,SING,N2,HN22,no,N,51,,83443,18251,GCP
52,,SING,N3,C4,yes,N,52,,83443,18251,GCP
1,,DOUB,PG,O1G,no,N,1,,83468,18252,GCP
2,,SING,PG,O2G,no,N,2,,83468,18252,GCP
3,,SING,PG,O3G,no,N,3,,83468,18252,GCP
4,,SING,PG,C3B,no,N,4,,83468,18252,GCP
5,,SING,O2G,HOG2,no,N,5,,83468,18252,GCP
6,,SING,O3G,HOG3,no,N,6,,83468,18252,GCP
7,,SING,C3B,PB,no,N,7,,83468,18252,GCP
8,,SING,C3B,H3B1,no,N,8,,83468,18252,GCP
9,,SING,C3B,H3B2,no,N,9,,83468,18252,GCP
10,,DOUB,PB,O1B,no,N,10,,83468,18252,GCP
11,,SING,PB,O2B,no,N,11,,83468,18252,GCP
12,,SING,PB,O3A,no,N,12,,83468,18252,GCP
13,,SING,O2B,HOB2,no,N,13,,83468,18252,GCP
14,,SING,O3A,PA,no,N,14,,83468,18252,GCP
15,,DOUB,PA,O1A,no,N,15,,83468,18252,GCP
16,,SING,PA,O2A,no,N,16,,83468,18252,GCP
17,,SING,PA,O5',no,N,17,,83468,18252,GCP
18,,SING,O2A,HOA2,no,N,18,,83468,18252,GCP
19,,SING,O5',C5',no,N,19,,83468,18252,GCP
20,,SING,C5',C4',no,N,20,,83468,18252,GCP
21,,SING,C5',H5'2,no,N,21,,83468,18252,GCP
22,,SING,C5',H5'1,no,N,22,,83468,18252,GCP
23,,SING,C4',O4',no,N,23,,83468,18252,GCP
24,,SING,C4',C3',no,N,24,,83468,18252,GCP
25,,SING,C4',H4',no,N,25,,83468,18252,GCP
26,,SING,O4',C1',no,N,26,,83468,18252,GCP
27,,SING,C3',O3',no,N,27,,83468,18252,GCP
28,,SING,C3',C2',no,N,28,,83468,18252,GCP
29,,SING,C3',H3',no,N,29,,83468,18252,GCP
30,,SING,O3',HO3',no,N,30,,83468,18252,GCP
31,,SING,C2',O2',no,N,31,,83468,18252,GCP
32,,SING,C2',C1',no,N,32,,83468,18252,GCP
33,,SING,C2',H2',no,N,33,,83468,18252,GCP
34,,SING,O2',HO2',no,N,34,,83468,18252,GCP
35,,SING,C1',N9,no,N,35,,83468,18252,GCP
36,,SING,C1',H1',no,N,36,,83468,18252,GCP
37,,SING,N9,C8,yes,N,37,,83468,18252,GCP
38,,SING,N9,C4,yes,N,38,,83468,18252,GCP
39,,DOUB,C8,N7,yes,N,39,,83468,18252,GCP
40,,SING,C8,H8,no,N,40,,83468,18252,GCP
41,,SING,N7,C5,yes,N,41,,83468,18252,GCP
42,,SING,C5,C6,yes,N,42,,83468,18252,GCP
43,,DOUB,C5,C4,yes,N,43,,83468,18252,GCP
44,,DOUB,C6,O6,no,N,44,,83468,18252,GCP
45,,SING,C6,N1,yes,N,45,,83468,18252,GCP
46,,SING,N1,C2,yes,N,46,,83468,18252,GCP
47,,SING,N1,HN1,no,N,47,,83468,18252,GCP
48,,SING,C2,N2,no,N,48,,83468,18252,GCP
49,,DOUB,C2,N3,yes,N,49,,83468,18252,GCP
50,,SING,N2,HN21,no,N,50,,83468,18252,GCP
51,,SING,N2,HN22,no,N,51,,83468,18252,GCP
52,,SING,N3,C4,yes,N,52,,83468,18252,GCP
1,,DOUB,C1,O1,no,N,1,,83885,18282,MYR
2,,SING,C1,O2,no,N,2,,83885,18282,MYR
3,,SING,C1,C2,no,N,3,,83885,18282,MYR
4,,SING,O2,HO2,no,N,4,,83885,18282,MYR
5,,SING,C2,C3,no,N,5,,83885,18282,MYR
6,,SING,C2,H21,no,N,6,,83885,18282,MYR
7,,SING,C2,H22,no,N,7,,83885,18282,MYR
8,,SING,C3,C4,no,N,8,,83885,18282,MYR
9,,SING,C3,H31,no,N,9,,83885,18282,MYR
10,,SING,C3,H32,no,N,10,,83885,18282,MYR
11,,SING,C4,C5,no,N,11,,83885,18282,MYR
12,,SING,C4,H41,no,N,12,,83885,18282,MYR
13,,SING,C4,H42,no,N,13,,83885,18282,MYR
14,,SING,C5,C6,no,N,14,,83885,18282,MYR
15,,SING,C5,H51,no,N,15,,83885,18282,MYR
16,,SING,C5,H52,no,N,16,,83885,18282,MYR
17,,SING,C6,C7,no,N,17,,83885,18282,MYR
18,,SING,C6,H61,no,N,18,,83885,18282,MYR
19,,SING,C6,H62,no,N,19,,83885,18282,MYR
20,,SING,C7,C8,no,N,20,,83885,18282,MYR
21,,SING,C7,H71,no,N,21,,83885,18282,MYR
22,,SING,C7,H72,no,N,22,,83885,18282,MYR
23,,SING,C8,C9,no,N,23,,83885,18282,MYR
24,,SING,C8,H81,no,N,24,,83885,18282,MYR
25,,SING,C8,H82,no,N,25,,83885,18282,MYR
26,,SING,C9,C10,no,N,26,,83885,18282,MYR
27,,SING,C9,H91,no,N,27,,83885,18282,MYR
28,,SING,C9,H92,no,N,28,,83885,18282,MYR
29,,SING,C10,C11,no,N,29,,83885,18282,MYR
30,,SING,C10,H101,no,N,30,,83885,18282,MYR
31,,SING,C10,H102,no,N,31,,83885,18282,MYR
32,,SING,C11,C12,no,N,32,,83885,18282,MYR
33,,SING,C11,H111,no,N,33,,83885,18282,MYR
34,,SING,C11,H112,no,N,34,,83885,18282,MYR
35,,SING,C12,C13,no,N,35,,83885,18282,MYR
36,,SING,C12,H121,no,N,36,,83885,18282,MYR
37,,SING,C12,H122,no,N,37,,83885,18282,MYR
38,,SING,C13,C14,no,N,38,,83885,18282,MYR
39,,SING,C13,H131,no,N,39,,83885,18282,MYR
40,,SING,C13,H132,no,N,40,,83885,18282,MYR
41,,SING,C14,H141,no,N,41,,83885,18282,MYR
42,,SING,C14,H142,no,N,42,,83885,18282,MYR
43,,SING,C14,H143,no,N,43,,83885,18282,MYR
1,,SING,N,CA,no,N,1,,84213,18300,PCA
2,,SING,N,CD,no,N,2,,84213,18300,PCA
3,,SING,N,H,no,N,3,,84213,18300,PCA
4,,SING,CA,CB,no,N,4,,84213,18300,PCA
5,,SING,CA,C,no,N,5,,84213,18300,PCA
6,,SING,CA,HA,no,N,6,,84213,18300,PCA
7,,SING,CB,CG,no,N,7,,84213,18300,PCA
8,,SING,CB,HB2,no,N,8,,84213,18300,PCA
9,,SING,CB,HB3,no,N,9,,84213,18300,PCA
10,,SING,CG,CD,no,N,10,,84213,18300,PCA
11,,SING,CG,HG2,no,N,11,,84213,18300,PCA
12,,SING,CG,HG3,no,N,12,,84213,18300,PCA
13,,DOUB,CD,OE,no,N,13,,84213,18300,PCA
14,,DOUB,C,O,no,N,14,,84213,18300,PCA
15,,SING,C,OXT,no,N,15,,84213,18300,PCA
16,,SING,OXT,HXT,no,N,16,,84213,18300,PCA
1,,SING,C1,C2,no,N,1,,84306,18305,NAG
2,,SING,C1,O1,no,N,2,,84306,18305,NAG
3,,SING,C1,O5,no,N,3,,84306,18305,NAG
4,,SING,C1,H1,no,N,4,,84306,18305,NAG
5,,SING,C2,C3,no,N,5,,84306,18305,NAG
6,,SING,C2,N2,no,N,6,,84306,18305,NAG
7,,SING,C2,H2,no,N,7,,84306,18305,NAG
8,,SING,C3,C4,no,N,8,,84306,18305,NAG
9,,SING,C3,O3,no,N,9,,84306,18305,NAG
10,,SING,C3,H3,no,N,10,,84306,18305,NAG
11,,SING,C4,C5,no,N,11,,84306,18305,NAG
12,,SING,C4,O4,no,N,12,,84306,18305,NAG
13,,SING,C4,H4,no,N,13,,84306,18305,NAG
14,,SING,C5,C6,no,N,14,,84306,18305,NAG
15,,SING,C5,O5,no,N,15,,84306,18305,NAG
16,,SING,C5,H5,no,N,16,,84306,18305,NAG
17,,SING,C6,O6,no,N,17,,84306,18305,NAG
18,,SING,C6,H61,no,N,18,,84306,18305,NAG
19,,SING,C6,H62,no,N,19,,84306,18305,NAG
20,,SING,C7,C8,no,N,20,,84306,18305,NAG
21,,SING,C7,N2,no,N,21,,84306,18305,NAG
22,,DOUB,C7,O7,no,N,22,,84306,18305,NAG
23,,SING,C8,H81,no,N,23,,84306,18305,NAG
24,,SING,C8,H82,no,N,24,,84306,18305,NAG
25,,SING,C8,H83,no,N,25,,84306,18305,NAG
26,,SING,N2,HN2,no,N,26,,84306,18305,NAG
27,,SING,O1,HO1,no,N,27,,84306,18305,NAG
28,,SING,O3,HO3,no,N,28,,84306,18305,NAG
29,,SING,O4,HO4,no,N,29,,84306,18305,NAG
30,,SING,O6,HO6,no,N,30,,84306,18305,NAG
1,,SING,N,CA,no,N,1,,84805,18333,PTR
2,,SING,N,H,no,N,2,,84805,18333,PTR
3,,SING,N,HN2,no,N,3,,84805,18333,PTR
4,,SING,CA,C,no,N,4,,84805,18333,PTR
5,,SING,CA,CB,no,N,5,,84805,18333,PTR
6,,SING,CA,HA,no,N,6,,84805,18333,PTR
7,,DOUB,C,O,no,N,7,,84805,18333,PTR
8,,SING,C,OXT,no,N,8,,84805,18333,PTR
9,,SING,OXT,HXT,no,N,9,,84805,18333,PTR
10,,SING,CB,CG,no,N,10,,84805,18333,PTR
11,,SING,CB,HB2,no,N,11,,84805,18333,PTR
12,,SING,CB,HB3,no,N,12,,84805,18333,PTR
13,,DOUB,CG,CD1,yes,N,13,,84805,18333,PTR
14,,SING,CG,CD2,yes,N,14,,84805,18333,PTR
15,,SING,CD1,CE1,yes,N,15,,84805,18333,PTR
16,,SING,CD1,HD1,no,N,16,,84805,18333,PTR
17,,DOUB,CD2,CE2,yes,N,17,,84805,18333,PTR
18,,SING,CD2,HD2,no,N,18,,84805,18333,PTR
19,,DOUB,CE1,CZ,yes,N,19,,84805,18333,PTR
20,,SING,CE1,HE1,no,N,20,,84805,18333,PTR
21,,SING,CE2,CZ,yes,N,21,,84805,18333,PTR
22,,SING,CE2,HE2,no,N,22,,84805,18333,PTR
23,,SING,CZ,OH,no,N,23,,84805,18333,PTR
24,,SING,OH,P,no,N,24,,84805,18333,PTR
25,,DOUB,P,O1P,no,N,25,,84805,18333,PTR
26,,SING,P,O2P,no,N,26,,84805,18333,PTR
27,,SING,P,O3P,no,N,27,,84805,18333,PTR
28,,SING,O2P,HO2P,no,N,28,,84805,18333,PTR
19,,SING,C5,C5M,,,,,117537,20121,T23
29,,SING,O3P,HO3P,no,N,29,,84805,18333,PTR
1,,DOUB,C,O,no,N,1,,84843,18335,ACE
2,,SING,C,CH3,no,N,2,,84843,18335,ACE
3,,SING,C,H,no,N,3,,84843,18335,ACE
4,,SING,CH3,H1,no,N,4,,84843,18335,ACE
5,,SING,CH3,H2,no,N,5,,84843,18335,ACE
6,,SING,CH3,H3,no,N,6,,84843,18335,ACE
1,,SING,N7,C8,no,N,1,,84844,18335,NHH
2,,SING,N7,HN71,no,N,2,,84844,18335,NHH
3,,SING,N7,HN72,no,N,3,,84844,18335,NHH
4,,SING,C8,N8,no,N,4,,84844,18335,NHH
5,,DOUB,C8,N6,no,N,5,,84844,18335,NHH
6,,SING,N8,HN81,no,N,6,,84844,18335,NHH
7,,SING,N8,HN82,no,N,7,,84844,18335,NHH
8,,SING,N6,N5,no,N,8,,84844,18335,NHH
9,,DOUB,N5,C4,no,N,9,,84844,18335,NHH
10,,SING,C4,C5,no,N,10,,84844,18335,NHH
11,,SING,C4,C3,no,N,11,,84844,18335,NHH
12,,SING,C5,C6,no,N,12,,84844,18335,NHH
13,,SING,C5,H51,no,N,13,,84844,18335,NHH
14,,SING,C5,H52,no,N,14,,84844,18335,NHH
15,,SING,C6,C1,no,N,15,,84844,18335,NHH
16,,SING,C6,H61,no,N,16,,84844,18335,NHH
17,,SING,C6,H62,no,N,17,,84844,18335,NHH
18,,SING,C3,C2,no,N,18,,84844,18335,NHH
19,,SING,C3,H31,no,N,19,,84844,18335,NHH
20,,SING,C3,H32,no,N,20,,84844,18335,NHH
21,,SING,C2,C1,no,N,21,,84844,18335,NHH
22,,SING,C2,H21,no,N,22,,84844,18335,NHH
23,,SING,C2,H22,no,N,23,,84844,18335,NHH
24,,DOUB,C1,N1,no,N,24,,84844,18335,NHH
25,,SING,N1,N2,no,N,25,,84844,18335,NHH
26,,DOUB,N2,C7,no,N,26,,84844,18335,NHH
27,,SING,C7,N3,no,N,27,,84844,18335,NHH
28,,SING,C7,N4,no,N,28,,84844,18335,NHH
29,,SING,N3,HN31,no,N,29,,84844,18335,NHH
30,,SING,N3,HN32,no,N,30,,84844,18335,NHH
31,,SING,N4,HN41,no,N,31,,84844,18335,NHH
32,,SING,N4,HN42,no,N,32,,84844,18335,NHH
1,,DOUB,O01,C02,no,N,1,,85665,18378,D6M
2,,SING,C02,N03,no,N,2,,85665,18378,D6M
3,,SING,C02,C12,no,N,3,,85665,18378,D6M
4,,SING,N03,C04,no,N,4,,85665,18378,D6M
5,,SING,C04,C05,no,N,5,,85665,18378,D6M
6,,SING,C04,C09,no,N,6,,85665,18378,D6M
7,,SING,C05,C06,no,N,7,,85665,18378,D6M
8,,SING,C06,C07,no,N,8,,85665,18378,D6M
9,,DOUB,C07,O08,no,N,9,,85665,18378,D6M
10,,SING,C07,OXT,no,N,10,,85665,18378,D6M
11,,DOUB,C09,O10,no,N,11,,85665,18378,D6M
12,,SING,C09,O11,no,N,12,,85665,18378,D6M
13,,SING,C12,C13,no,N,13,,85665,18378,D6M
14,,SING,C13,C14,no,N,14,,85665,18378,D6M
15,,SING,C14,C15,no,N,15,,85665,18378,D6M
16,,SING,C15,C16,no,N,16,,85665,18378,D6M
17,,SING,C16,C17,no,N,17,,85665,18378,D6M
18,,SING,C17,C18,no,N,18,,85665,18378,D6M
19,,SING,C18,C19,no,N,19,,85665,18378,D6M
20,,SING,C19,C20,no,N,20,,85665,18378,D6M
21,,SING,C20,C21,no,N,21,,85665,18378,D6M
22,,SING,C21,C22,no,N,22,,85665,18378,D6M
23,,SING,C22,C23,no,N,23,,85665,18378,D6M
24,,SING,C23,C24,no,N,24,,85665,18378,D6M
25,,SING,C24,C25,no,N,25,,85665,18378,D6M
26,,SING,C25,C26,no,N,26,,85665,18378,D6M
27,,SING,N03,H03,no,N,27,,85665,18378,D6M
28,,SING,C12,H121,no,N,28,,85665,18378,D6M
29,,SING,C12,H122,no,N,29,,85665,18378,D6M
30,,SING,C04,H04,no,N,30,,85665,18378,D6M
31,,SING,C05,H051,no,N,31,,85665,18378,D6M
32,,SING,C05,H052,no,N,32,,85665,18378,D6M
33,,SING,C06,H061,no,N,33,,85665,18378,D6M
34,,SING,C06,H062,no,N,34,,85665,18378,D6M
35,,SING,OXT,HX0,no,N,35,,85665,18378,D6M
36,,SING,O11,H11,no,N,36,,85665,18378,D6M
37,,SING,C13,H131,no,N,37,,85665,18378,D6M
38,,SING,C13,H132,no,N,38,,85665,18378,D6M
39,,SING,C14,H141,no,N,39,,85665,18378,D6M
40,,SING,C14,H142,no,N,40,,85665,18378,D6M
41,,SING,C15,H151,no,N,41,,85665,18378,D6M
42,,SING,C15,H152,no,N,42,,85665,18378,D6M
43,,SING,C16,H161,no,N,43,,85665,18378,D6M
44,,SING,C16,H162,no,N,44,,85665,18378,D6M
45,,SING,C17,H171,no,N,45,,85665,18378,D6M
46,,SING,C17,H172,no,N,46,,85665,18378,D6M
47,,SING,C18,H181,no,N,47,,85665,18378,D6M
48,,SING,C18,H182,no,N,48,,85665,18378,D6M
49,,SING,C19,H191,no,N,49,,85665,18378,D6M
50,,SING,C19,H192,no,N,50,,85665,18378,D6M
51,,SING,C20,H201,no,N,51,,85665,18378,D6M
52,,SING,C20,H202,no,N,52,,85665,18378,D6M
53,,SING,C21,H211,no,N,53,,85665,18378,D6M
54,,SING,C21,H212,no,N,54,,85665,18378,D6M
55,,SING,C22,H221,no,N,55,,85665,18378,D6M
56,,SING,C22,H222,no,N,56,,85665,18378,D6M
57,,SING,C23,H231,no,N,57,,85665,18378,D6M
58,,SING,C23,H232,no,N,58,,85665,18378,D6M
59,,SING,C24,H241,no,N,59,,85665,18378,D6M
60,,SING,C24,H242,no,N,60,,85665,18378,D6M
61,,SING,C25,H251,no,N,61,,85665,18378,D6M
62,,SING,C25,H252,no,N,62,,85665,18378,D6M
63,,SING,C26,H261,no,N,63,,85665,18378,D6M
64,,SING,C26,H262,no,N,64,,85665,18378,D6M
65,,SING,C26,H263,no,N,65,,85665,18378,D6M
1,,DOUB,CHA,C1A,yes,Z,1,,85687,18379,PHO
2,,SING,CHA,C4D,yes,N,2,,85687,18379,PHO
3,,SING,CHA,CBD,no,N,3,,85687,18379,PHO
4,,SING,CHB,C4A,yes,N,4,,85687,18379,PHO
5,,DOUB,CHB,C1B,yes,Z,5,,85687,18379,PHO
6,,SING,CHB,HHB,no,N,6,,85687,18379,PHO
7,,DOUB,CHC,C4B,yes,Z,7,,85687,18379,PHO
8,,SING,CHC,C1C,yes,N,8,,85687,18379,PHO
9,,SING,CHC,HHC,no,N,9,,85687,18379,PHO
10,,DOUB,CHD,C4C,yes,Z,10,,85687,18379,PHO
11,,SING,CHD,C1D,yes,N,11,,85687,18379,PHO
12,,SING,CHD,HHD,no,N,12,,85687,18379,PHO
13,,SING,NA,C1A,yes,N,13,,85687,18379,PHO
14,,DOUB,NA,C4A,yes,N,14,,85687,18379,PHO
15,,SING,C1A,C2A,no,N,15,,85687,18379,PHO
16,,SING,C2A,C3A,no,N,16,,85687,18379,PHO
17,,SING,C2A,CAA,no,N,17,,85687,18379,PHO
18,,SING,C2A,H2A,no,N,18,,85687,18379,PHO
19,,SING,C3A,C4A,no,N,19,,85687,18379,PHO
20,,SING,C3A,CMA,no,N,20,,85687,18379,PHO
21,,SING,C3A,H3A,no,N,21,,85687,18379,PHO
22,,SING,CMA,HMA1,no,N,22,,85687,18379,PHO
23,,SING,CMA,HMA2,no,N,23,,85687,18379,PHO
24,,SING,CMA,HMA3,no,N,24,,85687,18379,PHO
25,,SING,CAA,CBA,no,N,25,,85687,18379,PHO
26,,SING,CAA,HAA1,no,N,26,,85687,18379,PHO
27,,SING,CAA,HAA2,no,N,27,,85687,18379,PHO
28,,SING,CBA,CGA,no,N,28,,85687,18379,PHO
29,,SING,CBA,HBA1,no,N,29,,85687,18379,PHO
30,,SING,CBA,HBA2,no,N,30,,85687,18379,PHO
31,,DOUB,CGA,O1A,no,N,31,,85687,18379,PHO
32,,SING,CGA,O2A,no,N,32,,85687,18379,PHO
33,,SING,O2A,C1,no,N,33,,85687,18379,PHO
34,,SING,NB,C1B,yes,N,34,,85687,18379,PHO
35,,SING,NB,C4B,yes,N,35,,85687,18379,PHO
36,,SING,NB,HNB,no,N,36,,85687,18379,PHO
37,,SING,C1B,C2B,yes,N,37,,85687,18379,PHO
38,,DOUB,C2B,C3B,yes,N,38,,85687,18379,PHO
39,,SING,C2B,CMB,no,N,39,,85687,18379,PHO
40,,SING,C3B,C4B,yes,N,40,,85687,18379,PHO
41,,SING,C3B,CAB,no,N,41,,85687,18379,PHO
42,,SING,CMB,HMB1,no,N,42,,85687,18379,PHO
43,,SING,CMB,HMB2,no,N,43,,85687,18379,PHO
44,,SING,CMB,HMB3,no,N,44,,85687,18379,PHO
45,,DOUB,CAB,CBB,no,N,45,,85687,18379,PHO
46,,SING,CAB,HAB,no,N,46,,85687,18379,PHO
47,,SING,CBB,HBB1,no,N,47,,85687,18379,PHO
48,,SING,CBB,HBB2,no,N,48,,85687,18379,PHO
49,,DOUB,NC,C1C,yes,N,49,,85687,18379,PHO
50,,SING,NC,C4C,yes,N,50,,85687,18379,PHO
51,,SING,C1C,C2C,no,N,51,,85687,18379,PHO
52,,DOUB,C2C,C3C,no,N,52,,85687,18379,PHO
53,,SING,C2C,CMC,no,N,53,,85687,18379,PHO
54,,SING,C3C,C4C,no,N,54,,85687,18379,PHO
55,,SING,C3C,CAC,no,N,55,,85687,18379,PHO
56,,SING,CMC,HMC1,no,N,56,,85687,18379,PHO
57,,SING,CMC,HMC2,no,N,57,,85687,18379,PHO
58,,SING,CMC,HMC3,no,N,58,,85687,18379,PHO
59,,SING,CAC,CBC,no,N,59,,85687,18379,PHO
60,,SING,CAC,HAC1,no,N,60,,85687,18379,PHO
61,,SING,CAC,HAC2,no,N,61,,85687,18379,PHO
62,,SING,CBC,HBC1,no,N,62,,85687,18379,PHO
63,,SING,CBC,HBC2,no,N,63,,85687,18379,PHO
64,,SING,CBC,HBC3,no,N,64,,85687,18379,PHO
65,,SING,ND,C1D,yes,N,65,,85687,18379,PHO
66,,SING,ND,C4D,yes,N,66,,85687,18379,PHO
67,,SING,ND,HND,no,N,67,,85687,18379,PHO
68,,DOUB,C1D,C2D,yes,N,68,,85687,18379,PHO
69,,SING,C2D,C3D,yes,N,69,,85687,18379,PHO
70,,SING,C2D,CMD,no,N,70,,85687,18379,PHO
71,,DOUB,C3D,C4D,yes,N,71,,85687,18379,PHO
72,,SING,C3D,CAD,no,N,72,,85687,18379,PHO
73,,SING,CMD,HMD1,no,N,73,,85687,18379,PHO
74,,SING,CMD,HMD2,no,N,74,,85687,18379,PHO
75,,SING,CMD,HMD3,no,N,75,,85687,18379,PHO
76,,DOUB,CAD,OBD,no,N,76,,85687,18379,PHO
77,,SING,CAD,CBD,no,N,77,,85687,18379,PHO
78,,SING,CBD,CGD,no,N,78,,85687,18379,PHO
79,,SING,CBD,HBD,no,N,79,,85687,18379,PHO
80,,DOUB,CGD,O1D,no,N,80,,85687,18379,PHO
81,,SING,CGD,O2D,no,N,81,,85687,18379,PHO
82,,SING,O2D,CED,no,N,82,,85687,18379,PHO
83,,SING,CED,HED1,no,N,83,,85687,18379,PHO
84,,SING,CED,HED2,no,N,84,,85687,18379,PHO
85,,SING,CED,HED3,no,N,85,,85687,18379,PHO
86,,SING,C1,C2,no,N,86,,85687,18379,PHO
87,,SING,C1,H11,no,N,87,,85687,18379,PHO
88,,SING,C1,H12,no,N,88,,85687,18379,PHO
89,,DOUB,C2,C3,no,N,89,,85687,18379,PHO
90,,SING,C2,H2,no,N,90,,85687,18379,PHO
91,,SING,C3,C4,no,N,91,,85687,18379,PHO
92,,SING,C3,C5,no,N,92,,85687,18379,PHO
93,,SING,C4,H41,no,N,93,,85687,18379,PHO
94,,SING,C4,H42,no,N,94,,85687,18379,PHO
95,,SING,C4,H43,no,N,95,,85687,18379,PHO
96,,SING,C5,C6,no,N,96,,85687,18379,PHO
97,,SING,C5,H51,no,N,97,,85687,18379,PHO
98,,SING,C5,H52,no,N,98,,85687,18379,PHO
99,,SING,C6,C7,no,N,99,,85687,18379,PHO
100,,SING,C6,H61,no,N,100,,85687,18379,PHO
101,,SING,C6,H62,no,N,101,,85687,18379,PHO
102,,SING,C7,C8,no,N,102,,85687,18379,PHO
103,,SING,C7,H71,no,N,103,,85687,18379,PHO
104,,SING,C7,H72,no,N,104,,85687,18379,PHO
105,,SING,C8,C9,no,N,105,,85687,18379,PHO
106,,SING,C8,C10,no,N,106,,85687,18379,PHO
107,,SING,C8,H8,no,N,107,,85687,18379,PHO
108,,SING,C9,H91,no,N,108,,85687,18379,PHO
109,,SING,C9,H92,no,N,109,,85687,18379,PHO
110,,SING,C9,H93,no,N,110,,85687,18379,PHO
111,,SING,C10,C11,no,N,111,,85687,18379,PHO
112,,SING,C10,H101,no,N,112,,85687,18379,PHO
113,,SING,C10,H102,no,N,113,,85687,18379,PHO
114,,SING,C11,C12,no,N,114,,85687,18379,PHO
115,,SING,C11,H111,no,N,115,,85687,18379,PHO
116,,SING,C11,H112,no,N,116,,85687,18379,PHO
117,,SING,C12,C13,no,N,117,,85687,18379,PHO
118,,SING,C12,H121,no,N,118,,85687,18379,PHO
119,,SING,C12,H122,no,N,119,,85687,18379,PHO
120,,SING,C13,C14,no,N,120,,85687,18379,PHO
121,,SING,C13,C15,no,N,121,,85687,18379,PHO
122,,SING,C13,H13,no,N,122,,85687,18379,PHO
123,,SING,C14,H141,no,N,123,,85687,18379,PHO
124,,SING,C14,H142,no,N,124,,85687,18379,PHO
125,,SING,C14,H143,no,N,125,,85687,18379,PHO
126,,SING,C15,C16,no,N,126,,85687,18379,PHO
127,,SING,C15,H151,no,N,127,,85687,18379,PHO
128,,SING,C15,H152,no,N,128,,85687,18379,PHO
129,,SING,C16,C17,no,N,129,,85687,18379,PHO
130,,SING,C16,H161,no,N,130,,85687,18379,PHO
131,,SING,C16,H162,no,N,131,,85687,18379,PHO
132,,SING,C17,C18,no,N,132,,85687,18379,PHO
133,,SING,C17,H171,no,N,133,,85687,18379,PHO
134,,SING,C17,H172,no,N,134,,85687,18379,PHO
135,,SING,C18,C19,no,N,135,,85687,18379,PHO
136,,SING,C18,C20,no,N,136,,85687,18379,PHO
137,,SING,C18,H18,no,N,137,,85687,18379,PHO
138,,SING,C19,H191,no,N,138,,85687,18379,PHO
139,,SING,C19,H192,no,N,139,,85687,18379,PHO
140,,SING,C19,H193,no,N,140,,85687,18379,PHO
141,,SING,C20,H201,no,N,141,,85687,18379,PHO
142,,SING,C20,H202,no,N,142,,85687,18379,PHO
143,,SING,C20,H203,no,N,143,,85687,18379,PHO
1,,SING,N,C1,no,N,1,,85688,18379,ANI
2,,SING,N,HN1,no,N,2,,85688,18379,ANI
3,,SING,N,HN2,no,N,3,,85688,18379,ANI
4,,DOUB,C1,C2,yes,N,4,,85688,18379,ANI
5,,SING,C1,C6,yes,N,5,,85688,18379,ANI
6,,SING,C2,C3,yes,N,6,,85688,18379,ANI
7,,SING,C2,H2,no,N,7,,85688,18379,ANI
8,,DOUB,C3,C4,yes,N,8,,85688,18379,ANI
9,,SING,C3,H3,no,N,9,,85688,18379,ANI
10,,SING,C4,C5,yes,N,10,,85688,18379,ANI
11,,SING,C4,C7,no,N,11,,85688,18379,ANI
12,,DOUB,C5,C6,yes,N,12,,85688,18379,ANI
13,,SING,C5,H5,no,N,13,,85688,18379,ANI
14,,SING,C6,H6,no,N,14,,85688,18379,ANI
15,,SING,C7,F1,no,N,15,,85688,18379,ANI
16,,SING,C7,F2,no,N,16,,85688,18379,ANI
17,,SING,C7,F3,no,N,17,,85688,18379,ANI
1,,DOUB,P,OP1,no,N,1,,85893,18391,DGP
2,,SING,P,OP2,no,N,2,,85893,18391,DGP
3,,SING,P,OP3,no,N,3,,85893,18391,DGP
4,,SING,P,O5',no,N,4,,85893,18391,DGP
5,,SING,OP2,HOP2,no,N,5,,85893,18391,DGP
6,,SING,OP3,HOP3,no,N,6,,85893,18391,DGP
7,,SING,O5',C5',no,N,7,,85893,18391,DGP
8,,SING,C5',C4',no,N,8,,85893,18391,DGP
9,,SING,C5',H5',no,N,9,,85893,18391,DGP
10,,SING,C5',H5'',no,N,10,,85893,18391,DGP
11,,SING,C4',O4',no,N,11,,85893,18391,DGP
12,,SING,C4',C3',no,N,12,,85893,18391,DGP
13,,SING,C4',H4',no,N,13,,85893,18391,DGP
14,,SING,O4',C1',no,N,14,,85893,18391,DGP
15,,SING,C3',O3',no,N,15,,85893,18391,DGP
16,,SING,C3',C2',no,N,16,,85893,18391,DGP
17,,SING,C3',H3',no,N,17,,85893,18391,DGP
18,,SING,O3',HO3',no,N,18,,85893,18391,DGP
19,,SING,C2',C1',no,N,19,,85893,18391,DGP
20,,SING,C2',H2',no,N,20,,85893,18391,DGP
21,,SING,C2',H2'',no,N,21,,85893,18391,DGP
22,,SING,C1',N9,no,N,22,,85893,18391,DGP
23,,SING,C1',H1',no,N,23,,85893,18391,DGP
24,,SING,N9,C8,yes,N,24,,85893,18391,DGP
25,,SING,N9,C4,yes,N,25,,85893,18391,DGP
26,,DOUB,C8,N7,yes,N,26,,85893,18391,DGP
27,,SING,C8,H8,no,N,27,,85893,18391,DGP
28,,SING,N7,C5,yes,N,28,,85893,18391,DGP
29,,SING,C5,C6,no,N,29,,85893,18391,DGP
30,,DOUB,C5,C4,yes,N,30,,85893,18391,DGP
31,,DOUB,C6,O6,no,N,31,,85893,18391,DGP
32,,SING,C6,N1,no,N,32,,85893,18391,DGP
33,,SING,N1,C2,no,N,33,,85893,18391,DGP
34,,SING,N1,HN1,no,N,34,,85893,18391,DGP
35,,SING,C2,N2,no,N,35,,85893,18391,DGP
36,,DOUB,C2,N3,no,N,36,,85893,18391,DGP
37,,SING,N2,HN21,no,N,37,,85893,18391,DGP
38,,SING,N2,HN22,no,N,38,,85893,18391,DGP
39,,SING,N3,C4,no,N,39,,85893,18391,DGP
1,,SING,FE,NA,no,N,1,,86421,18422,HEB
2,,SING,FE,NB,no,N,2,,86421,18422,HEB
3,,SING,FE,NC,no,N,3,,86421,18422,HEB
4,,SING,FE,ND,no,N,4,,86421,18422,HEB
5,,DOUB,CHA,C1A,yes,N,5,,86421,18422,HEB
6,,SING,CHA,C4D,yes,N,6,,86421,18422,HEB
7,,SING,CHA,HHA,no,N,7,,86421,18422,HEB
8,,DOUB,CHB,C4A,yes,N,8,,86421,18422,HEB
9,,SING,CHB,C1B,yes,N,9,,86421,18422,HEB
10,,SING,CHB,HHB,no,N,10,,86421,18422,HEB
11,,DOUB,CHC,C4B,yes,N,11,,86421,18422,HEB
12,,SING,CHC,C1C,yes,N,12,,86421,18422,HEB
13,,SING,CHC,HHC,no,N,13,,86421,18422,HEB
14,,SING,CHD,C4C,yes,N,14,,86421,18422,HEB
15,,DOUB,CHD,C1D,yes,N,15,,86421,18422,HEB
16,,SING,CHD,HHD,no,N,16,,86421,18422,HEB
17,,SING,NA,C1A,yes,N,17,,86421,18422,HEB
18,,SING,NA,C4A,yes,N,18,,86421,18422,HEB
19,,SING,C1A,C2A,yes,N,19,,86421,18422,HEB
20,,DOUB,C2A,C3A,yes,N,20,,86421,18422,HEB
21,,SING,C2A,CAA,no,N,21,,86421,18422,HEB
22,,SING,C3A,C4A,yes,N,22,,86421,18422,HEB
23,,SING,C3A,CMA,no,N,23,,86421,18422,HEB
24,,SING,CMA,HMA1,no,N,24,,86421,18422,HEB
25,,SING,CMA,HMA2,no,N,25,,86421,18422,HEB
26,,SING,CMA,HMA3,no,N,26,,86421,18422,HEB
27,,SING,CAA,CBA,no,N,27,,86421,18422,HEB
28,,SING,CAA,HAA1,no,N,28,,86421,18422,HEB
29,,SING,CAA,HAA2,no,N,29,,86421,18422,HEB
30,,SING,CBA,CGA,no,N,30,,86421,18422,HEB
31,,SING,CBA,HBA1,no,N,31,,86421,18422,HEB
32,,SING,CBA,HBA2,no,N,32,,86421,18422,HEB
33,,DOUB,CGA,O1A,no,N,33,,86421,18422,HEB
34,,SING,CGA,O2A,no,N,34,,86421,18422,HEB
35,,SING,O2A,H2A,no,N,35,,86421,18422,HEB
36,,DOUB,NB,C1B,yes,N,36,,86421,18422,HEB
37,,SING,NB,C4B,yes,N,37,,86421,18422,HEB
38,,SING,C1B,C2B,no,N,38,,86421,18422,HEB
39,,DOUB,C2B,C3B,no,N,39,,86421,18422,HEB
40,,SING,C2B,CMB,no,N,40,,86421,18422,HEB
41,,SING,C3B,C4B,no,N,41,,86421,18422,HEB
42,,SING,C3B,CAB,no,N,42,,86421,18422,HEB
43,,SING,CMB,HMB1,no,N,43,,86421,18422,HEB
44,,SING,CMB,HMB2,no,N,44,,86421,18422,HEB
45,,SING,CMB,HMB3,no,N,45,,86421,18422,HEB
46,,SING,CAB,CBB,no,N,46,,86421,18422,HEB
47,,SING,CAB,HAB,no,N,47,,86421,18422,HEB
48,,SING,CAB,HAB2,no,N,48,,86421,18422,HEB
49,,SING,CBB,HBB1,no,N,49,,86421,18422,HEB
50,,SING,CBB,HBB2,no,N,50,,86421,18422,HEB
51,,SING,CBB,HBB3,no,N,51,,86421,18422,HEB
52,,SING,NC,C1C,yes,N,52,,86421,18422,HEB
53,,SING,NC,C4C,yes,N,53,,86421,18422,HEB
54,,DOUB,C1C,C2C,yes,N,54,,86421,18422,HEB
55,,SING,C2C,C3C,yes,N,55,,86421,18422,HEB
56,,SING,C2C,CMC,no,N,56,,86421,18422,HEB
57,,DOUB,C3C,C4C,yes,N,57,,86421,18422,HEB
58,,SING,C3C,CAC,no,N,58,,86421,18422,HEB
59,,SING,CMC,HMC1,no,N,59,,86421,18422,HEB
60,,SING,CMC,HMC2,no,N,60,,86421,18422,HEB
61,,SING,CMC,HMC3,no,N,61,,86421,18422,HEB
62,,DOUB,CAC,CBC,no,N,62,,86421,18422,HEB
63,,SING,CAC,HAC,no,N,63,,86421,18422,HEB
64,,SING,CBC,HBC1,no,N,64,,86421,18422,HEB
65,,SING,CBC,HBC2,no,N,65,,86421,18422,HEB
66,,SING,ND,C1D,yes,N,66,,86421,18422,HEB
67,,DOUB,ND,C4D,yes,N,67,,86421,18422,HEB
68,,SING,C1D,C2D,no,N,68,,86421,18422,HEB
69,,DOUB,C2D,C3D,no,N,69,,86421,18422,HEB
70,,SING,C2D,CMD,no,N,70,,86421,18422,HEB
71,,SING,C3D,C4D,no,N,71,,86421,18422,HEB
72,,SING,C3D,CAD,no,N,72,,86421,18422,HEB
73,,SING,CMD,HMD1,no,N,73,,86421,18422,HEB
74,,SING,CMD,HMD2,no,N,74,,86421,18422,HEB
75,,SING,CMD,HMD3,no,N,75,,86421,18422,HEB
76,,SING,CAD,CBD,no,N,76,,86421,18422,HEB
77,,SING,CAD,HAD1,no,N,77,,86421,18422,HEB
78,,SING,CAD,HAD2,no,N,78,,86421,18422,HEB
79,,SING,CBD,CGD,no,N,79,,86421,18422,HEB
80,,SING,CBD,HBD1,no,N,80,,86421,18422,HEB
81,,SING,CBD,HBD2,no,N,81,,86421,18422,HEB
82,,DOUB,CGD,O1D,no,N,82,,86421,18422,HEB
83,,SING,CGD,O2D,no,N,83,,86421,18422,HEB
84,,SING,O2D,H2D,no,N,84,,86421,18422,HEB
1,,TRIP,C,O,no,N,1,,86422,18422,CMO
1,,SING,FE,NA,no,N,1,,86449,18423,HEB
2,,SING,FE,NB,no,N,2,,86449,18423,HEB
3,,SING,FE,NC,no,N,3,,86449,18423,HEB
4,,SING,FE,ND,no,N,4,,86449,18423,HEB
5,,DOUB,CHA,C1A,yes,N,5,,86449,18423,HEB
6,,SING,CHA,C4D,yes,N,6,,86449,18423,HEB
7,,SING,CHA,HHA,no,N,7,,86449,18423,HEB
8,,DOUB,CHB,C4A,yes,N,8,,86449,18423,HEB
9,,SING,CHB,C1B,yes,N,9,,86449,18423,HEB
10,,SING,CHB,HHB,no,N,10,,86449,18423,HEB
11,,DOUB,CHC,C4B,yes,N,11,,86449,18423,HEB
12,,SING,CHC,C1C,yes,N,12,,86449,18423,HEB
13,,SING,CHC,HHC,no,N,13,,86449,18423,HEB
14,,SING,CHD,C4C,yes,N,14,,86449,18423,HEB
15,,DOUB,CHD,C1D,yes,N,15,,86449,18423,HEB
16,,SING,CHD,HHD,no,N,16,,86449,18423,HEB
17,,SING,NA,C1A,yes,N,17,,86449,18423,HEB
18,,SING,NA,C4A,yes,N,18,,86449,18423,HEB
19,,SING,C1A,C2A,yes,N,19,,86449,18423,HEB
20,,DOUB,C2A,C3A,yes,N,20,,86449,18423,HEB
21,,SING,C2A,CAA,no,N,21,,86449,18423,HEB
22,,SING,C3A,C4A,yes,N,22,,86449,18423,HEB
23,,SING,C3A,CMA,no,N,23,,86449,18423,HEB
25,,SING,C3',O3',,,,,216223,5054,ATP
24,,SING,CMA,HMA1,no,N,24,,86449,18423,HEB
25,,SING,CMA,HMA2,no,N,25,,86449,18423,HEB
26,,SING,CMA,HMA3,no,N,26,,86449,18423,HEB
27,,SING,CAA,CBA,no,N,27,,86449,18423,HEB
28,,SING,CAA,HAA1,no,N,28,,86449,18423,HEB
29,,SING,CAA,HAA2,no,N,29,,86449,18423,HEB
30,,SING,CBA,CGA,no,N,30,,86449,18423,HEB
31,,SING,CBA,HBA1,no,N,31,,86449,18423,HEB
32,,SING,CBA,HBA2,no,N,32,,86449,18423,HEB
33,,DOUB,CGA,O1A,no,N,33,,86449,18423,HEB
34,,SING,CGA,O2A,no,N,34,,86449,18423,HEB
35,,SING,O2A,H2A,no,N,35,,86449,18423,HEB
36,,DOUB,NB,C1B,yes,N,36,,86449,18423,HEB
37,,SING,NB,C4B,yes,N,37,,86449,18423,HEB
38,,SING,C1B,C2B,no,N,38,,86449,18423,HEB
39,,DOUB,C2B,C3B,no,N,39,,86449,18423,HEB
40,,SING,C2B,CMB,no,N,40,,86449,18423,HEB
41,,SING,C3B,C4B,no,N,41,,86449,18423,HEB
42,,SING,C3B,CAB,no,N,42,,86449,18423,HEB
43,,SING,CMB,HMB1,no,N,43,,86449,18423,HEB
44,,SING,CMB,HMB2,no,N,44,,86449,18423,HEB
45,,SING,CMB,HMB3,no,N,45,,86449,18423,HEB
46,,SING,CAB,CBB,no,N,46,,86449,18423,HEB
47,,SING,CAB,HAB,no,N,47,,86449,18423,HEB
48,,SING,CAB,HAB2,no,N,48,,86449,18423,HEB
49,,SING,CBB,HBB1,no,N,49,,86449,18423,HEB
50,,SING,CBB,HBB2,no,N,50,,86449,18423,HEB
51,,SING,CBB,HBB3,no,N,51,,86449,18423,HEB
52,,SING,NC,C1C,yes,N,52,,86449,18423,HEB
53,,SING,NC,C4C,yes,N,53,,86449,18423,HEB
54,,DOUB,C1C,C2C,yes,N,54,,86449,18423,HEB
55,,SING,C2C,C3C,yes,N,55,,86449,18423,HEB
56,,SING,C2C,CMC,no,N,56,,86449,18423,HEB
57,,DOUB,C3C,C4C,yes,N,57,,86449,18423,HEB
58,,SING,C3C,CAC,no,N,58,,86449,18423,HEB
59,,SING,CMC,HMC1,no,N,59,,86449,18423,HEB
60,,SING,CMC,HMC2,no,N,60,,86449,18423,HEB
61,,SING,CMC,HMC3,no,N,61,,86449,18423,HEB
62,,DOUB,CAC,CBC,no,N,62,,86449,18423,HEB
63,,SING,CAC,HAC,no,N,63,,86449,18423,HEB
64,,SING,CBC,HBC1,no,N,64,,86449,18423,HEB
65,,SING,CBC,HBC2,no,N,65,,86449,18423,HEB
66,,SING,ND,C1D,yes,N,66,,86449,18423,HEB
67,,DOUB,ND,C4D,yes,N,67,,86449,18423,HEB
68,,SING,C1D,C2D,no,N,68,,86449,18423,HEB
69,,DOUB,C2D,C3D,no,N,69,,86449,18423,HEB
70,,SING,C2D,CMD,no,N,70,,86449,18423,HEB
71,,SING,C3D,C4D,no,N,71,,86449,18423,HEB
72,,SING,C3D,CAD,no,N,72,,86449,18423,HEB
73,,SING,CMD,HMD1,no,N,73,,86449,18423,HEB
74,,SING,CMD,HMD2,no,N,74,,86449,18423,HEB
75,,SING,CMD,HMD3,no,N,75,,86449,18423,HEB
76,,SING,CAD,CBD,no,N,76,,86449,18423,HEB
77,,SING,CAD,HAD1,no,N,77,,86449,18423,HEB
78,,SING,CAD,HAD2,no,N,78,,86449,18423,HEB
79,,SING,CBD,CGD,no,N,79,,86449,18423,HEB
80,,SING,CBD,HBD1,no,N,80,,86449,18423,HEB
81,,SING,CBD,HBD2,no,N,81,,86449,18423,HEB
82,,DOUB,CGD,O1D,no,N,82,,86449,18423,HEB
83,,SING,CGD,O2D,no,N,83,,86449,18423,HEB
84,,SING,O2D,H2D,no,N,84,,86449,18423,HEB
1,,TRIP,C,N,no,N,1,,86450,18423,CYN
1,,TRIP,C,N,no,N,1,,86477,18424,CYN
1,,SING,CHA,C1A,yes,N,1,,86478,18424,HEM
2,,DOUB,CHA,C4D,yes,N,2,,86478,18424,HEM
3,,SING,CHA,HHA,no,N,3,,86478,18424,HEM
4,,SING,CHB,C4A,yes,N,4,,86478,18424,HEM
5,,DOUB,CHB,C1B,yes,N,5,,86478,18424,HEM
6,,SING,CHB,HHB,no,N,6,,86478,18424,HEM
7,,SING,CHC,C4B,yes,N,7,,86478,18424,HEM
8,,DOUB,CHC,C1C,yes,N,8,,86478,18424,HEM
9,,SING,CHC,HHC,no,N,9,,86478,18424,HEM
10,,DOUB,CHD,C4C,yes,N,10,,86478,18424,HEM
11,,SING,CHD,C1D,yes,N,11,,86478,18424,HEM
12,,SING,CHD,HHD,no,N,12,,86478,18424,HEM
13,,DOUB,C1A,C2A,yes,N,13,,86478,18424,HEM
14,,SING,C1A,NA,yes,N,14,,86478,18424,HEM
15,,SING,C2A,C3A,yes,N,15,,86478,18424,HEM
16,,SING,C2A,CAA,no,N,16,,86478,18424,HEM
17,,DOUB,C3A,C4A,yes,N,17,,86478,18424,HEM
18,,SING,C3A,CMA,no,N,18,,86478,18424,HEM
19,,SING,C4A,NA,yes,N,19,,86478,18424,HEM
20,,SING,CMA,HMA,no,N,20,,86478,18424,HEM
21,,SING,CMA,HMAA,no,N,21,,86478,18424,HEM
22,,SING,CMA,HMAB,no,N,22,,86478,18424,HEM
23,,SING,CAA,CBA,no,N,23,,86478,18424,HEM
24,,SING,CAA,HAA,no,N,24,,86478,18424,HEM
25,,SING,CAA,HAAA,no,N,25,,86478,18424,HEM
26,,SING,CBA,CGA,no,N,26,,86478,18424,HEM
27,,SING,CBA,HBA,no,N,27,,86478,18424,HEM
28,,SING,CBA,HBAA,no,N,28,,86478,18424,HEM
29,,DOUB,CGA,O1A,no,N,29,,86478,18424,HEM
30,,SING,CGA,O2A,no,N,30,,86478,18424,HEM
31,,SING,C1B,C2B,no,N,31,,86478,18424,HEM
32,,SING,C1B,NB,yes,N,32,,86478,18424,HEM
33,,DOUB,C2B,C3B,yes,N,33,,86478,18424,HEM
34,,SING,C2B,CMB,yes,N,34,,86478,18424,HEM
35,,SING,C3B,C4B,no,N,35,,86478,18424,HEM
36,,SING,C3B,CAB,yes,N,36,,86478,18424,HEM
37,,DOUB,C4B,NB,no,N,37,,86478,18424,HEM
38,,SING,CMB,HMB,yes,N,38,,86478,18424,HEM
39,,SING,CMB,HMBA,no,N,39,,86478,18424,HEM
26,,SING,C3',C2',,,,,216223,5054,ATP
40,,SING,CMB,HMBB,no,N,40,,86478,18424,HEM
41,,DOUB,CAB,CBB,no,N,41,,86478,18424,HEM
42,,SING,CAB,HAB,no,N,42,,86478,18424,HEM
43,,SING,CBB,HBB,no,N,43,,86478,18424,HEM
44,,SING,CBB,HBBA,no,N,44,,86478,18424,HEM
45,,SING,C1C,C2C,no,N,45,,86478,18424,HEM
46,,SING,C1C,NC,yes,N,46,,86478,18424,HEM
47,,DOUB,C2C,C3C,yes,N,47,,86478,18424,HEM
48,,SING,C2C,CMC,yes,N,48,,86478,18424,HEM
49,,SING,C3C,C4C,no,N,49,,86478,18424,HEM
50,,SING,C3C,CAC,yes,N,50,,86478,18424,HEM
51,,SING,C4C,NC,no,N,51,,86478,18424,HEM
52,,SING,CMC,HMC,yes,N,52,,86478,18424,HEM
53,,SING,CMC,HMCA,no,N,53,,86478,18424,HEM
54,,SING,CMC,HMCB,no,N,54,,86478,18424,HEM
55,,DOUB,CAC,CBC,no,N,55,,86478,18424,HEM
56,,SING,CAC,HAC,no,N,56,,86478,18424,HEM
57,,SING,CBC,HBC,no,N,57,,86478,18424,HEM
58,,SING,CBC,HBCA,no,N,58,,86478,18424,HEM
59,,SING,C1D,C2D,no,N,59,,86478,18424,HEM
60,,DOUB,C1D,ND,yes,N,60,,86478,18424,HEM
61,,DOUB,C2D,C3D,yes,N,61,,86478,18424,HEM
62,,SING,C2D,CMD,yes,N,62,,86478,18424,HEM
63,,SING,C3D,C4D,no,N,63,,86478,18424,HEM
64,,SING,C3D,CAD,yes,N,64,,86478,18424,HEM
65,,SING,C4D,ND,no,N,65,,86478,18424,HEM
66,,SING,CMD,HMD,yes,N,66,,86478,18424,HEM
67,,SING,CMD,HMDA,no,N,67,,86478,18424,HEM
68,,SING,CMD,HMDB,no,N,68,,86478,18424,HEM
69,,SING,CAD,CBD,no,N,69,,86478,18424,HEM
70,,SING,CAD,HAD,no,N,70,,86478,18424,HEM
71,,SING,CAD,HADA,no,N,71,,86478,18424,HEM
72,,SING,CBD,CGD,no,N,72,,86478,18424,HEM
73,,SING,CBD,HBD,no,N,73,,86478,18424,HEM
74,,SING,CBD,HBDA,no,N,74,,86478,18424,HEM
75,,DOUB,CGD,O1D,no,N,75,,86478,18424,HEM
76,,SING,CGD,O2D,no,N,76,,86478,18424,HEM
77,,SING,O2A,H2A,no,N,77,,86478,18424,HEM
78,,SING,O2D,H2D,no,N,78,,86478,18424,HEM
79,,SING,FE,NA,no,N,79,,86478,18424,HEM
80,,SING,FE,NB,no,N,80,,86478,18424,HEM
81,,SING,FE,NC,no,N,81,,86478,18424,HEM
82,,SING,FE,ND,no,N,82,,86478,18424,HEM
1,,SING,O3P,P,no,N,1,,86535,18427,CFL
2,,SING,O3P,HO3P,no,N,2,,86535,18427,CFL
3,,SING,P,O1P,no,N,3,,86535,18427,CFL
4,,DOUB,P,O2P,no,N,4,,86535,18427,CFL
5,,SING,P,O5',no,N,5,,86535,18427,CFL
6,,SING,O1P,HO1P,no,N,6,,86535,18427,CFL
7,,SING,O5',C5',no,N,7,,86535,18427,CFL
8,,SING,C5',C4',no,N,8,,86535,18427,CFL
9,,SING,C5',H5'1,no,N,9,,86535,18427,CFL
10,,SING,C5',H5'2,no,N,10,,86535,18427,CFL
11,,SING,C4',O4',no,N,11,,86535,18427,CFL
12,,SING,C4',C3',no,N,12,,86535,18427,CFL
13,,SING,C4',H4',no,N,13,,86535,18427,CFL
14,,SING,O4',C1',no,N,14,,86535,18427,CFL
15,,SING,C3',O3',no,N,15,,86535,18427,CFL
16,,SING,C3',C2',no,N,16,,86535,18427,CFL
17,,SING,C3',H3',no,N,17,,86535,18427,CFL
18,,SING,O3',HO3',no,N,18,,86535,18427,CFL
19,,SING,C2',C1',no,N,19,,86535,18427,CFL
20,,SING,C2',F,no,N,20,,86535,18427,CFL
21,,SING,C2',H2',no,N,21,,86535,18427,CFL
22,,SING,C1',N1,no,N,22,,86535,18427,CFL
23,,SING,C1',H1',no,N,23,,86535,18427,CFL
24,,SING,N1,C2,no,N,24,,86535,18427,CFL
25,,SING,N1,C6,no,N,25,,86535,18427,CFL
26,,DOUB,C2,O2,no,N,26,,86535,18427,CFL
27,,SING,C2,N3,no,N,27,,86535,18427,CFL
28,,DOUB,N3,C4,no,N,28,,86535,18427,CFL
29,,SING,C4,N4,no,N,29,,86535,18427,CFL
30,,SING,C4,C5,no,N,30,,86535,18427,CFL
31,,SING,N4,HN41,no,N,31,,86535,18427,CFL
32,,SING,N4,HN42,no,N,32,,86535,18427,CFL
33,,DOUB,C5,C6,no,N,33,,86535,18427,CFL
34,,SING,C5,H5,no,N,34,,86535,18427,CFL
35,,SING,C6,H6,no,N,35,,86535,18427,CFL
1,,SING,O3P,P,no,N,1,,86536,18427,GFL
2,,SING,O3P,HO3P,no,N,2,,86536,18427,GFL
3,,DOUB,P,O1P,no,N,3,,86536,18427,GFL
4,,SING,P,O2P,no,N,4,,86536,18427,GFL
5,,SING,P,O5',no,N,5,,86536,18427,GFL
6,,SING,O2P,HO2P,no,N,6,,86536,18427,GFL
7,,SING,O5',C5',no,N,7,,86536,18427,GFL
8,,SING,C5',C4',no,N,8,,86536,18427,GFL
9,,SING,C5',H5'1,no,N,9,,86536,18427,GFL
10,,SING,C5',H5'2,no,N,10,,86536,18427,GFL
11,,SING,C4',O4',no,N,11,,86536,18427,GFL
12,,SING,C4',C3',no,N,12,,86536,18427,GFL
13,,SING,C4',H4',no,N,13,,86536,18427,GFL
14,,SING,O4',C1',no,N,14,,86536,18427,GFL
15,,SING,C3',O3',no,N,15,,86536,18427,GFL
16,,SING,C3',C2',no,N,16,,86536,18427,GFL
17,,SING,C3',H3',no,N,17,,86536,18427,GFL
18,,SING,O3',HO3',no,N,18,,86536,18427,GFL
19,,SING,C2',C1',no,N,19,,86536,18427,GFL
20,,SING,C2',F,no,N,20,,86536,18427,GFL
21,,SING,C2',H2',no,N,21,,86536,18427,GFL
22,,SING,C1',N9,no,N,22,,86536,18427,GFL
23,,SING,C1',H1',no,N,23,,86536,18427,GFL
24,,SING,N9,C8,yes,N,24,,86536,18427,GFL
25,,SING,N9,C4,yes,N,25,,86536,18427,GFL
26,,DOUB,C8,N7,yes,N,26,,86536,18427,GFL
27,,SING,C8,H8,no,N,27,,86536,18427,GFL
28,,SING,N7,C5,yes,N,28,,86536,18427,GFL
29,,SING,C5,C6,no,N,29,,86536,18427,GFL
30,,DOUB,C5,C4,yes,N,30,,86536,18427,GFL
31,,DOUB,C6,O6,no,N,31,,86536,18427,GFL
32,,SING,C6,N1,no,N,32,,86536,18427,GFL
33,,SING,N1,C2,no,N,33,,86536,18427,GFL
34,,SING,N1,HN1,no,N,34,,86536,18427,GFL
35,,SING,C2,N2,no,N,35,,86536,18427,GFL
36,,DOUB,C2,N3,no,N,36,,86536,18427,GFL
37,,SING,N2,HN21,no,N,37,,86536,18427,GFL
38,,SING,N2,HN22,no,N,38,,86536,18427,GFL
39,,SING,N3,C4,no,N,39,,86536,18427,GFL
1,,DOUB,OP2,P,no,N,1,,86537,18427,A5O
2,,SING,P,OP1,no,N,2,,86537,18427,A5O
3,,SING,P,O5',no,N,3,,86537,18427,A5O
4,,SING,P,OP3,no,N,4,,86537,18427,A5O
5,,DOUB,C6,N1,yes,N,5,,86537,18427,A5O
6,,SING,N1,C2,yes,N,6,,86537,18427,A5O
7,,DOUB,N3,C2,yes,N,7,,86537,18427,A5O
8,,SING,C2,H2,no,N,8,,86537,18427,A5O
9,,SING,C4,N3,yes,N,9,,86537,18427,A5O
10,,DOUB,C5,C4,yes,N,10,,86537,18427,A5O
11,,SING,N9,C4,yes,N,11,,86537,18427,A5O
12,,SING,N7,C5,yes,N,12,,86537,18427,A5O
13,,SING,C5,C6,yes,N,13,,86537,18427,A5O
14,,SING,N6,C6,no,N,14,,86537,18427,A5O
15,,SING,HN6,N6,no,N,15,,86537,18427,A5O
16,,SING,N6,HN6A,no,N,16,,86537,18427,A5O
17,,DOUB,N7,C8,yes,N,17,,86537,18427,A5O
18,,SING,H8,C8,no,N,18,,86537,18427,A5O
19,,SING,C8,N9,yes,N,19,,86537,18427,A5O
20,,SING,N9,C1',no,N,20,,86537,18427,A5O
21,,SING,C2',C1',no,N,21,,86537,18427,A5O
22,,SING,C1',H1',no,N,22,,86537,18427,A5O
23,,SING,C1',O4',no,N,23,,86537,18427,A5O
24,,SING,O2',C2',no,N,24,,86537,18427,A5O
25,,SING,H2',C2',no,N,25,,86537,18427,A5O
26,,SING,C2',C3',no,N,26,,86537,18427,A5O
27,,SING,O2',HO2',no,N,27,,86537,18427,A5O
28,,SING,H3',C3',no,N,28,,86537,18427,A5O
29,,SING,C3',O3',no,N,29,,86537,18427,A5O
30,,SING,C3',C4',no,N,30,,86537,18427,A5O
31,,SING,O3',HO3',no,N,31,,86537,18427,A5O
32,,SING,C5',C4',no,N,32,,86537,18427,A5O
33,,SING,O4',C4',no,N,33,,86537,18427,A5O
34,,SING,C4',H4',no,N,34,,86537,18427,A5O
35,,SING,O5',C5',no,N,35,,86537,18427,A5O
36,,SING,C5',H5'A,no,N,36,,86537,18427,A5O
37,,SING,C5',H5',no,N,37,,86537,18427,A5O
38,,SING,OP1,HOP1,no,N,38,,86537,18427,A5O
39,,SING,OP3,HOP3,no,N,39,,86537,18427,A5O
1,,SING,OP3,P,no,N,1,,86538,18427,UAR
2,,SING,OP3,HOP3,no,N,2,,86538,18427,UAR
3,,DOUB,P,OP1,no,N,3,,86538,18427,UAR
4,,SING,P,OP2,no,N,4,,86538,18427,UAR
5,,SING,P,O5',no,N,5,,86538,18427,UAR
6,,SING,OP2,HOP2,no,N,6,,86538,18427,UAR
7,,SING,O5',C5',no,N,7,,86538,18427,UAR
8,,SING,C5',C4',no,N,8,,86538,18427,UAR
9,,SING,C5',H5',no,N,9,,86538,18427,UAR
10,,SING,C5',H5'',no,N,10,,86538,18427,UAR
11,,SING,C4',O4',no,N,11,,86538,18427,UAR
12,,SING,C4',C3',no,N,12,,86538,18427,UAR
13,,SING,C4',H4',no,N,13,,86538,18427,UAR
14,,SING,O4',C1',no,N,14,,86538,18427,UAR
15,,SING,C3',O3',no,N,15,,86538,18427,UAR
16,,SING,C3',C2',no,N,16,,86538,18427,UAR
17,,SING,C3',H3',no,N,17,,86538,18427,UAR
18,,SING,O3',HO3',no,N,18,,86538,18427,UAR
19,,SING,C2',O2',no,N,19,,86538,18427,UAR
20,,SING,C2',C1',no,N,20,,86538,18427,UAR
21,,SING,C2',H2',no,N,21,,86538,18427,UAR
22,,SING,O2',HO2',no,N,22,,86538,18427,UAR
23,,SING,C1',N1,no,N,23,,86538,18427,UAR
24,,SING,C1',H1',no,N,24,,86538,18427,UAR
25,,SING,N1,C2,no,N,25,,86538,18427,UAR
26,,SING,N1,C6,no,N,26,,86538,18427,UAR
27,,DOUB,C2,O2,no,N,27,,86538,18427,UAR
28,,SING,C2,N3,no,N,28,,86538,18427,UAR
29,,SING,N3,C4,no,N,29,,86538,18427,UAR
30,,SING,N3,H3,no,N,30,,86538,18427,UAR
31,,DOUB,C4,O4,no,N,31,,86538,18427,UAR
32,,SING,C4,C5,no,N,32,,86538,18427,UAR
33,,DOUB,C5,C6,no,N,33,,86538,18427,UAR
34,,SING,C5,H5,no,N,34,,86538,18427,UAR
35,,SING,C6,H6,no,N,35,,86538,18427,UAR
1,,SING,P,O5',no,N,1,,86614,18430,02I
2,,SING,P,OP3,no,N,2,,86614,18430,02I
3,,SING,N1,C6,yes,N,3,,86614,18430,02I
4,,DOUB,C2,N1,yes,N,4,,86614,18430,02I
5,,SING,N3,C2,yes,N,5,,86614,18430,02I
6,,DOUB,N3,C4,yes,N,6,,86614,18430,02I
7,,SING,C4,C5,yes,N,7,,86614,18430,02I
8,,DOUB,C5,C6,yes,N,8,,86614,18430,02I
9,,SING,C5,N7,yes,N,9,,86614,18430,02I
10,,SING,C6,N6,no,N,10,,86614,18430,02I
11,,SING,N6,H2N6,no,N,11,,86614,18430,02I
12,,DOUB,C8,N7,yes,N,12,,86614,18430,02I
13,,SING,C8,C5',no,N,13,,86614,18430,02I
14,,SING,N9,C4,yes,N,14,,86614,18430,02I
15,,SING,N9,C8,yes,N,15,,86614,18430,02I
16,,SING,C1',N9,no,N,16,,86614,18430,02I
17,,SING,C1',C2',no,N,17,,86614,18430,02I
18,,SING,OP3,HOP3,no,N,18,,86614,18430,02I
19,,SING,C2',C3',no,N,19,,86614,18430,02I
20,,SING,C2',H12',no,N,20,,86614,18430,02I
21,,SING,OP2,P,no,N,21,,86614,18430,02I
22,,SING,OP2,HOP2,no,N,22,,86614,18430,02I
23,,SING,C3',O3',no,N,23,,86614,18430,02I
24,,SING,C3',H3',no,N,24,,86614,18430,02I
25,,SING,O3',HO3',no,N,25,,86614,18430,02I
26,,SING,C4',C3',no,N,26,,86614,18430,02I
27,,SING,C4',C5',no,N,27,,86614,18430,02I
28,,SING,O4',C1',no,N,28,,86614,18430,02I
29,,SING,O4',C4',no,N,29,,86614,18430,02I
30,,SING,C5',O5',no,N,30,,86614,18430,02I
31,,SING,H2,C2,no,N,31,,86614,18430,02I
32,,SING,H1N6,N6,no,N,32,,86614,18430,02I
33,,SING,H1',C1',no,N,33,,86614,18430,02I
34,,SING,H22',C2',no,N,34,,86614,18430,02I
35,,SING,H4',C4',no,N,35,,86614,18430,02I
36,,SING,H5',C5',no,N,36,,86614,18430,02I
37,,DOUB,P,OP1,no,N,37,,86614,18430,02I
1,,DOUB,OH,CH,no,N,1,,86784,18439,ALY
2,,SING,CH,CH3,no,N,2,,86784,18439,ALY
3,,SING,CH,NZ,no,N,3,,86784,18439,ALY
4,,SING,CH3,HH31,no,N,4,,86784,18439,ALY
5,,SING,CH3,HH32,no,N,5,,86784,18439,ALY
6,,SING,CH3,HH33,no,N,6,,86784,18439,ALY
7,,SING,NZ,CE,no,N,7,,86784,18439,ALY
8,,SING,NZ,HZ,no,N,8,,86784,18439,ALY
9,,SING,CE,CD,no,N,9,,86784,18439,ALY
10,,SING,CE,HE3,no,N,10,,86784,18439,ALY
11,,SING,CE,HE2,no,N,11,,86784,18439,ALY
12,,SING,CD,CG,no,N,12,,86784,18439,ALY
13,,SING,CD,HD3,no,N,13,,86784,18439,ALY
14,,SING,CD,HD2,no,N,14,,86784,18439,ALY
15,,SING,CG,CB,no,N,15,,86784,18439,ALY
16,,SING,CG,HG3,no,N,16,,86784,18439,ALY
17,,SING,CG,HG2,no,N,17,,86784,18439,ALY
18,,SING,CB,CA,no,N,18,,86784,18439,ALY
19,,SING,CB,HB3,no,N,19,,86784,18439,ALY
20,,SING,CB,HB2,no,N,20,,86784,18439,ALY
21,,SING,CA,N,no,N,21,,86784,18439,ALY
22,,SING,CA,C,no,N,22,,86784,18439,ALY
23,,SING,CA,HCA,no,N,23,,86784,18439,ALY
24,,SING,N,H,no,N,24,,86784,18439,ALY
25,,SING,N,H2,no,N,25,,86784,18439,ALY
26,,DOUB,C,O,no,N,26,,86784,18439,ALY
27,,SING,C,OXT,no,N,27,,86784,18439,ALY
28,,SING,OXT,HXT,no,N,28,,86784,18439,ALY
1,,DOUB,PG,O1G,no,N,1,,87132,18461,GNP
2,,SING,PG,O2G,no,N,2,,87132,18461,GNP
3,,SING,PG,O3G,no,N,3,,87132,18461,GNP
4,,SING,PG,N3B,no,N,4,,87132,18461,GNP
5,,SING,O2G,HOG2,no,N,5,,87132,18461,GNP
6,,SING,O3G,HOG3,no,N,6,,87132,18461,GNP
7,,SING,N3B,PB,no,N,7,,87132,18461,GNP
8,,SING,N3B,HNB3,no,N,8,,87132,18461,GNP
9,,DOUB,PB,O1B,no,N,9,,87132,18461,GNP
10,,SING,PB,O2B,no,N,10,,87132,18461,GNP
11,,SING,PB,O3A,no,N,11,,87132,18461,GNP
12,,SING,O2B,HOB2,no,N,12,,87132,18461,GNP
13,,SING,O3A,PA,no,N,13,,87132,18461,GNP
14,,DOUB,PA,O1A,no,N,14,,87132,18461,GNP
15,,SING,PA,O2A,no,N,15,,87132,18461,GNP
16,,SING,PA,O5',no,N,16,,87132,18461,GNP
17,,SING,O2A,HOA2,no,N,17,,87132,18461,GNP
18,,SING,O5',C5',no,N,18,,87132,18461,GNP
19,,SING,C5',C4',no,N,19,,87132,18461,GNP
20,,SING,C5',H5'2,no,N,20,,87132,18461,GNP
21,,SING,C5',H5'1,no,N,21,,87132,18461,GNP
22,,SING,C4',O4',no,N,22,,87132,18461,GNP
23,,SING,C4',C3',no,N,23,,87132,18461,GNP
24,,SING,C4',H4',no,N,24,,87132,18461,GNP
25,,SING,O4',C1',no,N,25,,87132,18461,GNP
26,,SING,C3',O3',no,N,26,,87132,18461,GNP
27,,SING,C3',C2',no,N,27,,87132,18461,GNP
28,,SING,C3',H3',no,N,28,,87132,18461,GNP
29,,SING,O3',HO3',no,N,29,,87132,18461,GNP
30,,SING,C2',O2',no,N,30,,87132,18461,GNP
31,,SING,C2',C1',no,N,31,,87132,18461,GNP
32,,SING,C2',H2',no,N,32,,87132,18461,GNP
33,,SING,O2',HO2',no,N,33,,87132,18461,GNP
34,,SING,C1',N9,no,N,34,,87132,18461,GNP
35,,SING,C1',H1',no,N,35,,87132,18461,GNP
36,,SING,N9,C8,yes,N,36,,87132,18461,GNP
37,,SING,N9,C4,yes,N,37,,87132,18461,GNP
38,,DOUB,C8,N7,yes,N,38,,87132,18461,GNP
39,,SING,C8,H8,no,N,39,,87132,18461,GNP
40,,SING,N7,C5,yes,N,40,,87132,18461,GNP
41,,SING,C5,C6,yes,N,41,,87132,18461,GNP
42,,DOUB,C5,C4,yes,N,42,,87132,18461,GNP
43,,DOUB,C6,O6,no,N,43,,87132,18461,GNP
44,,SING,C6,N1,yes,N,44,,87132,18461,GNP
45,,SING,N1,C2,yes,N,45,,87132,18461,GNP
46,,SING,N1,HN1,no,N,46,,87132,18461,GNP
47,,SING,C2,N2,no,N,47,,87132,18461,GNP
48,,DOUB,C2,N3,yes,N,48,,87132,18461,GNP
49,,SING,N2,HN21,no,N,49,,87132,18461,GNP
50,,SING,N2,HN22,no,N,50,,87132,18461,GNP
51,,SING,N3,C4,yes,N,51,,87132,18461,GNP
1,,SING,O,H1,no,N,1,,87134,18461,HOH
2,,SING,O,H2,no,N,2,,87134,18461,HOH
1,,SING,OAX,CAW,no,N,1,,87419,18473,U46
2,,SING,OAX,HAX,no,N,2,,87419,18473,U46
3,,DOUB,CAW,OAY,no,N,3,,87419,18473,U46
4,,SING,CAW,CAR,no,N,4,,87419,18473,U46
5,,SING,CAR,CAQ,no,N,5,,87419,18473,U46
6,,SING,CAR,HAR1,no,N,6,,87419,18473,U46
7,,SING,CAR,HAR2,no,N,7,,87419,18473,U46
8,,SING,CAQ,CAP,no,N,8,,87419,18473,U46
9,,SING,CAQ,HAQ1,no,N,9,,87419,18473,U46
10,,SING,CAQ,HAQ2,no,N,10,,87419,18473,U46
11,,SING,CAP,CAO,no,N,11,,87419,18473,U46
12,,SING,CAP,HAP1,no,N,12,,87419,18473,U46
13,,SING,CAP,HAP2,no,N,13,,87419,18473,U46
14,,DOUB,CAO,CAN,no,Z,14,,87419,18473,U46
15,,SING,CAO,HAO,no,N,15,,87419,18473,U46
16,,SING,CAN,CAF,no,N,16,,87419,18473,U46
17,,SING,CAN,HAN,no,N,17,,87419,18473,U46
18,,SING,CAF,CAD,no,N,18,,87419,18473,U46
19,,SING,CAF,HAF1,no,N,19,,87419,18473,U46
20,,SING,CAF,HAF2,no,N,20,,87419,18473,U46
21,,SING,CAD,CAC,no,N,21,,87419,18473,U46
22,,SING,CAD,CAE,no,N,22,,87419,18473,U46
23,,SING,CAD,HAD,no,N,23,,87419,18473,U46
24,,SING,CAC,CAB,no,N,24,,87419,18473,U46
25,,SING,CAC,CAT,no,N,25,,87419,18473,U46
26,,SING,CAC,HAC,no,N,26,,87419,18473,U46
27,,SING,CAB,CAA,no,N,27,,87419,18473,U46
28,,SING,CAB,HAB1,no,N,28,,87419,18473,U46
29,,SING,CAB,HAB2,no,N,29,,87419,18473,U46
30,,SING,CAT,OAS,no,N,30,,87419,18473,U46
31,,SING,CAT,HAT1,no,N,31,,87419,18473,U46
32,,SING,CAT,HAT2,no,N,32,,87419,18473,U46
33,,SING,OAS,CAA,no,N,33,,87419,18473,U46
34,,SING,CAA,CAE,no,N,34,,87419,18473,U46
35,,SING,CAA,HAA,no,N,35,,87419,18473,U46
36,,SING,CAE,CAG,no,N,36,,87419,18473,U46
37,,SING,CAE,HAE,no,N,37,,87419,18473,U46
38,,DOUB,CAG,CAH,no,E,38,,87419,18473,U46
39,,SING,CAG,HAG,no,N,39,,87419,18473,U46
40,,SING,CAH,CAI,no,N,40,,87419,18473,U46
41,,SING,CAH,HAH,no,N,41,,87419,18473,U46
42,,SING,CAI,OAU,no,N,42,,87419,18473,U46
43,,SING,CAI,CAJ,no,N,43,,87419,18473,U46
44,,SING,CAI,HAI,no,N,44,,87419,18473,U46
45,,SING,OAU,HAU,no,N,45,,87419,18473,U46
46,,SING,CAJ,CAK,no,N,46,,87419,18473,U46
47,,SING,CAJ,HAJ1,no,N,47,,87419,18473,U46
48,,SING,CAJ,HAJ2,no,N,48,,87419,18473,U46
49,,SING,CAK,CAL,no,N,49,,87419,18473,U46
50,,SING,CAK,HAK1,no,N,50,,87419,18473,U46
51,,SING,CAK,HAK2,no,N,51,,87419,18473,U46
52,,SING,CAL,CAM,no,N,52,,87419,18473,U46
53,,SING,CAL,HAL1,no,N,53,,87419,18473,U46
54,,SING,CAL,HAL2,no,N,54,,87419,18473,U46
55,,SING,CAM,CAV,no,N,55,,87419,18473,U46
56,,SING,CAM,HAM1,no,N,56,,87419,18473,U46
57,,SING,CAM,HAM2,no,N,57,,87419,18473,U46
58,,SING,CAV,HAV1,no,N,58,,87419,18473,U46
59,,SING,CAV,HAV2,no,N,59,,87419,18473,U46
60,,SING,CAV,HAV3,no,N,60,,87419,18473,U46
1,,SING,C1,NH1,no,N,1,,87703,18490,DA2
2,,SING,C1,HC11,no,N,2,,87703,18490,DA2
3,,SING,C1,HC12,no,N,3,,87703,18490,DA2
4,,SING,C1,HC13,no,N,4,,87703,18490,DA2
5,,SING,C2,NH1,no,N,5,,87703,18490,DA2
6,,SING,C2,HC21,no,N,6,,87703,18490,DA2
7,,SING,C2,HC22,no,N,7,,87703,18490,DA2
8,,SING,C2,HC23,no,N,8,,87703,18490,DA2
9,,SING,N,CA,no,N,9,,87703,18490,DA2
10,,SING,N,HN1,no,N,10,,87703,18490,DA2
11,,SING,N,HN2,no,N,11,,87703,18490,DA2
12,,SING,CA,CB,no,N,12,,87703,18490,DA2
13,,SING,CA,C,no,N,13,,87703,18490,DA2
14,,SING,CA,HCA,no,N,14,,87703,18490,DA2
15,,SING,CB,CG,no,N,15,,87703,18490,DA2
16,,SING,CB,HCB1,no,N,16,,87703,18490,DA2
17,,SING,CB,HCB2,no,N,17,,87703,18490,DA2
18,,SING,CG,CD,no,N,18,,87703,18490,DA2
19,,SING,CG,HCG1,no,N,19,,87703,18490,DA2
20,,SING,CG,HCG2,no,N,20,,87703,18490,DA2
21,,SING,CD,NE,no,N,21,,87703,18490,DA2
22,,SING,CD,HCD1,no,N,22,,87703,18490,DA2
23,,SING,CD,HCD2,no,N,23,,87703,18490,DA2
24,,SING,NE,CZ,no,N,24,,87703,18490,DA2
25,,SING,NE,HNE,no,N,25,,87703,18490,DA2
26,,DOUB,CZ,NH2,no,Z,26,,87703,18490,DA2
27,,SING,CZ,NH1,no,N,27,,87703,18490,DA2
28,,SING,NH2,HNH2,no,N,28,,87703,18490,DA2
29,,DOUB,C,OA1,no,N,29,,87703,18490,DA2
30,,SING,C,OA2,no,N,30,,87703,18490,DA2
31,,SING,OA2,HOA2,no,N,31,,87703,18490,DA2
1,,DOUB,C1,O1,no,N,1,,87761,18493,UQ1
2,,SING,C1,C2,no,N,2,,87761,18493,UQ1
3,,SING,C1,C6,no,N,3,,87761,18493,UQ1
4,,SING,C2,O2,no,N,4,,87761,18493,UQ1
5,,DOUB,C2,C3,no,N,5,,87761,18493,UQ1
6,,SING,O2,CM2,no,N,6,,87761,18493,UQ1
7,,SING,CM2,HM21,no,N,7,,87761,18493,UQ1
8,,SING,CM2,HM22,no,N,8,,87761,18493,UQ1
9,,SING,CM2,HM23,no,N,9,,87761,18493,UQ1
10,,SING,C3,O3,no,N,10,,87761,18493,UQ1
11,,SING,C3,C4,no,N,11,,87761,18493,UQ1
12,,SING,O3,CM3,no,N,12,,87761,18493,UQ1
13,,SING,CM3,HM31,no,N,13,,87761,18493,UQ1
14,,SING,CM3,HM32,no,N,14,,87761,18493,UQ1
15,,SING,CM3,HM33,no,N,15,,87761,18493,UQ1
16,,DOUB,C4,O4,no,N,16,,87761,18493,UQ1
17,,SING,C4,C5,no,N,17,,87761,18493,UQ1
18,,SING,C5,CM5,no,N,18,,87761,18493,UQ1
19,,DOUB,C5,C6,no,N,19,,87761,18493,UQ1
20,,SING,CM5,HM51,no,N,20,,87761,18493,UQ1
21,,SING,CM5,HM52,no,N,21,,87761,18493,UQ1
22,,SING,CM5,HM53,no,N,22,,87761,18493,UQ1
23,,SING,C6,C7,no,N,23,,87761,18493,UQ1
24,,SING,C7,C8,no,N,24,,87761,18493,UQ1
25,,SING,C7,H71,no,N,25,,87761,18493,UQ1
26,,SING,C7,H72,no,N,26,,87761,18493,UQ1
27,,DOUB,C8,C9,no,N,27,,87761,18493,UQ1
28,,SING,C8,H8,no,N,28,,87761,18493,UQ1
29,,SING,C9,C10,no,N,29,,87761,18493,UQ1
30,,SING,C9,C11,no,N,30,,87761,18493,UQ1
31,,SING,C10,H101,no,N,31,,87761,18493,UQ1
32,,SING,C10,H102,no,N,32,,87761,18493,UQ1
33,,SING,C10,H103,no,N,33,,87761,18493,UQ1
34,,SING,C11,H111,no,N,34,,87761,18493,UQ1
35,,SING,C11,H112,no,N,35,,87761,18493,UQ1
36,,SING,C11,H113,no,N,36,,87761,18493,UQ1
1,,SING,N,CA,no,N,1,,88261,18518,SEP
2,,SING,N,H,no,N,2,,88261,18518,SEP
3,,SING,N,H2,no,N,3,,88261,18518,SEP
4,,SING,CA,CB,no,N,4,,88261,18518,SEP
5,,SING,CA,C,no,N,5,,88261,18518,SEP
6,,SING,CA,HA,no,N,6,,88261,18518,SEP
7,,SING,CB,OG,no,N,7,,88261,18518,SEP
8,,SING,CB,HB2,no,N,8,,88261,18518,SEP
9,,SING,CB,HB3,no,N,9,,88261,18518,SEP
10,,SING,OG,P,no,N,10,,88261,18518,SEP
11,,DOUB,C,O,no,N,11,,88261,18518,SEP
12,,SING,C,OXT,no,N,12,,88261,18518,SEP
13,,SING,OXT,HXT,no,N,13,,88261,18518,SEP
14,,DOUB,P,O1P,no,N,14,,88261,18518,SEP
15,,SING,P,O2P,no,N,15,,88261,18518,SEP
16,,SING,P,O3P,no,N,16,,88261,18518,SEP
17,,SING,O2P,HOP2,no,N,17,,88261,18518,SEP
18,,SING,O3P,HOP3,no,N,18,,88261,18518,SEP
1,,SING,N,C5,no,N,1,,88303,18520,DPV
2,,SING,N,C6,no,N,2,,88303,18520,DPV
3,,SING,N,C7,no,N,3,,88303,18520,DPV
4,,SING,N,C8,no,N,4,,88303,18520,DPV
5,,SING,P,O1P,no,N,5,,88303,18520,DPV
6,,DOUB,P,O2P,no,N,6,,88303,18520,DPV
7,,SING,P,O3P,no,N,7,,88303,18520,DPV
8,,SING,P,O4P,no,N,8,,88303,18520,DPV
9,,SING,C1,C2,no,N,9,,88303,18520,DPV
10,,SING,C1,O3P,no,N,10,,88303,18520,DPV
11,,SING,C2,C3,no,N,11,,88303,18520,DPV
12,,SING,C3,C15,no,N,12,,88303,18520,DPV
13,,SING,C4,C5,no,N,13,,88303,18520,DPV
14,,SING,C4,O4P,no,N,14,,88303,18520,DPV
15,,SING,C15,C16,no,N,15,,88303,18520,DPV
16,,SING,C16,C17,no,N,16,,88303,18520,DPV
17,,SING,C17,C18,no,N,17,,88303,18520,DPV
18,,SING,C18,C19,no,N,18,,88303,18520,DPV
19,,SING,C19,C20,no,N,19,,88303,18520,DPV
20,,SING,C20,C21,no,N,20,,88303,18520,DPV
21,,SING,C21,C22,no,N,21,,88303,18520,DPV
22,,SING,C22,C23,no,N,22,,88303,18520,DPV
23,,SING,C1,H1,no,N,23,,88303,18520,DPV
24,,SING,C1,H1A,no,N,24,,88303,18520,DPV
25,,SING,C2,H2,no,N,25,,88303,18520,DPV
26,,SING,C2,H2A,no,N,26,,88303,18520,DPV
27,,SING,C3,H3,no,N,27,,88303,18520,DPV
28,,SING,C3,H3A,no,N,28,,88303,18520,DPV
29,,SING,C4,H4,no,N,29,,88303,18520,DPV
30,,SING,C4,H4A,no,N,30,,88303,18520,DPV
31,,SING,C5,H5,no,N,31,,88303,18520,DPV
32,,SING,C5,H5A,no,N,32,,88303,18520,DPV
33,,SING,C6,H6,no,N,33,,88303,18520,DPV
34,,SING,C6,H6A,no,N,34,,88303,18520,DPV
35,,SING,C6,H6B,no,N,35,,88303,18520,DPV
36,,SING,C7,H7,no,N,36,,88303,18520,DPV
37,,SING,C7,H7A,no,N,37,,88303,18520,DPV
38,,SING,C7,H7B,no,N,38,,88303,18520,DPV
39,,SING,C8,H8,no,N,39,,88303,18520,DPV
40,,SING,C8,H8A,no,N,40,,88303,18520,DPV
41,,SING,C8,H8B,no,N,41,,88303,18520,DPV
42,,SING,C15,H15,no,N,42,,88303,18520,DPV
43,,SING,C15,H15A,no,N,43,,88303,18520,DPV
44,,SING,C16,H16,no,N,44,,88303,18520,DPV
45,,SING,C16,H16A,no,N,45,,88303,18520,DPV
46,,SING,C17,H17,no,N,46,,88303,18520,DPV
47,,SING,C17,H17A,no,N,47,,88303,18520,DPV
48,,SING,C18,H18,no,N,48,,88303,18520,DPV
49,,SING,C18,H18A,no,N,49,,88303,18520,DPV
50,,SING,C19,H19,no,N,50,,88303,18520,DPV
51,,SING,C19,H19A,no,N,51,,88303,18520,DPV
52,,SING,C20,H20,no,N,52,,88303,18520,DPV
53,,SING,C20,H20A,no,N,53,,88303,18520,DPV
54,,SING,C21,H21,no,N,54,,88303,18520,DPV
55,,SING,C21,H21A,no,N,55,,88303,18520,DPV
56,,SING,C22,H22,no,N,56,,88303,18520,DPV
57,,SING,C22,H22A,no,N,57,,88303,18520,DPV
58,,SING,C23,H23,no,N,58,,88303,18520,DPV
59,,SING,C23,H23A,no,N,59,,88303,18520,DPV
60,,SING,C23,H23B,no,N,60,,88303,18520,DPV
1,,DOUB,P,OP1,no,N,1,,88388,18524,IGU
2,,SING,P,OP2,no,N,2,,88388,18524,IGU
3,,SING,P,OP3,no,N,3,,88388,18524,IGU
4,,SING,P,O5',no,N,4,,88388,18524,IGU
5,,SING,OP2,HOP2,no,N,5,,88388,18524,IGU
6,,SING,OP3,HOP3,no,N,6,,88388,18524,IGU
7,,SING,O5',C5',no,N,7,,88388,18524,IGU
8,,SING,C5',C4',no,N,8,,88388,18524,IGU
9,,SING,C5',H5',no,N,9,,88388,18524,IGU
10,,SING,C5',H5'',no,N,10,,88388,18524,IGU
11,,SING,C4',O4',no,N,11,,88388,18524,IGU
12,,SING,C4',C3',no,N,12,,88388,18524,IGU
13,,SING,C4',H4',no,N,13,,88388,18524,IGU
14,,SING,O4',C1',no,N,14,,88388,18524,IGU
15,,SING,C3',O3',no,N,15,,88388,18524,IGU
16,,SING,C3',C2',no,N,16,,88388,18524,IGU
17,,SING,C3',H3',no,N,17,,88388,18524,IGU
18,,SING,O3',HO3',no,N,18,,88388,18524,IGU
19,,SING,C2',C1',no,N,19,,88388,18524,IGU
20,,SING,C2',H2',no,N,20,,88388,18524,IGU
21,,SING,C2',H2'',no,N,21,,88388,18524,IGU
22,,SING,C1',N9,no,N,22,,88388,18524,IGU
23,,SING,C1',H1',no,N,23,,88388,18524,IGU
24,,SING,N9,C8,no,N,24,,88388,18524,IGU
25,,SING,N9,C4,no,N,25,,88388,18524,IGU
26,,DOUB,C8,N7,no,N,26,,88388,18524,IGU
27,,SING,C8,H8,no,N,27,,88388,18524,IGU
28,,SING,N7,C5,no,N,28,,88388,18524,IGU
29,,SING,C6,N6,no,N,29,,88388,18524,IGU
30,,DOUB,C6,C5,no,N,30,,88388,18524,IGU
31,,SING,C6,N1,no,N,31,,88388,18524,IGU
32,,SING,N6,HN61,no,N,32,,88388,18524,IGU
33,,SING,N6,HN62,no,N,33,,88388,18524,IGU
34,,SING,C5,C4,no,N,34,,88388,18524,IGU
35,,SING,N1,C2,no,N,35,,88388,18524,IGU
36,,DOUB,C2,O2,no,N,36,,88388,18524,IGU
37,,SING,C2,N3,no,N,37,,88388,18524,IGU
38,,DOUB,N3,C4,no,N,38,,88388,18524,IGU
39,,SING,N1,HN1,no,N,39,,88388,18524,IGU
1,,DOUB,PB,O1B,no,N,1,,88472,18529,GDP
2,,SING,PB,O2B,no,N,2,,88472,18529,GDP
3,,SING,PB,O3B,no,N,3,,88472,18529,GDP
4,,SING,PB,O3A,no,N,4,,88472,18529,GDP
5,,SING,O2B,HOB2,no,N,5,,88472,18529,GDP
6,,SING,O3B,HOB3,no,N,6,,88472,18529,GDP
7,,SING,O3A,PA,no,N,7,,88472,18529,GDP
8,,DOUB,PA,O1A,no,N,8,,88472,18529,GDP
9,,SING,PA,O2A,no,N,9,,88472,18529,GDP
10,,SING,PA,O5',no,N,10,,88472,18529,GDP
11,,SING,O2A,HOA2,no,N,11,,88472,18529,GDP
12,,SING,O5',C5',no,N,12,,88472,18529,GDP
13,,SING,C5',C4',no,N,13,,88472,18529,GDP
14,,SING,C5',H5',no,N,14,,88472,18529,GDP
15,,SING,C5',H5'',no,N,15,,88472,18529,GDP
16,,SING,C4',O4',no,N,16,,88472,18529,GDP
17,,SING,C4',C3',no,N,17,,88472,18529,GDP
18,,SING,C4',H4',no,N,18,,88472,18529,GDP
19,,SING,O4',C1',no,N,19,,88472,18529,GDP
20,,SING,C3',O3',no,N,20,,88472,18529,GDP
21,,SING,C3',C2',no,N,21,,88472,18529,GDP
22,,SING,C3',H3',no,N,22,,88472,18529,GDP
23,,SING,O3',HO3',no,N,23,,88472,18529,GDP
24,,SING,C2',O2',no,N,24,,88472,18529,GDP
25,,SING,C2',C1',no,N,25,,88472,18529,GDP
26,,SING,C2',H2',no,N,26,,88472,18529,GDP
27,,SING,O2',HO2',no,N,27,,88472,18529,GDP
28,,SING,C1',N9,no,N,28,,88472,18529,GDP
29,,SING,C1',H1',no,N,29,,88472,18529,GDP
30,,SING,N9,C8,yes,N,30,,88472,18529,GDP
31,,SING,N9,C4,yes,N,31,,88472,18529,GDP
32,,DOUB,C8,N7,yes,N,32,,88472,18529,GDP
33,,SING,C8,H8,no,N,33,,88472,18529,GDP
34,,SING,N7,C5,yes,N,34,,88472,18529,GDP
35,,SING,C5,C6,no,N,35,,88472,18529,GDP
36,,DOUB,C5,C4,yes,N,36,,88472,18529,GDP
37,,DOUB,C6,O6,no,N,37,,88472,18529,GDP
38,,SING,C6,N1,no,N,38,,88472,18529,GDP
39,,SING,N1,C2,no,N,39,,88472,18529,GDP
40,,SING,N1,HN1,no,N,40,,88472,18529,GDP
41,,SING,C2,N2,no,N,41,,88472,18529,GDP
42,,DOUB,C2,N3,no,N,42,,88472,18529,GDP
43,,SING,N2,HN21,no,N,43,,88472,18529,GDP
44,,SING,N2,HN22,no,N,44,,88472,18529,GDP
45,,SING,N3,C4,no,N,45,,88472,18529,GDP
1,,SING,N,HN1,no,N,1,,88623,18537,NH2
2,,SING,N,HN2,no,N,2,,88623,18537,NH2
1,,SING,N,HN1,no,N,1,,88638,18538,NH2
2,,SING,N,HN2,no,N,2,,88638,18538,NH2
1,,SING,N,CA,no,N,1,,89491,18579,MLY
2,,SING,N,H,no,N,2,,89491,18579,MLY
3,,SING,N,H2,no,N,3,,89491,18579,MLY
4,,SING,CA,CB,no,N,4,,89491,18579,MLY
5,,SING,CA,C,no,N,5,,89491,18579,MLY
6,,SING,CA,HA,no,N,6,,89491,18579,MLY
7,,SING,CB,CG,no,N,7,,89491,18579,MLY
8,,SING,CB,HB2,no,N,8,,89491,18579,MLY
9,,SING,CB,HB3,no,N,9,,89491,18579,MLY
10,,SING,CG,CD,no,N,10,,89491,18579,MLY
11,,SING,CG,HG2,no,N,11,,89491,18579,MLY
12,,SING,CG,HG3,no,N,12,,89491,18579,MLY
13,,SING,CD,CE,no,N,13,,89491,18579,MLY
14,,SING,CD,HD2,no,N,14,,89491,18579,MLY
15,,SING,CD,HD3,no,N,15,,89491,18579,MLY
16,,SING,CE,NZ,no,N,16,,89491,18579,MLY
17,,SING,CE,HE2,no,N,17,,89491,18579,MLY
18,,SING,CE,HE3,no,N,18,,89491,18579,MLY
19,,SING,NZ,CH1,no,N,19,,89491,18579,MLY
20,,SING,NZ,CH2,no,N,20,,89491,18579,MLY
21,,SING,CH1,HH11,no,N,21,,89491,18579,MLY
22,,SING,CH1,HH12,no,N,22,,89491,18579,MLY
23,,SING,CH1,HH13,no,N,23,,89491,18579,MLY
24,,SING,CH2,HH21,no,N,24,,89491,18579,MLY
25,,SING,CH2,HH22,no,N,25,,89491,18579,MLY
26,,SING,CH2,HH23,no,N,26,,89491,18579,MLY
27,,DOUB,C,O,no,N,27,,89491,18579,MLY
28,,SING,C,OXT,no,N,28,,89491,18579,MLY
29,,SING,OXT,HXT,no,N,29,,89491,18579,MLY
1,,SING,N,CA,no,N,1,,89745,18591,VAL
2,,SING,N,H,no,N,2,,89745,18591,VAL
3,,SING,N,H2,no,N,3,,89745,18591,VAL
4,,SING,CA,C,no,N,4,,89745,18591,VAL
5,,SING,CA,CB,no,N,5,,89745,18591,VAL
6,,SING,CA,HA,no,N,6,,89745,18591,VAL
7,,DOUB,C,O,no,N,7,,89745,18591,VAL
8,,SING,C,OXT,no,N,8,,89745,18591,VAL
9,,SING,CB,CG1,no,N,9,,89745,18591,VAL
10,,SING,CB,CG2,no,N,10,,89745,18591,VAL
11,,SING,CB,HB,no,N,11,,89745,18591,VAL
12,,SING,CG1,HG11,no,N,12,,89745,18591,VAL
13,,SING,CG1,HG12,no,N,13,,89745,18591,VAL
14,,SING,CG1,HG13,no,N,14,,89745,18591,VAL
15,,SING,CG2,HG21,no,N,15,,89745,18591,VAL
16,,SING,CG2,HG22,no,N,16,,89745,18591,VAL
17,,SING,CG2,HG23,no,N,17,,89745,18591,VAL
18,,SING,OXT,HXT,no,N,18,,89745,18591,VAL
1,,SING,P,OP3,no,N,1,,89789,18593,UPV
2,,SING,N1,C6,no,N,2,,89789,18593,UPV
3,,SING,N1,C1',no,N,3,,89789,18593,UPV
4,,SING,C2,N1,no,N,4,,89789,18593,UPV
5,,DOUB,O2,C2,no,N,5,,89789,18593,UPV
6,,SING,N3,C2,no,N,6,,89789,18593,UPV
7,,SING,N3,C4,no,N,7,,89789,18593,UPV
8,,SING,C4,C5,no,N,8,,89789,18593,UPV
9,,DOUB,O4,C4,no,N,9,,89789,18593,UPV
10,,SING,C5,H5,no,N,10,,89789,18593,UPV
11,,DOUB,C5,C6,no,N,11,,89789,18593,UPV
12,,SING,C6,H6,no,N,12,,89789,18593,UPV
13,,SING,CA,HAA,no,N,13,,89789,18593,UPV
14,,SING,CA,O2',no,N,14,,89789,18593,UPV
15,,SING,CB,OB1,no,N,15,,89789,18593,UPV
16,,DOUB,CB,OB2,no,N,16,,89789,18593,UPV
17,,SING,CG,CB,no,N,17,,89789,18593,UPV
18,,SING,C1',O4',no,N,18,,89789,18593,UPV
19,,SING,C1',C2',no,N,19,,89789,18593,UPV
20,,SING,C2',O2',no,N,20,,89789,18593,UPV
21,,SING,C2',C3',no,N,21,,89789,18593,UPV
22,,SING,C3',O3',no,N,22,,89789,18593,UPV
23,,SING,O3',HO3',no,N,23,,89789,18593,UPV
24,,SING,C4',C3',no,N,24,,89789,18593,UPV
25,,SING,C4',C5',no,N,25,,89789,18593,UPV
26,,SING,C4',H4',no,N,26,,89789,18593,UPV
27,,SING,O4',C4',no,N,27,,89789,18593,UPV
28,,SING,C5',H5'A,no,N,28,,89789,18593,UPV
29,,SING,O5',P,no,N,29,,89789,18593,UPV
30,,SING,O5',C5',no,N,30,,89789,18593,UPV
31,,SING,OB1,CA,no,N,31,,89789,18593,UPV
32,,SING,CD1,CG,no,N,32,,89789,18593,UPV
33,,SING,CD1,HD1B,no,N,33,,89789,18593,UPV
34,,SING,CD1,HD1A,no,N,34,,89789,18593,UPV
35,,SING,CD2,CG,no,N,35,,89789,18593,UPV
36,,SING,CD2,HD2B,no,N,36,,89789,18593,UPV
37,,SING,CD2,HD2,no,N,37,,89789,18593,UPV
38,,SING,CD3,CG,no,N,38,,89789,18593,UPV
39,,SING,CD3,HD3,no,N,39,,89789,18593,UPV
40,,SING,CD3,HD3B,no,N,40,,89789,18593,UPV
41,,SING,OP3,HOP3,no,N,41,,89789,18593,UPV
42,,SING,OP2,P,no,N,42,,89789,18593,UPV
43,,SING,OP2,HOP2,no,N,43,,89789,18593,UPV
44,,SING,HN3,N3,no,N,44,,89789,18593,UPV
45,,SING,H5',C5',no,N,45,,89789,18593,UPV
46,,SING,H1',C1',no,N,46,,89789,18593,UPV
47,,SING,HD1,CD1,no,N,47,,89789,18593,UPV
48,,SING,H2',C2',no,N,48,,89789,18593,UPV
49,,SING,HD2A,CD2,no,N,49,,89789,18593,UPV
50,,SING,H3',C3',no,N,50,,89789,18593,UPV
51,,SING,HD3A,CD3,no,N,51,,89789,18593,UPV
52,,SING,HA,CA,no,N,52,,89789,18593,UPV
53,,DOUB,P,OP1,no,N,53,,89789,18593,UPV
1,,SING,C2,C1,no,N,1,,89828,18596,LVZ
2,,SING,C1,C3,no,N,2,,89828,18596,LVZ
3,,SING,C1,O2,no,N,3,,89828,18596,LVZ
4,,SING,C1,H1,no,N,4,,89828,18596,LVZ
5,,SING,H2A,C2,no,N,5,,89828,18596,LVZ
6,,SING,H2,C2,no,N,6,,89828,18596,LVZ
7,,SING,C2,H2B,no,N,7,,89828,18596,LVZ
8,,SING,O2,C19,no,N,8,,89828,18596,LVZ
9,,SING,H3B,C3,no,N,9,,89828,18596,LVZ
10,,SING,H3A,C3,no,N,10,,89828,18596,LVZ
11,,SING,C3,H3,no,N,11,,89828,18596,LVZ
12,,SING,HN9,N9,no,N,12,,89828,18596,LVZ
13,,SING,C29,N9,no,N,13,,89828,18596,LVZ
14,,SING,N9,S19,no,N,14,,89828,18596,LVZ
15,,SING,O59,C19,no,N,15,,89828,18596,LVZ
16,,SING,C19,H19,no,N,16,,89828,18596,LVZ
17,,SING,C19,C29,no,N,17,,89828,18596,LVZ
18,,DOUB,O2S,S19,no,N,18,,89828,18596,LVZ
19,,DOUB,S19,O3S,no,N,19,,89828,18596,LVZ
20,,SING,S19,O1S,no,N,20,,89828,18596,LVZ
21,,SING,O1S,HO1S,no,N,21,,89828,18596,LVZ
22,,SING,C39,C29,no,N,22,,89828,18596,LVZ
23,,SING,C29,H29,no,N,23,,89828,18596,LVZ
24,,DOUB,O4S,S29,no,N,24,,89828,18596,LVZ
25,,DOUB,O6S,S29,no,N,25,,89828,18596,LVZ
26,,SING,O69,S29,no,N,26,,89828,18596,LVZ
27,,SING,S29,O5S,no,N,27,,89828,18596,LVZ
28,,SING,C49,C39,no,N,28,,89828,18596,LVZ
29,,SING,H39,C39,no,N,29,,89828,18596,LVZ
30,,SING,C39,O39,no,N,30,,89828,18596,LVZ
31,,SING,HO39,O39,no,N,31,,89828,18596,LVZ
32,,SING,C59,C49,no,N,32,,89828,18596,LVZ
33,,SING,O49,C49,no,N,33,,89828,18596,LVZ
34,,SING,C49,H49,no,N,34,,89828,18596,LVZ
35,,SING,O49,HO49,no,N,35,,89828,18596,LVZ
36,,SING,C69,C59,no,N,36,,89828,18596,LVZ
37,,SING,H59,C59,no,N,37,,89828,18596,LVZ
38,,SING,C59,O59,no,N,38,,89828,18596,LVZ
39,,SING,O5S,HO5S,no,N,39,,89828,18596,LVZ
40,,SING,O69,C69,no,N,40,,89828,18596,LVZ
41,,SING,H69,C69,no,N,41,,89828,18596,LVZ
42,,SING,C69,H69A,no,N,42,,89828,18596,LVZ
1,,SING,C1,C2,no,N,1,,89829,18596,SGN
2,,SING,C1,O1,no,N,2,,89829,18596,SGN
3,,SING,C1,O5,no,N,3,,89829,18596,SGN
4,,SING,C1,H1,no,N,4,,89829,18596,SGN
5,,SING,C2,C3,no,N,5,,89829,18596,SGN
6,,SING,C2,N,no,N,6,,89829,18596,SGN
7,,SING,C2,H2,no,N,7,,89829,18596,SGN
8,,SING,C3,C4,no,N,8,,89829,18596,SGN
9,,SING,C3,O3,no,N,9,,89829,18596,SGN
10,,SING,C3,H3,no,N,10,,89829,18596,SGN
11,,SING,C4,C5,no,N,11,,89829,18596,SGN
12,,SING,C4,O4,no,N,12,,89829,18596,SGN
13,,SING,C4,H4,no,N,13,,89829,18596,SGN
14,,SING,C5,C6,no,N,14,,89829,18596,SGN
15,,SING,C5,O5,no,N,15,,89829,18596,SGN
16,,SING,C5,H5,no,N,16,,89829,18596,SGN
17,,SING,C6,O6,no,N,17,,89829,18596,SGN
18,,SING,C6,H61,no,N,18,,89829,18596,SGN
19,,SING,C6,H62,no,N,19,,89829,18596,SGN
20,,SING,N,S1,no,N,20,,89829,18596,SGN
21,,SING,N,HN,no,N,21,,89829,18596,SGN
22,,SING,O1,HO1,no,N,22,,89829,18596,SGN
23,,SING,O3,HO3,no,N,23,,89829,18596,SGN
24,,SING,O4,HO4,no,N,24,,89829,18596,SGN
25,,SING,O6,S2,no,N,25,,89829,18596,SGN
26,,DOUB,S1,O1S,no,N,26,,89829,18596,SGN
27,,DOUB,S1,O2S,no,N,27,,89829,18596,SGN
28,,SING,S1,O3S,no,N,28,,89829,18596,SGN
29,,SING,O3S,HOS3,no,N,29,,89829,18596,SGN
30,,DOUB,S2,O4S,no,N,30,,89829,18596,SGN
31,,DOUB,S2,O5S,no,N,31,,89829,18596,SGN
32,,SING,S2,O6S,no,N,32,,89829,18596,SGN
33,,SING,O6S,HOS6,no,N,33,,89829,18596,SGN
1,,SING,C1,C2,no,N,1,,89830,18596,IDS
2,,SING,C1,O1,no,N,2,,89830,18596,IDS
3,,SING,C1,O5,no,N,3,,89830,18596,IDS
4,,SING,C1,H1,no,N,4,,89830,18596,IDS
5,,SING,C2,C3,no,N,5,,89830,18596,IDS
6,,SING,C2,O2,no,N,6,,89830,18596,IDS
7,,SING,C2,H2,no,N,7,,89830,18596,IDS
8,,SING,C3,C4,no,N,8,,89830,18596,IDS
9,,SING,C3,O3,no,N,9,,89830,18596,IDS
10,,SING,C3,H3,no,N,10,,89830,18596,IDS
11,,SING,C4,C5,no,N,11,,89830,18596,IDS
12,,SING,C4,O4,no,N,12,,89830,18596,IDS
13,,SING,C4,H4,no,N,13,,89830,18596,IDS
14,,SING,C5,C6,no,N,14,,89830,18596,IDS
15,,SING,C5,O5,no,N,15,,89830,18596,IDS
16,,SING,C5,H5,no,N,16,,89830,18596,IDS
17,,DOUB,C6,O61,no,N,17,,89830,18596,IDS
18,,SING,C6,O62,no,N,18,,89830,18596,IDS
19,,SING,O1,HO1,no,N,19,,89830,18596,IDS
20,,SING,O2,S,no,N,20,,89830,18596,IDS
21,,SING,O3,HO3,no,N,21,,89830,18596,IDS
22,,SING,O4,HO4,no,N,22,,89830,18596,IDS
23,,SING,O62,HO6,no,N,23,,89830,18596,IDS
24,,DOUB,S,O1S,no,N,24,,89830,18596,IDS
25,,DOUB,S,O2S,no,N,25,,89830,18596,IDS
26,,SING,S,O3S,no,N,26,,89830,18596,IDS
27,,SING,O3S,HOS3,no,N,27,,89830,18596,IDS
1,,SING,C2,C3,no,N,1,,90018,18603,BGC
2,,SING,C2,C1,no,N,2,,90018,18603,BGC
3,,SING,C2,O2,no,N,3,,90018,18603,BGC
4,,SING,C2,H2,no,N,4,,90018,18603,BGC
5,,SING,C3,C4,no,N,5,,90018,18603,BGC
6,,SING,C3,O3,no,N,6,,90018,18603,BGC
7,,SING,C3,H3,no,N,7,,90018,18603,BGC
8,,SING,C4,C5,no,N,8,,90018,18603,BGC
9,,SING,C4,O4,no,N,9,,90018,18603,BGC
10,,SING,C4,H4,no,N,10,,90018,18603,BGC
11,,SING,C5,C6,no,N,11,,90018,18603,BGC
12,,SING,C5,O5,no,N,12,,90018,18603,BGC
13,,SING,C5,H5,no,N,13,,90018,18603,BGC
14,,SING,C6,O6,no,N,14,,90018,18603,BGC
15,,SING,C6,H6C1,no,N,15,,90018,18603,BGC
16,,SING,C6,H6C2,no,N,16,,90018,18603,BGC
17,,SING,C1,O1,no,N,17,,90018,18603,BGC
18,,SING,C1,O5,no,N,18,,90018,18603,BGC
19,,SING,C1,H1,no,N,19,,90018,18603,BGC
20,,SING,O1,HA,no,N,20,,90018,18603,BGC
21,,SING,O2,HB,no,N,21,,90018,18603,BGC
22,,SING,O3,HC,no,N,22,,90018,18603,BGC
23,,SING,O4,HD,no,N,23,,90018,18603,BGC
24,,SING,O6,H6,no,N,24,,90018,18603,BGC
1,,SING,C2,C3,no,N,1,,90144,18609,BGC
2,,SING,C2,C1,no,N,2,,90144,18609,BGC
3,,SING,C2,O2,no,N,3,,90144,18609,BGC
4,,SING,C2,H2,no,N,4,,90144,18609,BGC
5,,SING,C3,C4,no,N,5,,90144,18609,BGC
6,,SING,C3,O3,no,N,6,,90144,18609,BGC
7,,SING,C3,H3,no,N,7,,90144,18609,BGC
8,,SING,C4,C5,no,N,8,,90144,18609,BGC
9,,SING,C4,O4,no,N,9,,90144,18609,BGC
10,,SING,C4,H4,no,N,10,,90144,18609,BGC
11,,SING,C5,C6,no,N,11,,90144,18609,BGC
12,,SING,C5,O5,no,N,12,,90144,18609,BGC
13,,SING,C5,H5,no,N,13,,90144,18609,BGC
14,,SING,C6,O6,no,N,14,,90144,18609,BGC
15,,SING,C6,H6C1,no,N,15,,90144,18609,BGC
27,,SING,C3',H3',,,,,216223,5054,ATP
16,,SING,C6,H6C2,no,N,16,,90144,18609,BGC
17,,SING,C1,O1,no,N,17,,90144,18609,BGC
18,,SING,C1,O5,no,N,18,,90144,18609,BGC
19,,SING,C1,H1,no,N,19,,90144,18609,BGC
20,,SING,O1,HA,no,N,20,,90144,18609,BGC
21,,SING,O2,HB,no,N,21,,90144,18609,BGC
22,,SING,O3,HC,no,N,22,,90144,18609,BGC
23,,SING,O4,HD,no,N,23,,90144,18609,BGC
24,,SING,O6,H6,no,N,24,,90144,18609,BGC
1,,DOUB,C1,N1,no,N,1,,90455,18626,NT
2,,SING,C1,N2,no,N,2,,90455,18626,NT
3,,SING,C1,N3,no,N,3,,90455,18626,NT
4,,SING,N1,HN1,no,N,4,,90455,18626,NT
5,,SING,N2,HN21,no,N,5,,90455,18626,NT
6,,SING,N2,HN22,no,N,6,,90455,18626,NT
7,,SING,N3,C2,no,N,7,,90455,18626,NT
8,,SING,N3,HN3,no,N,8,,90455,18626,NT
9,,SING,C2,C3,no,N,9,,90455,18626,NT
10,,SING,C2,H21,no,N,10,,90455,18626,NT
11,,SING,C2,H22,no,N,11,,90455,18626,NT
12,,DOUB,C3,O1,no,N,12,,90455,18626,NT
13,,SING,C3,N4,no,N,13,,90455,18626,NT
14,,SING,N4,C4,no,N,14,,90455,18626,NT
15,,SING,N4,HN4,no,N,15,,90455,18626,NT
16,,SING,C4,C5,yes,N,16,,90455,18626,NT
17,,DOUB,C4,C7,yes,N,17,,90455,18626,NT
18,,DOUB,C5,C6,yes,N,18,,90455,18626,NT
19,,SING,C5,H5,no,N,19,,90455,18626,NT
20,,SING,C6,N5,yes,N,20,,90455,18626,NT
21,,SING,C6,C9,no,N,21,,90455,18626,NT
22,,SING,N5,C8,no,N,22,,90455,18626,NT
23,,SING,N5,C7,yes,N,23,,90455,18626,NT
24,,SING,C8,H81,no,N,24,,90455,18626,NT
25,,SING,C8,H82,no,N,25,,90455,18626,NT
26,,SING,C8,H83,no,N,26,,90455,18626,NT
27,,SING,C7,H7,no,N,27,,90455,18626,NT
28,,DOUB,C9,O2,no,N,28,,90455,18626,NT
29,,SING,C9,N6,no,N,29,,90455,18626,NT
30,,SING,N6,C10,no,N,30,,90455,18626,NT
31,,SING,N6,HN6,no,N,31,,90455,18626,NT
32,,SING,C10,C11,yes,N,32,,90455,18626,NT
33,,DOUB,C10,C13,yes,N,33,,90455,18626,NT
34,,DOUB,C11,C12,yes,N,34,,90455,18626,NT
35,,SING,C11,H11,no,N,35,,90455,18626,NT
36,,SING,C12,N7,yes,N,36,,90455,18626,NT
37,,SING,C12,C15,no,N,37,,90455,18626,NT
38,,SING,N7,C14,no,N,38,,90455,18626,NT
39,,SING,N7,C13,yes,N,39,,90455,18626,NT
40,,SING,C14,H141,no,N,40,,90455,18626,NT
41,,SING,C14,H142,no,N,41,,90455,18626,NT
42,,SING,C14,H143,no,N,42,,90455,18626,NT
43,,SING,C13,H13,no,N,43,,90455,18626,NT
44,,DOUB,C15,O3,no,N,44,,90455,18626,NT
45,,SING,C15,N8,no,N,45,,90455,18626,NT
46,,SING,N8,C16,no,N,46,,90455,18626,NT
47,,SING,N8,HN8,no,N,47,,90455,18626,NT
48,,SING,C16,C17,no,N,48,,90455,18626,NT
49,,SING,C16,H161,no,N,49,,90455,18626,NT
50,,SING,C16,H162,no,N,50,,90455,18626,NT
51,,SING,C17,C18,no,N,51,,90455,18626,NT
52,,SING,C17,H171,no,N,52,,90455,18626,NT
53,,SING,C17,H172,no,N,53,,90455,18626,NT
54,,DOUB,C18,N9,no,N,54,,90455,18626,NT
55,,SING,C18,N10,no,N,55,,90455,18626,NT
56,,SING,N9,HN9,no,N,56,,90455,18626,NT
57,,SING,N10,HN01,no,N,57,,90455,18626,NT
58,,SING,N10,HN02,no,N,58,,90455,18626,NT
1,,DOUB,PG,O1G,no,N,1,,90527,18629,GNP
2,,SING,PG,O2G,no,N,2,,90527,18629,GNP
3,,SING,PG,O3G,no,N,3,,90527,18629,GNP
4,,SING,PG,N3B,no,N,4,,90527,18629,GNP
5,,SING,O2G,HOG2,no,N,5,,90527,18629,GNP
6,,SING,O3G,HOG3,no,N,6,,90527,18629,GNP
7,,SING,N3B,PB,no,N,7,,90527,18629,GNP
8,,SING,N3B,HNB3,no,N,8,,90527,18629,GNP
9,,DOUB,PB,O1B,no,N,9,,90527,18629,GNP
10,,SING,PB,O2B,no,N,10,,90527,18629,GNP
11,,SING,PB,O3A,no,N,11,,90527,18629,GNP
12,,SING,O2B,HOB2,no,N,12,,90527,18629,GNP
13,,SING,O3A,PA,no,N,13,,90527,18629,GNP
14,,DOUB,PA,O1A,no,N,14,,90527,18629,GNP
15,,SING,PA,O2A,no,N,15,,90527,18629,GNP
16,,SING,PA,O5',no,N,16,,90527,18629,GNP
17,,SING,O2A,HOA2,no,N,17,,90527,18629,GNP
18,,SING,O5',C5',no,N,18,,90527,18629,GNP
19,,SING,C5',C4',no,N,19,,90527,18629,GNP
20,,SING,C5',H5'2,no,N,20,,90527,18629,GNP
21,,SING,C5',H5'1,no,N,21,,90527,18629,GNP
22,,SING,C4',O4',no,N,22,,90527,18629,GNP
23,,SING,C4',C3',no,N,23,,90527,18629,GNP
24,,SING,C4',H4',no,N,24,,90527,18629,GNP
25,,SING,O4',C1',no,N,25,,90527,18629,GNP
26,,SING,C3',O3',no,N,26,,90527,18629,GNP
27,,SING,C3',C2',no,N,27,,90527,18629,GNP
28,,SING,C3',H3',no,N,28,,90527,18629,GNP
29,,SING,O3',HO3',no,N,29,,90527,18629,GNP
30,,SING,C2',O2',no,N,30,,90527,18629,GNP
31,,SING,C2',C1',no,N,31,,90527,18629,GNP
32,,SING,C2',H2',no,N,32,,90527,18629,GNP
33,,SING,O2',HO2',no,N,33,,90527,18629,GNP
34,,SING,C1',N9,no,N,34,,90527,18629,GNP
35,,SING,C1',H1',no,N,35,,90527,18629,GNP
36,,SING,N9,C8,yes,N,36,,90527,18629,GNP
37,,SING,N9,C4,yes,N,37,,90527,18629,GNP
38,,DOUB,C8,N7,yes,N,38,,90527,18629,GNP
39,,SING,C8,H8,no,N,39,,90527,18629,GNP
40,,SING,N7,C5,yes,N,40,,90527,18629,GNP
41,,SING,C5,C6,yes,N,41,,90527,18629,GNP
42,,DOUB,C5,C4,yes,N,42,,90527,18629,GNP
43,,DOUB,C6,O6,no,N,43,,90527,18629,GNP
44,,SING,C6,N1,yes,N,44,,90527,18629,GNP
45,,SING,N1,C2,yes,N,45,,90527,18629,GNP
46,,SING,N1,HN1,no,N,46,,90527,18629,GNP
47,,SING,C2,N2,no,N,47,,90527,18629,GNP
48,,DOUB,C2,N3,yes,N,48,,90527,18629,GNP
49,,SING,N2,HN21,no,N,49,,90527,18629,GNP
50,,SING,N2,HN22,no,N,50,,90527,18629,GNP
51,,SING,N3,C4,yes,N,51,,90527,18629,GNP
1,,SING,O3B,N3,no,N,1,,90529,18629,KOB
2,,DOUB,O3A,N3,no,N,2,,90529,18629,KOB
3,,SING,N3,C3,no,N,3,,90529,18629,KOB
4,,DOUB,C3,C2,yes,N,4,,90529,18629,KOB
5,,SING,C3,C4,yes,N,5,,90529,18629,KOB
6,,SING,C2,C1,yes,N,6,,90529,18629,KOB
7,,DOUB,C4,C5,yes,N,7,,90529,18629,KOB
8,,DOUB,O1A,N1,no,N,8,,90529,18629,KOB
9,,SING,C1,N1,no,N,9,,90529,18629,KOB
10,,DOUB,C1,C6,yes,N,10,,90529,18629,KOB
11,,SING,C5,C6,yes,N,11,,90529,18629,KOB
12,,SING,N1,O1B,no,N,12,,90529,18629,KOB
13,,SING,C6,N6,no,N,13,,90529,18629,KOB
14,,DOUB,C13,C12,yes,N,14,,90529,18629,KOB
15,,SING,C13,C8,yes,N,15,,90529,18629,KOB
16,,SING,N6,N7,no,N,16,,90529,18629,KOB
17,,SING,C12,C11,yes,N,17,,90529,18629,KOB
18,,SING,N8,C8,no,N,18,,90529,18629,KOB
19,,SING,N8,C7,no,N,19,,90529,18629,KOB
20,,DOUB,C8,C9,yes,N,20,,90529,18629,KOB
21,,SING,N7,C7,no,N,21,,90529,18629,KOB
22,,SING,C11,F11,no,N,22,,90529,18629,KOB
23,,DOUB,C11,C10,yes,N,23,,90529,18629,KOB
24,,DOUB,C7,S7,no,N,24,,90529,18629,KOB
25,,SING,C9,C10,yes,N,25,,90529,18629,KOB
26,,SING,C12,HE2,no,N,26,,90529,18629,KOB
27,,SING,C10,HE1,no,N,27,,90529,18629,KOB
28,,SING,C13,HD2,no,N,28,,90529,18629,KOB
29,,SING,C9,HD1,no,N,29,,90529,18629,KOB
30,,SING,N8,HAD,no,N,30,,90529,18629,KOB
31,,SING,N7,HAC,no,N,31,,90529,18629,KOB
32,,SING,N6,HAB,no,N,32,,90529,18629,KOB
33,,SING,C5,H5,no,N,33,,90529,18629,KOB
34,,SING,C4,H4,no,N,34,,90529,18629,KOB
35,,SING,C2,H2,no,N,35,,90529,18629,KOB
1,,SING,O,H1,no,N,1,,90530,18629,HOH
2,,SING,O,H2,no,N,2,,90530,18629,HOH
1,,DOUB,C1,O1,no,N,1,,90583,18632,OLA
2,,SING,C1,O2,no,N,2,,90583,18632,OLA
3,,SING,C1,C2,no,N,3,,90583,18632,OLA
4,,SING,O2,HO2,no,N,4,,90583,18632,OLA
5,,SING,C2,C3,no,N,5,,90583,18632,OLA
6,,SING,C2,H21,no,N,6,,90583,18632,OLA
7,,SING,C2,H22,no,N,7,,90583,18632,OLA
8,,SING,C3,C4,no,N,8,,90583,18632,OLA
9,,SING,C3,H31,no,N,9,,90583,18632,OLA
10,,SING,C3,H32,no,N,10,,90583,18632,OLA
11,,SING,C4,C5,no,N,11,,90583,18632,OLA
12,,SING,C4,H41,no,N,12,,90583,18632,OLA
13,,SING,C4,H42,no,N,13,,90583,18632,OLA
14,,SING,C5,C6,no,N,14,,90583,18632,OLA
15,,SING,C5,H51,no,N,15,,90583,18632,OLA
16,,SING,C5,H52,no,N,16,,90583,18632,OLA
17,,SING,C6,C7,no,N,17,,90583,18632,OLA
18,,SING,C6,H61,no,N,18,,90583,18632,OLA
19,,SING,C6,H62,no,N,19,,90583,18632,OLA
20,,SING,C7,C8,no,N,20,,90583,18632,OLA
21,,SING,C7,H71,no,N,21,,90583,18632,OLA
22,,SING,C7,H72,no,N,22,,90583,18632,OLA
23,,SING,C8,C9,no,N,23,,90583,18632,OLA
24,,SING,C8,H81,no,N,24,,90583,18632,OLA
25,,SING,C8,H82,no,N,25,,90583,18632,OLA
26,,DOUB,C9,C10,no,Z,26,,90583,18632,OLA
27,,SING,C9,H9,no,N,27,,90583,18632,OLA
28,,SING,C10,C11,no,N,28,,90583,18632,OLA
29,,SING,C10,H10,no,N,29,,90583,18632,OLA
30,,SING,C11,C12,no,N,30,,90583,18632,OLA
31,,SING,C11,H111,no,N,31,,90583,18632,OLA
32,,SING,C11,H112,no,N,32,,90583,18632,OLA
33,,SING,C12,C13,no,N,33,,90583,18632,OLA
34,,SING,C12,H121,no,N,34,,90583,18632,OLA
35,,SING,C12,H122,no,N,35,,90583,18632,OLA
36,,SING,C13,C14,no,N,36,,90583,18632,OLA
37,,SING,C13,H131,no,N,37,,90583,18632,OLA
38,,SING,C13,H132,no,N,38,,90583,18632,OLA
39,,SING,C14,C15,no,N,39,,90583,18632,OLA
40,,SING,C14,H141,no,N,40,,90583,18632,OLA
41,,SING,C14,H142,no,N,41,,90583,18632,OLA
42,,SING,C15,C16,no,N,42,,90583,18632,OLA
43,,SING,C15,H151,no,N,43,,90583,18632,OLA
44,,SING,C15,H152,no,N,44,,90583,18632,OLA
45,,SING,C16,C17,no,N,45,,90583,18632,OLA
46,,SING,C16,H161,no,N,46,,90583,18632,OLA
47,,SING,C16,H162,no,N,47,,90583,18632,OLA
48,,SING,C17,C18,no,N,48,,90583,18632,OLA
49,,SING,C17,H171,no,N,49,,90583,18632,OLA
50,,SING,C17,H172,no,N,50,,90583,18632,OLA
51,,SING,C18,H181,no,N,51,,90583,18632,OLA
52,,SING,C18,H182,no,N,52,,90583,18632,OLA
53,,SING,C18,H183,no,N,53,,90583,18632,OLA
1,,DOUB,N6,C1,yes,N,1,,90620,18633,0EC
2,,SING,C1,N11,no,N,2,,90620,18633,0EC
3,,SING,C1,N2,yes,N,3,,90620,18633,0EC
4,,DOUB,C3,N2,yes,N,4,,90620,18633,0EC
5,,SING,C4,C3,yes,N,5,,90620,18633,0EC
6,,SING,C3,C7,yes,N,6,,90620,18633,0EC
7,,DOUB,C5,C4,yes,N,7,,90620,18633,0EC
8,,SING,C10,C4,yes,N,8,,90620,18633,0EC
9,,SING,N5,C5,no,N,9,,90620,18633,0EC
10,,SING,C5,N6,yes,N,10,,90620,18633,0EC
11,,SING,HN5A,N5,no,N,11,,90620,18633,0EC
12,,SING,N5,HN5,no,N,12,,90620,18633,0EC
13,,DOUB,C8,C7,yes,N,13,,90620,18633,0EC
14,,SING,C7,H7,no,N,14,,90620,18633,0EC
15,,SING,C9,C8,yes,N,15,,90620,18633,0EC
16,,SING,C8,O8,no,N,16,,90620,18633,0EC
17,,SING,C8A,O8,no,N,17,,90620,18633,0EC
18,,DOUB,C10,C9,yes,N,18,,90620,18633,0EC
19,,SING,O9,C9,no,N,19,,90620,18633,0EC
20,,SING,C9A,O9,no,N,20,,90620,18633,0EC
21,,SING,H10,C10,no,N,21,,90620,18633,0EC
22,,SING,C16,N11,no,N,22,,90620,18633,0EC
23,,SING,N11,C12,no,N,23,,90620,18633,0EC
24,,SING,C13,C12,no,N,24,,90620,18633,0EC
25,,SING,C12,H12,no,N,25,,90620,18633,0EC
26,,SING,C12,H12A,no,N,26,,90620,18633,0EC
27,,SING,N14,C13,no,N,27,,90620,18633,0EC
28,,SING,H13,C13,no,N,28,,90620,18633,0EC
29,,SING,C13,H13A,no,N,29,,90620,18633,0EC
30,,SING,C15,N14,no,N,30,,90620,18633,0EC
31,,SING,N14,HN14,no,N,31,,90620,18633,0EC
32,,SING,H15A,C15,no,N,32,,90620,18633,0EC
33,,SING,H15,C15,no,N,33,,90620,18633,0EC
34,,SING,C15,C16,no,N,34,,90620,18633,0EC
35,,SING,H16,C16,no,N,35,,90620,18633,0EC
36,,SING,C16,H16A,no,N,36,,90620,18633,0EC
37,,SING,H8A,C8A,no,N,37,,90620,18633,0EC
38,,SING,H8AB,C8A,no,N,38,,90620,18633,0EC
39,,SING,C8A,H8AA,no,N,39,,90620,18633,0EC
40,,SING,H9AB,C9A,no,N,40,,90620,18633,0EC
41,,SING,H9AA,C9A,no,N,41,,90620,18633,0EC
42,,SING,C9A,H9A,no,N,42,,90620,18633,0EC
1,,SING,P1,O5',no,N,1,,90722,18638,LWM
2,,DOUB,P1,OP1,no,N,2,,90722,18638,LWM
3,,SING,N1,HN1,no,N,3,,90722,18638,LWM
4,,SING,C1,N1,no,N,4,,90722,18638,LWM
5,,SING,C1,N2,no,N,5,,90722,18638,LWM
6,,SING,N2,H3',no,N,6,,90722,18638,LWM
7,,DOUB,N3,C1,no,N,7,,90722,18638,LWM
8,,SING,C2,N3,no,N,8,,90722,18638,LWM
9,,DOUB,C3,C2,no,N,9,,90722,18638,LWM
10,,SING,C3,C4,no,N,10,,90722,18638,LWM
11,,SING,C4,N1,no,N,11,,90722,18638,LWM
12,,DOUB,C4,O1,no,N,12,,90722,18638,LWM
13,,SING,N4,C3,no,N,13,,90722,18638,LWM
14,,SING,C5,N4,no,N,14,,90722,18638,LWM
15,,DOUB,C5,O2,no,N,15,,90722,18638,LWM
16,,SING,N5,C2,no,N,16,,90722,18638,LWM
17,,SING,C1',N5,no,N,17,,90722,18638,LWM
18,,SING,C1',H1',no,N,18,,90722,18638,LWM
19,,SING,OP3,P1,no,N,19,,90722,18638,LWM
20,,SING,OP3,HOP3,no,N,20,,90722,18638,LWM
21,,SING,C2',C1',no,N,21,,90722,18638,LWM
22,,SING,C2',H2',no,N,22,,90722,18638,LWM
23,,SING,OP2,P1,no,N,23,,90722,18638,LWM
24,,SING,OP2,HOP2,no,N,24,,90722,18638,LWM
25,,SING,C3',C2',no,N,25,,90722,18638,LWM
26,,SING,C3',C4',no,N,26,,90722,18638,LWM
27,,SING,C3',O3',no,N,27,,90722,18638,LWM
28,,SING,O3',HO3',no,N,28,,90722,18638,LWM
29,,SING,C4',H4',no,N,29,,90722,18638,LWM
30,,SING,C4',C6',no,N,30,,90722,18638,LWM
31,,SING,C5',C4',no,N,31,,90722,18638,LWM
32,,SING,C5',H5'',no,N,32,,90722,18638,LWM
33,,SING,O5',C5',no,N,33,,90722,18638,LWM
34,,SING,C6',C1',no,N,34,,90722,18638,LWM
35,,SING,C6',H6',no,N,35,,90722,18638,LWM
36,,SING,HN7,N4,no,N,36,,90722,18638,LWM
37,,SING,HN9,C5,no,N,37,,90722,18638,LWM
38,,SING,H5,N5,no,N,38,,90722,18638,LWM
39,,SING,H5',C5',no,N,39,,90722,18638,LWM
40,,SING,H2'',C2',no,N,40,,90722,18638,LWM
41,,SING,HN2A,N2,no,N,41,,90722,18638,LWM
42,,SING,H3,C3',no,N,42,,90722,18638,LWM
43,,SING,H6'',C6',no,N,43,,90722,18638,LWM
1,,SING,P1,O5',no,N,1,,90743,18639,LWM
2,,DOUB,P1,OP1,no,N,2,,90743,18639,LWM
3,,SING,N1,HN1,no,N,3,,90743,18639,LWM
4,,SING,C1,N1,no,N,4,,90743,18639,LWM
5,,SING,C1,N2,no,N,5,,90743,18639,LWM
6,,SING,N2,H3',no,N,6,,90743,18639,LWM
7,,DOUB,N3,C1,no,N,7,,90743,18639,LWM
8,,SING,C2,N3,no,N,8,,90743,18639,LWM
9,,DOUB,C3,C2,no,N,9,,90743,18639,LWM
10,,SING,C3,C4,no,N,10,,90743,18639,LWM
11,,SING,C4,N1,no,N,11,,90743,18639,LWM
12,,DOUB,C4,O1,no,N,12,,90743,18639,LWM
13,,SING,N4,C3,no,N,13,,90743,18639,LWM
14,,SING,C5,N4,no,N,14,,90743,18639,LWM
15,,DOUB,C5,O2,no,N,15,,90743,18639,LWM
16,,SING,N5,C2,no,N,16,,90743,18639,LWM
17,,SING,C1',N5,no,N,17,,90743,18639,LWM
18,,SING,C1',H1',no,N,18,,90743,18639,LWM
19,,SING,OP3,P1,no,N,19,,90743,18639,LWM
20,,SING,OP3,HOP3,no,N,20,,90743,18639,LWM
21,,SING,C2',C1',no,N,21,,90743,18639,LWM
22,,SING,C2',H2',no,N,22,,90743,18639,LWM
23,,SING,OP2,P1,no,N,23,,90743,18639,LWM
24,,SING,OP2,HOP2,no,N,24,,90743,18639,LWM
25,,SING,C3',C2',no,N,25,,90743,18639,LWM
26,,SING,C3',C4',no,N,26,,90743,18639,LWM
27,,SING,C3',O3',no,N,27,,90743,18639,LWM
28,,SING,O3',HO3',no,N,28,,90743,18639,LWM
29,,SING,C4',H4',no,N,29,,90743,18639,LWM
30,,SING,C4',C6',no,N,30,,90743,18639,LWM
31,,SING,C5',C4',no,N,31,,90743,18639,LWM
32,,SING,C5',H5'',no,N,32,,90743,18639,LWM
33,,SING,O5',C5',no,N,33,,90743,18639,LWM
34,,SING,C6',C1',no,N,34,,90743,18639,LWM
35,,SING,C6',H6',no,N,35,,90743,18639,LWM
36,,SING,HN7,N4,no,N,36,,90743,18639,LWM
37,,SING,HN9,C5,no,N,37,,90743,18639,LWM
38,,SING,H5,N5,no,N,38,,90743,18639,LWM
39,,SING,H5',C5',no,N,39,,90743,18639,LWM
40,,SING,H2'',C2',no,N,40,,90743,18639,LWM
41,,SING,HN2A,N2,no,N,41,,90743,18639,LWM
42,,SING,H3,C3',no,N,42,,90743,18639,LWM
43,,SING,H6'',C6',no,N,43,,90743,18639,LWM
1,,SING,P1,O5',no,N,1,,90764,18640,LWM
2,,DOUB,P1,OP1,no,N,2,,90764,18640,LWM
3,,SING,N1,HN1,no,N,3,,90764,18640,LWM
4,,SING,C1,N1,no,N,4,,90764,18640,LWM
5,,SING,C1,N2,no,N,5,,90764,18640,LWM
6,,SING,N2,H3',no,N,6,,90764,18640,LWM
7,,DOUB,N3,C1,no,N,7,,90764,18640,LWM
8,,SING,C2,N3,no,N,8,,90764,18640,LWM
9,,DOUB,C3,C2,no,N,9,,90764,18640,LWM
10,,SING,C3,C4,no,N,10,,90764,18640,LWM
11,,SING,C4,N1,no,N,11,,90764,18640,LWM
12,,DOUB,C4,O1,no,N,12,,90764,18640,LWM
13,,SING,N4,C3,no,N,13,,90764,18640,LWM
14,,SING,C5,N4,no,N,14,,90764,18640,LWM
15,,DOUB,C5,O2,no,N,15,,90764,18640,LWM
16,,SING,N5,C2,no,N,16,,90764,18640,LWM
17,,SING,C1',N5,no,N,17,,90764,18640,LWM
18,,SING,C1',H1',no,N,18,,90764,18640,LWM
19,,SING,OP3,P1,no,N,19,,90764,18640,LWM
20,,SING,OP3,HOP3,no,N,20,,90764,18640,LWM
21,,SING,C2',C1',no,N,21,,90764,18640,LWM
22,,SING,C2',H2',no,N,22,,90764,18640,LWM
23,,SING,OP2,P1,no,N,23,,90764,18640,LWM
24,,SING,OP2,HOP2,no,N,24,,90764,18640,LWM
25,,SING,C3',C2',no,N,25,,90764,18640,LWM
26,,SING,C3',C4',no,N,26,,90764,18640,LWM
27,,SING,C3',O3',no,N,27,,90764,18640,LWM
28,,SING,O3',HO3',no,N,28,,90764,18640,LWM
29,,SING,C4',H4',no,N,29,,90764,18640,LWM
30,,SING,C4',C6',no,N,30,,90764,18640,LWM
31,,SING,C5',C4',no,N,31,,90764,18640,LWM
32,,SING,C5',H5'',no,N,32,,90764,18640,LWM
33,,SING,O5',C5',no,N,33,,90764,18640,LWM
34,,SING,C6',C1',no,N,34,,90764,18640,LWM
35,,SING,C6',H6',no,N,35,,90764,18640,LWM
36,,SING,HN7,N4,no,N,36,,90764,18640,LWM
37,,SING,HN9,C5,no,N,37,,90764,18640,LWM
38,,SING,H5,N5,no,N,38,,90764,18640,LWM
39,,SING,H5',C5',no,N,39,,90764,18640,LWM
40,,SING,H2'',C2',no,N,40,,90764,18640,LWM
41,,SING,HN2A,N2,no,N,41,,90764,18640,LWM
42,,SING,H3,C3',no,N,42,,90764,18640,LWM
43,,SING,H6'',C6',no,N,43,,90764,18640,LWM
1,,SING,FE,NA,no,N,1,,91122,1866,HEC
2,,SING,FE,NB,no,N,2,,91122,1866,HEC
3,,SING,FE,NC,no,N,3,,91122,1866,HEC
4,,SING,FE,ND,no,N,4,,91122,1866,HEC
5,,DOUB,CHA,C1A,no,N,5,,91122,1866,HEC
6,,SING,CHA,C4D,no,N,6,,91122,1866,HEC
7,,SING,CHA,HHA,no,N,7,,91122,1866,HEC
8,,DOUB,CHB,C4A,no,N,8,,91122,1866,HEC
9,,SING,CHB,C1B,no,N,9,,91122,1866,HEC
10,,SING,CHB,HHB,no,N,10,,91122,1866,HEC
11,,DOUB,CHC,C4B,no,N,11,,91122,1866,HEC
12,,SING,CHC,C1C,no,N,12,,91122,1866,HEC
13,,SING,CHC,HHC,no,N,13,,91122,1866,HEC
14,,DOUB,CHD,C4C,no,N,14,,91122,1866,HEC
15,,SING,CHD,C1D,no,N,15,,91122,1866,HEC
16,,SING,CHD,HHD,no,N,16,,91122,1866,HEC
17,,SING,NA,C1A,yes,N,17,,91122,1866,HEC
18,,SING,NA,C4A,yes,N,18,,91122,1866,HEC
19,,SING,C1A,C2A,yes,N,19,,91122,1866,HEC
20,,DOUB,C2A,C3A,yes,N,20,,91122,1866,HEC
21,,SING,C2A,CAA,no,N,21,,91122,1866,HEC
22,,SING,C3A,C4A,yes,N,22,,91122,1866,HEC
23,,SING,C3A,CMA,no,N,23,,91122,1866,HEC
24,,SING,CMA,HMA1,no,N,24,,91122,1866,HEC
25,,SING,CMA,HMA2,no,N,25,,91122,1866,HEC
26,,SING,CMA,HMA3,no,N,26,,91122,1866,HEC
27,,SING,CAA,CBA,no,N,27,,91122,1866,HEC
28,,SING,CAA,HAA1,no,N,28,,91122,1866,HEC
29,,SING,CAA,HAA2,no,N,29,,91122,1866,HEC
30,,SING,CBA,CGA,no,N,30,,91122,1866,HEC
31,,SING,CBA,HBA1,no,N,31,,91122,1866,HEC
32,,SING,CBA,HBA2,no,N,32,,91122,1866,HEC
33,,DOUB,CGA,O1A,no,N,33,,91122,1866,HEC
34,,SING,CGA,O2A,no,N,34,,91122,1866,HEC
35,,SING,O2A,H2A,no,N,35,,91122,1866,HEC
36,,SING,NB,C1B,yes,N,36,,91122,1866,HEC
37,,SING,NB,C4B,yes,N,37,,91122,1866,HEC
38,,DOUB,C1B,C2B,yes,N,38,,91122,1866,HEC
39,,SING,C2B,C3B,yes,N,39,,91122,1866,HEC
40,,SING,C2B,CMB,no,N,40,,91122,1866,HEC
41,,SING,C3B,C4B,yes,N,41,,91122,1866,HEC
42,,DOUB,C3B,CAB,no,E,42,,91122,1866,HEC
43,,SING,CMB,HMB1,no,N,43,,91122,1866,HEC
44,,SING,CMB,HMB2,no,N,44,,91122,1866,HEC
45,,SING,CMB,HMB3,no,N,45,,91122,1866,HEC
46,,SING,CAB,CBB,no,N,46,,91122,1866,HEC
47,,SING,CAB,HAB,no,N,47,,91122,1866,HEC
48,,SING,CBB,HBB1,no,N,48,,91122,1866,HEC
49,,SING,CBB,HBB2,no,N,49,,91122,1866,HEC
50,,SING,CBB,HBB3,no,N,50,,91122,1866,HEC
51,,SING,NC,C1C,yes,N,51,,91122,1866,HEC
52,,SING,NC,C4C,yes,N,52,,91122,1866,HEC
53,,DOUB,C1C,C2C,yes,N,53,,91122,1866,HEC
54,,SING,C2C,C3C,yes,N,54,,91122,1866,HEC
55,,SING,C2C,CMC,no,N,55,,91122,1866,HEC
56,,SING,C3C,C4C,yes,N,56,,91122,1866,HEC
57,,DOUB,C3C,CAC,no,E,57,,91122,1866,HEC
58,,SING,CMC,HMC1,no,N,58,,91122,1866,HEC
59,,SING,CMC,HMC2,no,N,59,,91122,1866,HEC
60,,SING,CMC,HMC3,no,N,60,,91122,1866,HEC
61,,SING,CAC,CBC,no,N,61,,91122,1866,HEC
62,,SING,CAC,HAC,no,N,62,,91122,1866,HEC
63,,SING,CBC,HBC1,no,N,63,,91122,1866,HEC
64,,SING,CBC,HBC2,no,N,64,,91122,1866,HEC
65,,SING,CBC,HBC3,no,N,65,,91122,1866,HEC
66,,SING,ND,C1D,yes,N,66,,91122,1866,HEC
67,,SING,ND,C4D,yes,N,67,,91122,1866,HEC
68,,DOUB,C1D,C2D,yes,N,68,,91122,1866,HEC
69,,SING,C2D,C3D,yes,N,69,,91122,1866,HEC
70,,SING,C2D,CMD,no,N,70,,91122,1866,HEC
71,,DOUB,C3D,C4D,yes,N,71,,91122,1866,HEC
72,,SING,C3D,CAD,no,N,72,,91122,1866,HEC
73,,SING,CMD,HMD1,no,N,73,,91122,1866,HEC
74,,SING,CMD,HMD2,no,N,74,,91122,1866,HEC
75,,SING,CMD,HMD3,no,N,75,,91122,1866,HEC
76,,SING,CAD,CBD,no,N,76,,91122,1866,HEC
77,,SING,CAD,HAD1,no,N,77,,91122,1866,HEC
78,,SING,CAD,HAD2,no,N,78,,91122,1866,HEC
79,,SING,CBD,CGD,no,N,79,,91122,1866,HEC
80,,SING,CBD,HBD1,no,N,80,,91122,1866,HEC
81,,SING,CBD,HBD2,no,N,81,,91122,1866,HEC
82,,DOUB,CGD,O1D,no,N,82,,91122,1866,HEC
83,,SING,CGD,O2D,no,N,83,,91122,1866,HEC
84,,SING,O2D,H2D,no,N,84,,91122,1866,HEC
1,,DOUB,O4,C4,no,N,1,,91236,18666,DUP
2,,SING,C4,C5,yes,N,2,,91236,18666,DUP
3,,SING,C4,N3,yes,N,3,,91236,18666,DUP
4,,DOUB,C5,C6,yes,N,4,,91236,18666,DUP
5,,SING,C5,H5,no,N,5,,91236,18666,DUP
6,,SING,C6,N1,yes,N,6,,91236,18666,DUP
7,,SING,C6,H6,no,N,7,,91236,18666,DUP
8,,SING,N3,C2,yes,N,8,,91236,18666,DUP
9,,SING,N3,HN3,no,N,9,,91236,18666,DUP
10,,DOUB,C2,O2,no,N,10,,91236,18666,DUP
11,,SING,C2,N1,yes,N,11,,91236,18666,DUP
12,,SING,N1,C1',no,N,12,,91236,18666,DUP
13,,SING,C1',C2',no,N,13,,91236,18666,DUP
14,,SING,C1',O4',no,N,14,,91236,18666,DUP
15,,SING,C1',H1',no,N,15,,91236,18666,DUP
16,,SING,C2',C3',no,N,16,,91236,18666,DUP
17,,SING,C2',H2'1,no,N,17,,91236,18666,DUP
18,,SING,C2',H2'2,no,N,18,,91236,18666,DUP
19,,SING,C3',O3',no,N,19,,91236,18666,DUP
20,,SING,C3',C4',no,N,20,,91236,18666,DUP
21,,SING,C3',H1,no,N,21,,91236,18666,DUP
22,,SING,O3',H3',no,N,22,,91236,18666,DUP
23,,SING,O4',C4',no,N,23,,91236,18666,DUP
24,,SING,C4',C5',no,N,24,,91236,18666,DUP
25,,SING,C4',H4',no,N,25,,91236,18666,DUP
26,,SING,C5',O5',no,N,26,,91236,18666,DUP
27,,SING,C5',H5'1,no,N,27,,91236,18666,DUP
28,,SING,C5',H5'2,no,N,28,,91236,18666,DUP
29,,SING,O5',PA,no,N,29,,91236,18666,DUP
30,,DOUB,PA,O1A,no,N,30,,91236,18666,DUP
31,,SING,PA,O2A,no,N,31,,91236,18666,DUP
32,,SING,PA,N3A,no,N,32,,91236,18666,DUP
33,,SING,O2A,H2A,no,N,33,,91236,18666,DUP
34,,SING,N3A,PB,no,N,34,,91236,18666,DUP
35,,SING,N3A,H3A,no,N,35,,91236,18666,DUP
36,,DOUB,PB,O1B,no,N,36,,91236,18666,DUP
37,,SING,PB,O2B,no,N,37,,91236,18666,DUP
38,,SING,PB,O3B,no,N,38,,91236,18666,DUP
39,,SING,O2B,H2B,no,N,39,,91236,18666,DUP
40,,SING,O3B,PG,no,N,40,,91236,18666,DUP
41,,DOUB,PG,O2G,no,N,41,,91236,18666,DUP
42,,SING,PG,O1G,no,N,42,,91236,18666,DUP
43,,SING,PG,O3G,no,N,43,,91236,18666,DUP
44,,SING,O1G,H1G,no,N,44,,91236,18666,DUP
45,,SING,O3G,H3G,no,N,45,,91236,18666,DUP
1,,DOUB,PA,O1A,no,N,1,,91256,18667,M7G
2,,SING,PA,O2A,no,N,2,,91256,18667,M7G
3,,SING,PA,O3A,no,N,3,,91256,18667,M7G
4,,SING,PA,O5',no,N,4,,91256,18667,M7G
5,,SING,O2A,HOA2,no,N,5,,91256,18667,M7G
6,,SING,O3A,PB,no,N,6,,91256,18667,M7G
7,,SING,O5',C5',no,N,7,,91256,18667,M7G
8,,DOUB,PB,O1B,no,N,8,,91256,18667,M7G
9,,SING,PB,O2B,no,N,9,,91256,18667,M7G
10,,SING,PB,O3B,no,N,10,,91256,18667,M7G
11,,SING,O2B,HOB2,no,N,11,,91256,18667,M7G
12,,SING,O3B,HOB3,no,N,12,,91256,18667,M7G
13,,SING,C5',C4',no,N,13,,91256,18667,M7G
14,,SING,C5',H5'1,no,N,14,,91256,18667,M7G
15,,SING,C5',H5'2,no,N,15,,91256,18667,M7G
16,,SING,C4',O4',no,N,16,,91256,18667,M7G
17,,SING,C4',C3',no,N,17,,91256,18667,M7G
18,,SING,C4',H4',no,N,18,,91256,18667,M7G
19,,SING,O4',C1',no,N,19,,91256,18667,M7G
20,,SING,C3',O3',no,N,20,,91256,18667,M7G
21,,SING,C3',C2',no,N,21,,91256,18667,M7G
22,,SING,C3',H3',no,N,22,,91256,18667,M7G
23,,SING,O3',HO3',no,N,23,,91256,18667,M7G
24,,SING,C2',O2',no,N,24,,91256,18667,M7G
25,,SING,C2',C1',no,N,25,,91256,18667,M7G
26,,SING,C2',H2',no,N,26,,91256,18667,M7G
27,,SING,O2',HO2',no,N,27,,91256,18667,M7G
28,,SING,C1',N9,no,N,28,,91256,18667,M7G
29,,SING,C1',H1',no,N,29,,91256,18667,M7G
30,,SING,N9,C8,no,N,30,,91256,18667,M7G
31,,SING,N9,C4,no,N,31,,91256,18667,M7G
32,,SING,C8,N7,no,N,32,,91256,18667,M7G
33,,SING,C8,H81,no,N,33,,91256,18667,M7G
34,,SING,C8,H82,no,N,34,,91256,18667,M7G
35,,SING,N7,CM7,no,N,35,,91256,18667,M7G
36,,SING,N7,C5,no,N,36,,91256,18667,M7G
37,,SING,CM7,HM71,no,N,37,,91256,18667,M7G
38,,SING,CM7,HM72,no,N,38,,91256,18667,M7G
39,,SING,CM7,HM73,no,N,39,,91256,18667,M7G
40,,SING,C5,C6,no,N,40,,91256,18667,M7G
41,,DOUB,C5,C4,no,N,41,,91256,18667,M7G
42,,DOUB,C6,O6,no,N,42,,91256,18667,M7G
43,,SING,C6,N1,no,N,43,,91256,18667,M7G
44,,SING,N1,C2,no,N,44,,91256,18667,M7G
45,,SING,N1,HN1,no,N,45,,91256,18667,M7G
46,,SING,C2,N2,no,N,46,,91256,18667,M7G
47,,DOUB,C2,N3,no,N,47,,91256,18667,M7G
48,,SING,N2,HN21,no,N,48,,91256,18667,M7G
49,,SING,N2,HN22,no,N,49,,91256,18667,M7G
50,,SING,N3,C4,no,N,50,,91256,18667,M7G
1,,DOUB,PA,O1A,no,N,1,,91570,18685,AP5
2,,SING,PA,O2A,no,N,2,,91570,18685,AP5
3,,SING,PA,O3A,no,N,3,,91570,18685,AP5
4,,SING,PA,O5F,no,N,4,,91570,18685,AP5
5,,SING,O2A,HOA2,no,N,5,,91570,18685,AP5
6,,SING,O3A,PB,no,N,6,,91570,18685,AP5
7,,DOUB,PB,O1B,no,N,7,,91570,18685,AP5
8,,SING,PB,O2B,no,N,8,,91570,18685,AP5
9,,SING,PB,O3B,no,N,9,,91570,18685,AP5
10,,SING,O2B,HOB2,no,N,10,,91570,18685,AP5
11,,SING,O3B,PG,no,N,11,,91570,18685,AP5
12,,DOUB,PG,O1G,no,N,12,,91570,18685,AP5
13,,SING,PG,O2G,no,N,13,,91570,18685,AP5
14,,SING,PG,O3G,no,N,14,,91570,18685,AP5
15,,SING,O2G,HOG2,no,N,15,,91570,18685,AP5
16,,SING,O3G,PD,no,N,16,,91570,18685,AP5
17,,DOUB,PD,O1D,no,N,17,,91570,18685,AP5
18,,SING,PD,O2D,no,N,18,,91570,18685,AP5
19,,SING,PD,O3D,no,N,19,,91570,18685,AP5
20,,SING,O2D,HOD2,no,N,20,,91570,18685,AP5
21,,SING,O3D,PE,no,N,21,,91570,18685,AP5
22,,DOUB,PE,O1E,no,N,22,,91570,18685,AP5
23,,SING,PE,O2E,no,N,23,,91570,18685,AP5
24,,SING,PE,O5J,no,N,24,,91570,18685,AP5
25,,SING,O2E,HOE2,no,N,25,,91570,18685,AP5
26,,SING,O5F,C5F,no,N,26,,91570,18685,AP5
27,,SING,C5F,C4F,no,N,27,,91570,18685,AP5
28,,SING,C5F,H51A,no,N,28,,91570,18685,AP5
29,,SING,C5F,H52A,no,N,29,,91570,18685,AP5
30,,SING,C4F,O4F,no,N,30,,91570,18685,AP5
31,,SING,C4F,C3F,no,N,31,,91570,18685,AP5
32,,SING,C4F,H4F,no,N,32,,91570,18685,AP5
33,,SING,O4F,C1F,no,N,33,,91570,18685,AP5
34,,SING,C3F,O3F,no,N,34,,91570,18685,AP5
35,,SING,C3F,C2F,no,N,35,,91570,18685,AP5
36,,SING,C3F,H3F,no,N,36,,91570,18685,AP5
37,,SING,O3F,HO3A,no,N,37,,91570,18685,AP5
38,,SING,C2F,O2F,no,N,38,,91570,18685,AP5
39,,SING,C2F,C1F,no,N,39,,91570,18685,AP5
40,,SING,C2F,H2F,no,N,40,,91570,18685,AP5
41,,SING,O2F,HO2A,no,N,41,,91570,18685,AP5
42,,SING,C1F,N9A,no,N,42,,91570,18685,AP5
43,,SING,C1F,H1F,no,N,43,,91570,18685,AP5
44,,SING,N9A,C8A,yes,N,44,,91570,18685,AP5
45,,SING,N9A,C4A,yes,N,45,,91570,18685,AP5
46,,DOUB,C8A,N7A,yes,N,46,,91570,18685,AP5
47,,SING,C8A,H8A,no,N,47,,91570,18685,AP5
48,,SING,N7A,C5A,yes,N,48,,91570,18685,AP5
49,,SING,C5A,C6A,yes,N,49,,91570,18685,AP5
50,,DOUB,C5A,C4A,yes,N,50,,91570,18685,AP5
51,,SING,C6A,N6A,no,N,51,,91570,18685,AP5
52,,DOUB,C6A,N1A,yes,N,52,,91570,18685,AP5
53,,SING,N6A,H61A,no,N,53,,91570,18685,AP5
54,,SING,N6A,H62A,no,N,54,,91570,18685,AP5
55,,SING,N1A,C2A,yes,N,55,,91570,18685,AP5
56,,DOUB,C2A,N3A,yes,N,56,,91570,18685,AP5
57,,SING,C2A,H2A,no,N,57,,91570,18685,AP5
58,,SING,N3A,C4A,yes,N,58,,91570,18685,AP5
59,,SING,O5J,C5J,no,N,59,,91570,18685,AP5
60,,SING,C5J,C4J,no,N,60,,91570,18685,AP5
61,,SING,C5J,H51B,no,N,61,,91570,18685,AP5
62,,SING,C5J,H52B,no,N,62,,91570,18685,AP5
63,,SING,C4J,O4J,no,N,63,,91570,18685,AP5
64,,SING,C4J,C3J,no,N,64,,91570,18685,AP5
65,,SING,C4J,H4J,no,N,65,,91570,18685,AP5
66,,SING,O4J,C1J,no,N,66,,91570,18685,AP5
67,,SING,C3J,O3J,no,N,67,,91570,18685,AP5
68,,SING,C3J,C2J,no,N,68,,91570,18685,AP5
69,,SING,C3J,H3J,no,N,69,,91570,18685,AP5
70,,SING,O3J,HO3B,no,N,70,,91570,18685,AP5
71,,SING,C2J,O2J,no,N,71,,91570,18685,AP5
72,,SING,C2J,C1J,no,N,72,,91570,18685,AP5
73,,SING,C2J,H2J,no,N,73,,91570,18685,AP5
74,,SING,O2J,HO2B,no,N,74,,91570,18685,AP5
75,,SING,C1J,N9B,no,N,75,,91570,18685,AP5
76,,SING,C1J,H1J,no,N,76,,91570,18685,AP5
77,,SING,N9B,C8B,yes,N,77,,91570,18685,AP5
78,,SING,N9B,C4B,yes,N,78,,91570,18685,AP5
79,,DOUB,C8B,N7B,yes,N,79,,91570,18685,AP5
80,,SING,C8B,H8B,no,N,80,,91570,18685,AP5
81,,SING,N7B,C5B,yes,N,81,,91570,18685,AP5
82,,SING,C5B,C6B,yes,N,82,,91570,18685,AP5
83,,DOUB,C5B,C4B,yes,N,83,,91570,18685,AP5
84,,SING,C6B,N6B,no,N,84,,91570,18685,AP5
85,,DOUB,C6B,N1B,yes,N,85,,91570,18685,AP5
86,,SING,N6B,H61B,no,N,86,,91570,18685,AP5
87,,SING,N6B,H62B,no,N,87,,91570,18685,AP5
88,,SING,N1B,C2B,yes,N,88,,91570,18685,AP5
89,,DOUB,C2B,N3B,yes,N,89,,91570,18685,AP5
90,,SING,C2B,H2B,no,N,90,,91570,18685,AP5
91,,SING,N3B,C4B,yes,N,91,,91570,18685,AP5
1,,SING,N,CA,no,N,1,,91753,18695,SEP
2,,SING,N,H,no,N,2,,91753,18695,SEP
3,,SING,N,H2,no,N,3,,91753,18695,SEP
4,,SING,CA,CB,no,N,4,,91753,18695,SEP
5,,SING,CA,C,no,N,5,,91753,18695,SEP
6,,SING,CA,HA,no,N,6,,91753,18695,SEP
7,,SING,CB,OG,no,N,7,,91753,18695,SEP
8,,SING,CB,HB2,no,N,8,,91753,18695,SEP
9,,SING,CB,HB3,no,N,9,,91753,18695,SEP
10,,SING,OG,P,no,N,10,,91753,18695,SEP
11,,DOUB,C,O,no,N,11,,91753,18695,SEP
12,,SING,C,OXT,no,N,12,,91753,18695,SEP
13,,SING,OXT,HXT,no,N,13,,91753,18695,SEP
14,,DOUB,P,O1P,no,N,14,,91753,18695,SEP
15,,SING,P,O2P,no,N,15,,91753,18695,SEP
16,,SING,P,O3P,no,N,16,,91753,18695,SEP
17,,SING,O2P,HOP2,no,N,17,,91753,18695,SEP
18,,SING,O3P,HOP3,no,N,18,,91753,18695,SEP
1,,DOUB,C6,C1,yes,N,1,,91943,18703,HTS
2,,SING,C6,C5,yes,N,2,,91943,18703,HTS
3,,SING,C6,H6,no,N,3,,91943,18703,HTS
4,,SING,C1,C2,yes,N,4,,91943,18703,HTS
5,,SING,C1,O1,no,N,5,,91943,18703,HTS
6,,DOUB,C2,C3,yes,N,6,,91943,18703,HTS
7,,SING,C2,S1,no,N,7,,91943,18703,HTS
8,,SING,C3,C4,yes,N,8,,91943,18703,HTS
9,,SING,C3,H3,no,N,9,,91943,18703,HTS
10,,DOUB,C4,C5,yes,N,10,,91943,18703,HTS
11,,SING,C4,H4,no,N,11,,91943,18703,HTS
12,,SING,C5,H5,no,N,12,,91943,18703,HTS
13,,SING,O1,HO1,no,N,13,,91943,18703,HTS
14,,SING,S1,HS1,no,N,14,,91943,18703,HTS
1,,SING,O,N1,yes,N,1,,91998,18706,A2Y
2,,SING,O,C11,yes,N,2,,91998,18706,A2Y
3,,SING,S,C1,yes,N,3,,91998,18706,A2Y
4,,SING,S,C12,yes,N,4,,91998,18706,A2Y
5,,DOUB,C1,C2,yes,N,5,,91998,18706,A2Y
6,,SING,C1,H1,no,N,6,,91998,18706,A2Y
7,,DOUB,N1,C9,yes,N,7,,91998,18706,A2Y
8,,SING,C2,C3,yes,N,8,,91998,18706,A2Y
9,,SING,C2,H2,no,N,9,,91998,18706,A2Y
10,,SING,N2,C5,no,N,10,,91998,18706,A2Y
11,,SING,N2,C10,no,N,11,,91998,18706,A2Y
12,,SING,N2,H1N2,no,N,12,,91998,18706,A2Y
13,,SING,N2,H2N2,no,N,13,,91998,18706,A2Y
14,,DOUB,C3,C12,yes,N,14,,91998,18706,A2Y
15,,SING,C3,H3,no,N,15,,91998,18706,A2Y
16,,SING,C4,C9,yes,N,16,,91998,18706,A2Y
17,,DOUB,C4,C11,yes,N,17,,91998,18706,A2Y
18,,SING,C4,H44,no,N,18,,91998,18706,A2Y
19,,SING,C5,C9,no,N,19,,91998,18706,A2Y
20,,SING,C5,H15,no,N,20,,91998,18706,A2Y
21,,SING,C5,H25,no,N,21,,91998,18706,A2Y
22,,SING,C10,C61,no,N,22,,91998,18706,A2Y
23,,SING,C10,C62,no,N,23,,91998,18706,A2Y
24,,SING,C10,C63,no,N,24,,91998,18706,A2Y
25,,SING,C11,C12,no,N,25,,91998,18706,A2Y
26,,SING,C61,C71,no,N,26,,91998,18706,A2Y
27,,SING,C61,H161,no,N,27,,91998,18706,A2Y
28,,SING,C61,H261,no,N,28,,91998,18706,A2Y
29,,SING,C62,C72,no,N,29,,91998,18706,A2Y
30,,SING,C62,H362,no,N,30,,91998,18706,A2Y
31,,SING,C62,H462,no,N,31,,91998,18706,A2Y
32,,SING,C63,C73,no,N,32,,91998,18706,A2Y
33,,SING,C63,H563,no,N,33,,91998,18706,A2Y
34,,SING,C63,H663,no,N,34,,91998,18706,A2Y
35,,SING,C71,C81,no,N,35,,91998,18706,A2Y
36,,SING,C71,C83,no,N,36,,91998,18706,A2Y
37,,SING,C71,H171,no,N,37,,91998,18706,A2Y
38,,SING,C72,C81,no,N,38,,91998,18706,A2Y
39,,SING,C72,C82,no,N,39,,91998,18706,A2Y
40,,SING,C72,H272,no,N,40,,91998,18706,A2Y
41,,SING,C73,C82,no,N,41,,91998,18706,A2Y
42,,SING,C73,C83,no,N,42,,91998,18706,A2Y
43,,SING,C73,H373,no,N,43,,91998,18706,A2Y
44,,SING,C81,H181,no,N,44,,91998,18706,A2Y
45,,SING,C81,H281,no,N,45,,91998,18706,A2Y
46,,SING,C82,H382,no,N,46,,91998,18706,A2Y
47,,SING,C82,H482,no,N,47,,91998,18706,A2Y
48,,SING,C83,H583,no,N,48,,91998,18706,A2Y
49,,SING,C83,H683,no,N,49,,91998,18706,A2Y
1,,SING,O1,P1,no,N,1,,92197,18715,PC8
2,,SING,O1,H1P,no,N,2,,92197,18715,PC8
3,,DOUB,O2,P1,no,N,3,,92197,18715,PC8
4,,SING,P1,O3,no,N,4,,92197,18715,PC8
5,,SING,P1,O4,no,N,5,,92197,18715,PC8
6,,SING,O3,C1,no,N,6,,92197,18715,PC8
7,,SING,C1,C2,no,N,7,,92197,18715,PC8
8,,SING,C1,H1,no,N,8,,92197,18715,PC8
9,,SING,C1,H2,no,N,9,,92197,18715,PC8
10,,SING,C2,N1,no,N,10,,92197,18715,PC8
11,,SING,C2,H3,no,N,11,,92197,18715,PC8
12,,SING,C2,H4,no,N,12,,92197,18715,PC8
13,,SING,N1,C3,no,N,13,,92197,18715,PC8
14,,SING,N1,C4,no,N,14,,92197,18715,PC8
15,,SING,N1,C5,no,N,15,,92197,18715,PC8
16,,SING,C3,H5,no,N,16,,92197,18715,PC8
17,,SING,C3,H6,no,N,17,,92197,18715,PC8
18,,SING,C3,H7,no,N,18,,92197,18715,PC8
19,,SING,C4,H8,no,N,19,,92197,18715,PC8
20,,SING,C4,H9,no,N,20,,92197,18715,PC8
21,,SING,C4,H10,no,N,21,,92197,18715,PC8
22,,SING,C5,H11,no,N,22,,92197,18715,PC8
23,,SING,C5,H12,no,N,23,,92197,18715,PC8
24,,SING,C5,H13,no,N,24,,92197,18715,PC8
25,,SING,O4,C6,no,N,25,,92197,18715,PC8
26,,SING,C6,C7,no,N,26,,92197,18715,PC8
27,,SING,C6,H14,no,N,27,,92197,18715,PC8
28,,SING,C6,H15,no,N,28,,92197,18715,PC8
29,,SING,C7,C8,no,N,29,,92197,18715,PC8
30,,SING,C7,O7,no,N,30,,92197,18715,PC8
31,,SING,C7,H16,no,N,31,,92197,18715,PC8
32,,SING,C8,O5,no,N,32,,92197,18715,PC8
33,,SING,C8,H17,no,N,33,,92197,18715,PC8
34,,SING,C8,H18,no,N,34,,92197,18715,PC8
35,,SING,O5,C9,no,N,35,,92197,18715,PC8
36,,DOUB,C9,O6,no,N,36,,92197,18715,PC8
37,,SING,C9,C10,no,N,37,,92197,18715,PC8
38,,SING,C10,C11,no,N,38,,92197,18715,PC8
39,,SING,C10,H19,no,N,39,,92197,18715,PC8
40,,SING,C10,H20,no,N,40,,92197,18715,PC8
41,,SING,C11,C12,no,N,41,,92197,18715,PC8
42,,SING,C11,H21,no,N,42,,92197,18715,PC8
43,,SING,C11,H22,no,N,43,,92197,18715,PC8
44,,SING,C12,C13,no,N,44,,92197,18715,PC8
45,,SING,C12,H23,no,N,45,,92197,18715,PC8
46,,SING,C12,H24,no,N,46,,92197,18715,PC8
47,,SING,C13,C14,no,N,47,,92197,18715,PC8
48,,SING,C13,H25,no,N,48,,92197,18715,PC8
49,,SING,C13,H26,no,N,49,,92197,18715,PC8
50,,SING,C14,C15,no,N,50,,92197,18715,PC8
51,,SING,C14,H27,no,N,51,,92197,18715,PC8
52,,SING,C14,H28,no,N,52,,92197,18715,PC8
53,,SING,C15,C16,no,N,53,,92197,18715,PC8
54,,SING,C15,H29,no,N,54,,92197,18715,PC8
55,,SING,C15,H30,no,N,55,,92197,18715,PC8
56,,SING,C16,H31,no,N,56,,92197,18715,PC8
57,,SING,C16,H32,no,N,57,,92197,18715,PC8
58,,SING,C16,H33,no,N,58,,92197,18715,PC8
59,,SING,O7,C17,no,N,59,,92197,18715,PC8
60,,DOUB,C17,O8,no,N,60,,92197,18715,PC8
61,,SING,C17,C18,no,N,61,,92197,18715,PC8
62,,SING,C18,C19,no,N,62,,92197,18715,PC8
63,,SING,C18,H34,no,N,63,,92197,18715,PC8
64,,SING,C18,H35,no,N,64,,92197,18715,PC8
65,,SING,C19,C20,no,N,65,,92197,18715,PC8
66,,SING,C19,H36,no,N,66,,92197,18715,PC8
67,,SING,C19,H37,no,N,67,,92197,18715,PC8
68,,SING,C20,C21,no,N,68,,92197,18715,PC8
69,,SING,C20,H38,no,N,69,,92197,18715,PC8
70,,SING,C20,H39,no,N,70,,92197,18715,PC8
71,,SING,C21,C22,no,N,71,,92197,18715,PC8
72,,SING,C21,H40,no,N,72,,92197,18715,PC8
73,,SING,C21,H41,no,N,73,,92197,18715,PC8
74,,SING,C22,C23,no,N,74,,92197,18715,PC8
75,,SING,C22,H42,no,N,75,,92197,18715,PC8
76,,SING,C22,H43,no,N,76,,92197,18715,PC8
77,,SING,C23,C24,no,N,77,,92197,18715,PC8
78,,SING,C23,H44,no,N,78,,92197,18715,PC8
79,,SING,C23,H45,no,N,79,,92197,18715,PC8
80,,SING,C24,H46,no,N,80,,92197,18715,PC8
81,,SING,C24,H47,no,N,81,,92197,18715,PC8
82,,SING,C24,H48,no,N,82,,92197,18715,PC8
1,,SING,N,C2C,no,N,1,,92217,18716,8SP
2,,SING,N,HN,no,N,2,,92217,18716,8SP
3,,SING,N,HNA,no,N,3,,92217,18716,8SP
4,,SING,P,O0C,no,N,4,,92217,18716,8SP
5,,DOUB,P,O2P,no,N,5,,92217,18716,8SP
6,,SING,P,O3G,no,N,6,,92217,18716,8SP
7,,SING,P,O3P,no,N,7,,92217,18716,8SP
8,,SING,O0C,C1C,no,N,8,,92217,18716,8SP
9,,DOUB,C1A,O1A,no,N,9,,92217,18716,8SP
10,,SING,C1A,O1G,no,N,10,,92217,18716,8SP
11,,SING,C1A,C2A,no,N,11,,92217,18716,8SP
12,,DOUB,C1B,O1B,no,N,12,,92217,18716,8SP
13,,SING,C1B,C2B,no,N,13,,92217,18716,8SP
14,,SING,C1B,O2G,no,N,14,,92217,18716,8SP
15,,SING,C1C,C2C,no,N,15,,92217,18716,8SP
16,,SING,C1C,H11C,no,N,16,,92217,18716,8SP
17,,SING,C1C,H21C,no,N,17,,92217,18716,8SP
18,,SING,C1G,O1G,no,N,18,,92217,18716,8SP
19,,SING,C1G,C2G,no,N,19,,92217,18716,8SP
20,,SING,C1G,H11G,no,N,20,,92217,18716,8SP
21,,SING,C1G,H21G,no,N,21,,92217,18716,8SP
22,,SING,C2A,C3A,no,N,22,,92217,18716,8SP
23,,SING,C2A,H12A,no,N,23,,92217,18716,8SP
24,,SING,C2A,H22A,no,N,24,,92217,18716,8SP
25,,SING,C2B,C3B,no,N,25,,92217,18716,8SP
26,,SING,C2B,H12B,no,N,26,,92217,18716,8SP
27,,SING,C2B,H22B,no,N,27,,92217,18716,8SP
28,,SING,C2C,C3C,no,N,28,,92217,18716,8SP
29,,SING,C2C,H2C,no,N,29,,92217,18716,8SP
30,,SING,C2G,O2G,no,N,30,,92217,18716,8SP
31,,SING,C2G,C3G,no,N,31,,92217,18716,8SP
32,,SING,C2G,H2G,no,N,32,,92217,18716,8SP
33,,SING,C3A,C4A,no,N,33,,92217,18716,8SP
34,,SING,C3A,H13A,no,N,34,,92217,18716,8SP
35,,SING,C3A,H23A,no,N,35,,92217,18716,8SP
36,,SING,C3B,C4B,no,N,36,,92217,18716,8SP
37,,SING,C3B,H13B,no,N,37,,92217,18716,8SP
38,,SING,C3B,H23B,no,N,38,,92217,18716,8SP
39,,DOUB,C3C,O3C,no,N,39,,92217,18716,8SP
40,,SING,C3C,O3D,no,N,40,,92217,18716,8SP
41,,SING,C3G,O3G,no,N,41,,92217,18716,8SP
42,,SING,C3G,H13G,no,N,42,,92217,18716,8SP
43,,SING,C3G,H23G,no,N,43,,92217,18716,8SP
44,,SING,C4A,C5A,no,N,44,,92217,18716,8SP
45,,SING,C4A,H14A,no,N,45,,92217,18716,8SP
46,,SING,C4A,H24A,no,N,46,,92217,18716,8SP
47,,SING,C4B,C5B,no,N,47,,92217,18716,8SP
48,,SING,C4B,H14B,no,N,48,,92217,18716,8SP
49,,SING,C4B,H24B,no,N,49,,92217,18716,8SP
50,,SING,C5A,C6A,no,N,50,,92217,18716,8SP
51,,SING,C5A,H15A,no,N,51,,92217,18716,8SP
52,,SING,C5A,H25A,no,N,52,,92217,18716,8SP
53,,SING,C5B,C6B,no,N,53,,92217,18716,8SP
54,,SING,C5B,H15B,no,N,54,,92217,18716,8SP
55,,SING,C5B,H25B,no,N,55,,92217,18716,8SP
56,,SING,C6A,C7A,no,N,56,,92217,18716,8SP
57,,SING,C6A,H16A,no,N,57,,92217,18716,8SP
58,,SING,C6A,H26A,no,N,58,,92217,18716,8SP
59,,SING,C6B,C7B,no,N,59,,92217,18716,8SP
60,,SING,C6B,H16B,no,N,60,,92217,18716,8SP
61,,SING,C6B,H26B,no,N,61,,92217,18716,8SP
62,,SING,C7A,C8A,no,N,62,,92217,18716,8SP
63,,SING,C7A,H17A,no,N,63,,92217,18716,8SP
64,,SING,C7A,H27A,no,N,64,,92217,18716,8SP
65,,SING,C7B,C8B,no,N,65,,92217,18716,8SP
66,,SING,C7B,H17B,no,N,66,,92217,18716,8SP
67,,SING,C7B,H27B,no,N,67,,92217,18716,8SP
68,,SING,C8A,H18A,no,N,68,,92217,18716,8SP
69,,SING,C8A,H28A,no,N,69,,92217,18716,8SP
70,,SING,C8A,H38A,no,N,70,,92217,18716,8SP
71,,SING,C8B,H18B,no,N,71,,92217,18716,8SP
72,,SING,C8B,H28B,no,N,72,,92217,18716,8SP
73,,SING,C8B,H38B,no,N,73,,92217,18716,8SP
74,,SING,O3D,H41,no,N,74,,92217,18716,8SP
75,,SING,O3P,H42,no,N,75,,92217,18716,8SP
1,,SING,C1,C2,no,N,1,,92383,18724,FUC
2,,SING,C1,O1,no,N,2,,92383,18724,FUC
3,,SING,C1,O5,no,N,3,,92383,18724,FUC
4,,SING,C1,H1,no,N,4,,92383,18724,FUC
5,,SING,C2,C3,no,N,5,,92383,18724,FUC
6,,SING,C2,O2,no,N,6,,92383,18724,FUC
7,,SING,C2,H2,no,N,7,,92383,18724,FUC
8,,SING,C3,C4,no,N,8,,92383,18724,FUC
9,,SING,C3,O3,no,N,9,,92383,18724,FUC
10,,SING,C3,H3,no,N,10,,92383,18724,FUC
11,,SING,C4,C5,no,N,11,,92383,18724,FUC
12,,SING,C4,O4,no,N,12,,92383,18724,FUC
13,,SING,C4,H4,no,N,13,,92383,18724,FUC
14,,SING,C5,C6,no,N,14,,92383,18724,FUC
15,,SING,C5,O5,no,N,15,,92383,18724,FUC
16,,SING,C5,H5,no,N,16,,92383,18724,FUC
17,,SING,C6,H61,no,N,17,,92383,18724,FUC
18,,SING,C6,H62,no,N,18,,92383,18724,FUC
19,,SING,C6,H63,no,N,19,,92383,18724,FUC
20,,SING,O1,HO1,no,N,20,,92383,18724,FUC
21,,SING,O2,HO2,no,N,21,,92383,18724,FUC
22,,SING,O3,HO3,no,N,22,,92383,18724,FUC
23,,SING,O4,HO4,no,N,23,,92383,18724,FUC
1,,SING,C1,O1,no,N,1,,92384,18724,EDO
2,,SING,C1,C2,no,N,2,,92384,18724,EDO
3,,SING,C1,H11,no,N,3,,92384,18724,EDO
4,,SING,C1,H12,no,N,4,,92384,18724,EDO
5,,SING,O1,HO1,no,N,5,,92384,18724,EDO
6,,SING,C2,O2,no,N,6,,92384,18724,EDO
7,,SING,C2,H21,no,N,7,,92384,18724,EDO
8,,SING,C2,H22,no,N,8,,92384,18724,EDO
9,,SING,O2,HO2,no,N,9,,92384,18724,EDO
1,,SING,N,HN1,no,N,1,,92622,18736,NH2
2,,SING,N,HN2,no,N,2,,92622,18736,NH2
1,,SING,C21,C20,no,N,1,,92843,18755,0R3
2,,SING,C20,O4,no,N,2,,92843,18755,0R3
3,,SING,C20,C18,no,N,3,,92843,18755,0R3
4,,SING,C22,C19,no,N,4,,92843,18755,0R3
5,,DOUB,C11,C12,yes,N,5,,92843,18755,0R3
6,,SING,C11,C10,yes,N,6,,92843,18755,0R3
7,,SING,C18,C19,no,N,7,,92843,18755,0R3
8,,SING,C18,N1,no,N,8,,92843,18755,0R3
9,,SING,C12,C7,yes,N,9,,92843,18755,0R3
10,,SING,CL1,C10,no,N,10,,92843,18755,0R3
11,,DOUB,C10,C9,yes,N,11,,92843,18755,0R3
12,,SING,C7,C1,no,N,12,,92843,18755,0R3
13,,DOUB,C7,C8,yes,N,13,,92843,18755,0R3
14,,SING,N1,C1,no,N,14,,92843,18755,0R3
15,,SING,N1,C5,no,N,15,,92843,18755,0R3
16,,SING,C1,C2,no,N,16,,92843,18755,0R3
17,,SING,C9,C8,yes,N,17,,92843,18755,0R3
18,,DOUB,O1,C5,no,N,18,,92843,18755,0R3
19,,SING,C5,C4,no,N,19,,92843,18755,0R3
20,,DOUB,C13,C14,yes,N,20,,92843,18755,0R3
21,,SING,C13,C6,yes,N,21,,92843,18755,0R3
22,,SING,C14,C15,yes,N,22,,92843,18755,0R3
23,,SING,C2,C6,no,N,23,,92843,18755,0R3
24,,SING,C2,C3,no,N,24,,92843,18755,0R3
25,,DOUB,C6,C17,yes,N,25,,92843,18755,0R3
26,,DOUB,C15,C16,yes,N,26,,92843,18755,0R3
27,,SING,C3,C4,no,N,27,,92843,18755,0R3
28,,SING,C24,C4,no,N,28,,92843,18755,0R3
29,,SING,C4,C23,no,N,29,,92843,18755,0R3
30,,SING,C17,C16,yes,N,30,,92843,18755,0R3
31,,SING,C16,CL2,no,N,31,,92843,18755,0R3
32,,SING,C23,C25,no,N,32,,92843,18755,0R3
33,,DOUB,C25,O3,no,N,33,,92843,18755,0R3
34,,SING,C25,O2,no,N,34,,92843,18755,0R3
35,,SING,C17,H1,no,N,35,,92843,18755,0R3
36,,SING,C15,H2,no,N,36,,92843,18755,0R3
37,,SING,C14,H3,no,N,37,,92843,18755,0R3
38,,SING,C13,H4,no,N,38,,92843,18755,0R3
39,,SING,C2,H5,no,N,39,,92843,18755,0R3
40,,SING,C3,H6,no,N,40,,92843,18755,0R3
41,,SING,C3,H7,no,N,41,,92843,18755,0R3
42,,SING,C23,H8,no,N,42,,92843,18755,0R3
43,,SING,C23,H9,no,N,43,,92843,18755,0R3
44,,SING,O2,H10,no,N,44,,92843,18755,0R3
45,,SING,C24,H11,no,N,45,,92843,18755,0R3
46,,SING,C24,H12,no,N,46,,92843,18755,0R3
47,,SING,C24,H13,no,N,47,,92843,18755,0R3
48,,SING,C18,H14,no,N,48,,92843,18755,0R3
49,,SING,C19,H15,no,N,49,,92843,18755,0R3
50,,SING,C19,H16,no,N,50,,92843,18755,0R3
51,,SING,C22,H17,no,N,51,,92843,18755,0R3
52,,SING,C22,H18,no,N,52,,92843,18755,0R3
53,,SING,C22,H19,no,N,53,,92843,18755,0R3
54,,SING,C20,H20,no,N,54,,92843,18755,0R3
55,,SING,O4,H21,no,N,55,,92843,18755,0R3
56,,SING,C21,H22,no,N,56,,92843,18755,0R3
57,,SING,C21,H23,no,N,57,,92843,18755,0R3
58,,SING,C21,H24,no,N,58,,92843,18755,0R3
59,,SING,C1,H25,no,N,59,,92843,18755,0R3
60,,SING,C8,H26,no,N,60,,92843,18755,0R3
61,,SING,C9,H27,no,N,61,,92843,18755,0R3
62,,SING,C11,H28,no,N,62,,92843,18755,0R3
63,,SING,C12,H29,no,N,63,,92843,18755,0R3
1,,SING,N,CB,no,N,1,,92992,18762,DBP
2,,SING,N,HN1,no,N,2,,92992,18762,DBP
3,,SING,N,HN21,no,N,3,,92992,18762,DBP
4,,SING,CB,CG,no,N,4,,92992,18762,DBP
5,,SING,CB,HB11,no,N,5,,92992,18762,DBP
6,,SING,CB,HB21,no,N,6,,92992,18762,DBP
7,,DOUB,CG,CD1,yes,N,7,,92992,18762,DBP
8,,SING,CG,CD2,yes,N,8,,92992,18762,DBP
9,,SING,CD1,CE1,yes,N,9,,92992,18762,DBP
10,,SING,CD1,HD11,no,N,10,,92992,18762,DBP
11,,DOUB,CE1,CZ,yes,N,11,,92992,18762,DBP
12,,SING,CE1,HC11,no,N,12,,92992,18762,DBP
13,,DOUB,CD2,CE2,yes,N,13,,92992,18762,DBP
14,,SING,CD2,HC21,no,N,14,,92992,18762,DBP
15,,SING,CE2,CZ,yes,N,15,,92992,18762,DBP
16,,SING,CE2,NE2,no,N,16,,92992,18762,DBP
17,,SING,CZ,HCZ1,no,N,17,,92992,18762,DBP
18,,SING,NE2,HE21,no,N,18,,92992,18762,DBP
19,,SING,NE2,HE22,no,N,19,,92992,18762,DBP
1,,SING,N,CA,no,N,1,,93027,18764,M3L
2,,SING,N,H,no,N,2,,93027,18764,M3L
3,,SING,N,H2,no,N,3,,93027,18764,M3L
4,,SING,CA,CB,no,N,4,,93027,18764,M3L
5,,SING,CA,C,no,N,5,,93027,18764,M3L
6,,SING,CA,HA,no,N,6,,93027,18764,M3L
7,,SING,CB,CG,no,N,7,,93027,18764,M3L
8,,SING,CB,HB2,no,N,8,,93027,18764,M3L
9,,SING,CB,HB3,no,N,9,,93027,18764,M3L
10,,SING,CG,CD,no,N,10,,93027,18764,M3L
11,,SING,CG,HG2,no,N,11,,93027,18764,M3L
12,,SING,CG,HG3,no,N,12,,93027,18764,M3L
13,,SING,CD,CE,no,N,13,,93027,18764,M3L
14,,SING,CD,HD2,no,N,14,,93027,18764,M3L
15,,SING,CD,HD3,no,N,15,,93027,18764,M3L
16,,SING,CE,NZ,no,N,16,,93027,18764,M3L
17,,SING,CE,HE2,no,N,17,,93027,18764,M3L
18,,SING,CE,HE3,no,N,18,,93027,18764,M3L
19,,SING,NZ,CM1,no,N,19,,93027,18764,M3L
20,,SING,NZ,CM2,no,N,20,,93027,18764,M3L
21,,SING,NZ,CM3,no,N,21,,93027,18764,M3L
22,,DOUB,C,O,no,N,22,,93027,18764,M3L
23,,SING,C,OXT,no,N,23,,93027,18764,M3L
24,,SING,OXT,HXT,no,N,24,,93027,18764,M3L
25,,SING,CM1,HM11,no,N,25,,93027,18764,M3L
26,,SING,CM1,HM12,no,N,26,,93027,18764,M3L
27,,SING,CM1,HM13,no,N,27,,93027,18764,M3L
28,,SING,CM2,HM21,no,N,28,,93027,18764,M3L
29,,SING,CM2,HM22,no,N,29,,93027,18764,M3L
30,,SING,CM2,HM23,no,N,30,,93027,18764,M3L
31,,SING,CM3,HM31,no,N,31,,93027,18764,M3L
32,,SING,CM3,HM32,no,N,32,,93027,18764,M3L
33,,SING,CM3,HM33,no,N,33,,93027,18764,M3L
1,,SING,N,CN,no,N,1,,93141,18770,FME
2,,SING,N,CA,no,N,2,,93141,18770,FME
3,,SING,N,H,no,N,3,,93141,18770,FME
4,,DOUB,CN,O1,no,N,4,,93141,18770,FME
5,,SING,CN,HCN,no,N,5,,93141,18770,FME
6,,SING,CA,CB,no,N,6,,93141,18770,FME
7,,SING,CA,C,no,N,7,,93141,18770,FME
8,,SING,CA,HA,no,N,8,,93141,18770,FME
9,,SING,CB,CG,no,N,9,,93141,18770,FME
10,,SING,CB,HB2,no,N,10,,93141,18770,FME
11,,SING,CB,HB3,no,N,11,,93141,18770,FME
12,,SING,CG,SD,no,N,12,,93141,18770,FME
13,,SING,CG,HG2,no,N,13,,93141,18770,FME
14,,SING,CG,HG3,no,N,14,,93141,18770,FME
15,,SING,SD,CE,no,N,15,,93141,18770,FME
16,,SING,CE,HE1,no,N,16,,93141,18770,FME
17,,SING,CE,HE2,no,N,17,,93141,18770,FME
18,,SING,CE,HE3,no,N,18,,93141,18770,FME
19,,DOUB,C,O,no,N,19,,93141,18770,FME
20,,SING,C,OXT,no,N,20,,93141,18770,FME
21,,SING,OXT,HXT,no,N,21,,93141,18770,FME
1,,SING,N,CN,no,N,1,,93161,18771,FME
2,,SING,N,CA,no,N,2,,93161,18771,FME
3,,SING,N,H,no,N,3,,93161,18771,FME
4,,DOUB,CN,O1,no,N,4,,93161,18771,FME
5,,SING,CN,HCN,no,N,5,,93161,18771,FME
6,,SING,CA,CB,no,N,6,,93161,18771,FME
7,,SING,CA,C,no,N,7,,93161,18771,FME
8,,SING,CA,HA,no,N,8,,93161,18771,FME
9,,SING,CB,CG,no,N,9,,93161,18771,FME
10,,SING,CB,HB2,no,N,10,,93161,18771,FME
11,,SING,CB,HB3,no,N,11,,93161,18771,FME
12,,SING,CG,SD,no,N,12,,93161,18771,FME
13,,SING,CG,HG2,no,N,13,,93161,18771,FME
14,,SING,CG,HG3,no,N,14,,93161,18771,FME
15,,SING,SD,CE,no,N,15,,93161,18771,FME
16,,SING,CE,HE1,no,N,16,,93161,18771,FME
17,,SING,CE,HE2,no,N,17,,93161,18771,FME
18,,SING,CE,HE3,no,N,18,,93161,18771,FME
19,,DOUB,C,O,no,N,19,,93161,18771,FME
20,,SING,C,OXT,no,N,20,,93161,18771,FME
21,,SING,OXT,HXT,no,N,21,,93161,18771,FME
1,,DOUB,P,O1P,no,N,1,,93241,18775,OMP
2,,SING,P,O2P,no,N,2,,93241,18775,OMP
3,,SING,P,O3P,no,N,3,,93241,18775,OMP
4,,SING,P,O5',no,N,4,,93241,18775,OMP
5,,SING,O2P,HOP2,no,N,5,,93241,18775,OMP
6,,SING,O3P,HOP3,no,N,6,,93241,18775,OMP
7,,SING,O5',C5',no,N,7,,93241,18775,OMP
8,,SING,C5',C4',no,N,8,,93241,18775,OMP
9,,SING,C5',H5'1,no,N,9,,93241,18775,OMP
10,,SING,C5',H5'2,no,N,10,,93241,18775,OMP
11,,SING,C4',O4',no,N,11,,93241,18775,OMP
12,,SING,C4',C3',no,N,12,,93241,18775,OMP
13,,SING,C4',H4',no,N,13,,93241,18775,OMP
14,,SING,O4',C1',no,N,14,,93241,18775,OMP
15,,SING,C3',C2',no,N,15,,93241,18775,OMP
16,,SING,C3',O3',no,N,16,,93241,18775,OMP
17,,SING,C3',H3',no,N,17,,93241,18775,OMP
18,,SING,O3',HO3',no,N,18,,93241,18775,OMP
19,,SING,C2',C1',no,N,19,,93241,18775,OMP
20,,SING,C2',O2',no,N,20,,93241,18775,OMP
21,,SING,C2',H2',no,N,21,,93241,18775,OMP
22,,SING,O2',HO2',no,N,22,,93241,18775,OMP
23,,SING,C1',N1,no,N,23,,93241,18775,OMP
24,,SING,C1',H1',no,N,24,,93241,18775,OMP
25,,SING,N1,C2,no,N,25,,93241,18775,OMP
26,,SING,N1,C6,no,N,26,,93241,18775,OMP
27,,SING,C2,N3,no,N,27,,93241,18775,OMP
28,,DOUB,C2,O2,no,N,28,,93241,18775,OMP
29,,SING,N3,C4,no,N,29,,93241,18775,OMP
30,,SING,N3,HN3,no,N,30,,93241,18775,OMP
31,,SING,C4,C5,no,N,31,,93241,18775,OMP
32,,DOUB,C4,O4,no,N,32,,93241,18775,OMP
33,,DOUB,C5,C6,no,N,33,,93241,18775,OMP
34,,SING,C5,H5,no,N,34,,93241,18775,OMP
35,,SING,C6,C7,no,N,35,,93241,18775,OMP
36,,DOUB,C7,O71,no,N,36,,93241,18775,OMP
37,,SING,C7,O72,no,N,37,,93241,18775,OMP
38,,SING,O72,HO7,no,N,38,,93241,18775,OMP
1,,SING,C20,C21,no,N,1,,93355,18780,HP6
2,,SING,C20,H201,no,N,2,,93355,18780,HP6
3,,SING,C20,H202,no,N,3,,93355,18780,HP6
4,,SING,C20,H203,no,N,4,,93355,18780,HP6
5,,SING,C21,C22,no,N,5,,93355,18780,HP6
6,,SING,C21,H211,no,N,6,,93355,18780,HP6
7,,SING,C21,H212,no,N,7,,93355,18780,HP6
8,,SING,C22,C23,no,N,8,,93355,18780,HP6
9,,SING,C22,H221,no,N,9,,93355,18780,HP6
10,,SING,C22,H222,no,N,10,,93355,18780,HP6
11,,SING,C23,C24,no,N,11,,93355,18780,HP6
12,,SING,C23,H231,no,N,12,,93355,18780,HP6
13,,SING,C23,H232,no,N,13,,93355,18780,HP6
14,,SING,C24,C25,no,N,14,,93355,18780,HP6
15,,SING,C24,H241,no,N,15,,93355,18780,HP6
16,,SING,C24,H242,no,N,16,,93355,18780,HP6
17,,SING,C25,C26,no,N,17,,93355,18780,HP6
18,,SING,C25,H251,no,N,18,,93355,18780,HP6
19,,SING,C25,H252,no,N,19,,93355,18780,HP6
20,,SING,C26,H261,no,N,20,,93355,18780,HP6
21,,SING,C26,H262,no,N,21,,93355,18780,HP6
22,,SING,C26,H263,no,N,22,,93355,18780,HP6
1,,SING,C20,C21,no,N,1,,93378,18781,HP6
2,,SING,C20,H201,no,N,2,,93378,18781,HP6
3,,SING,C20,H202,no,N,3,,93378,18781,HP6
4,,SING,C20,H203,no,N,4,,93378,18781,HP6
5,,SING,C21,C22,no,N,5,,93378,18781,HP6
6,,SING,C21,H211,no,N,6,,93378,18781,HP6
7,,SING,C21,H212,no,N,7,,93378,18781,HP6
8,,SING,C22,C23,no,N,8,,93378,18781,HP6
9,,SING,C22,H221,no,N,9,,93378,18781,HP6
10,,SING,C22,H222,no,N,10,,93378,18781,HP6
11,,SING,C23,C24,no,N,11,,93378,18781,HP6
12,,SING,C23,H231,no,N,12,,93378,18781,HP6
13,,SING,C23,H232,no,N,13,,93378,18781,HP6
14,,SING,C24,C25,no,N,14,,93378,18781,HP6
15,,SING,C24,H241,no,N,15,,93378,18781,HP6
16,,SING,C24,H242,no,N,16,,93378,18781,HP6
17,,SING,C25,C26,no,N,17,,93378,18781,HP6
18,,SING,C25,H251,no,N,18,,93378,18781,HP6
19,,SING,C25,H252,no,N,19,,93378,18781,HP6
20,,SING,C26,H261,no,N,20,,93378,18781,HP6
21,,SING,C26,H262,no,N,21,,93378,18781,HP6
22,,SING,C26,H263,no,N,22,,93378,18781,HP6
1,,SING,N,CA,no,N,1,,93417,18783,PCA
2,,SING,N,CD,no,N,2,,93417,18783,PCA
3,,SING,N,H,no,N,3,,93417,18783,PCA
4,,SING,CA,CB,no,N,4,,93417,18783,PCA
5,,SING,CA,C,no,N,5,,93417,18783,PCA
6,,SING,CA,HA,no,N,6,,93417,18783,PCA
7,,SING,CB,CG,no,N,7,,93417,18783,PCA
8,,SING,CB,HB2,no,N,8,,93417,18783,PCA
9,,SING,CB,HB3,no,N,9,,93417,18783,PCA
10,,SING,CG,CD,no,N,10,,93417,18783,PCA
11,,SING,CG,HG2,no,N,11,,93417,18783,PCA
12,,SING,CG,HG3,no,N,12,,93417,18783,PCA
13,,DOUB,CD,OE,no,N,13,,93417,18783,PCA
14,,DOUB,C,O,no,N,14,,93417,18783,PCA
15,,SING,C,OXT,no,N,15,,93417,18783,PCA
16,,SING,OXT,HXT,no,N,16,,93417,18783,PCA
1,,SING,N,CA,no,N,1,,93433,18784,PCA
2,,SING,N,CD,no,N,2,,93433,18784,PCA
3,,SING,N,H,no,N,3,,93433,18784,PCA
4,,SING,CA,CB,no,N,4,,93433,18784,PCA
5,,SING,CA,C,no,N,5,,93433,18784,PCA
6,,SING,CA,HA,no,N,6,,93433,18784,PCA
7,,SING,CB,CG,no,N,7,,93433,18784,PCA
8,,SING,CB,HB2,no,N,8,,93433,18784,PCA
9,,SING,CB,HB3,no,N,9,,93433,18784,PCA
10,,SING,CG,CD,no,N,10,,93433,18784,PCA
11,,SING,CG,HG2,no,N,11,,93433,18784,PCA
12,,SING,CG,HG3,no,N,12,,93433,18784,PCA
13,,DOUB,CD,OE,no,N,13,,93433,18784,PCA
14,,DOUB,C,O,no,N,14,,93433,18784,PCA
15,,SING,C,OXT,no,N,15,,93433,18784,PCA
16,,SING,OXT,HXT,no,N,16,,93433,18784,PCA
1,,SING,CHA,C1A,yes,N,1,,93482,18787,HEM
2,,DOUB,CHA,C4D,yes,N,2,,93482,18787,HEM
3,,SING,CHA,HHA,no,N,3,,93482,18787,HEM
4,,SING,CHB,C4A,yes,N,4,,93482,18787,HEM
5,,DOUB,CHB,C1B,yes,N,5,,93482,18787,HEM
6,,SING,CHB,HHB,no,N,6,,93482,18787,HEM
7,,SING,CHC,C4B,yes,N,7,,93482,18787,HEM
8,,DOUB,CHC,C1C,yes,N,8,,93482,18787,HEM
9,,SING,CHC,HHC,no,N,9,,93482,18787,HEM
10,,DOUB,CHD,C4C,yes,N,10,,93482,18787,HEM
11,,SING,CHD,C1D,yes,N,11,,93482,18787,HEM
12,,SING,CHD,HHD,no,N,12,,93482,18787,HEM
13,,DOUB,C1A,C2A,yes,N,13,,93482,18787,HEM
14,,SING,C1A,NA,yes,N,14,,93482,18787,HEM
15,,SING,C2A,C3A,yes,N,15,,93482,18787,HEM
16,,SING,C2A,CAA,no,N,16,,93482,18787,HEM
17,,DOUB,C3A,C4A,yes,N,17,,93482,18787,HEM
18,,SING,C3A,CMA,no,N,18,,93482,18787,HEM
19,,SING,C4A,NA,yes,N,19,,93482,18787,HEM
20,,SING,CMA,HMA,no,N,20,,93482,18787,HEM
21,,SING,CMA,HMAA,no,N,21,,93482,18787,HEM
22,,SING,CMA,HMAB,no,N,22,,93482,18787,HEM
23,,SING,CAA,CBA,no,N,23,,93482,18787,HEM
24,,SING,CAA,HAA,no,N,24,,93482,18787,HEM
25,,SING,CAA,HAAA,no,N,25,,93482,18787,HEM
26,,SING,CBA,CGA,no,N,26,,93482,18787,HEM
27,,SING,CBA,HBA,no,N,27,,93482,18787,HEM
28,,SING,CBA,HBAA,no,N,28,,93482,18787,HEM
29,,DOUB,CGA,O1A,no,N,29,,93482,18787,HEM
30,,SING,CGA,O2A,no,N,30,,93482,18787,HEM
31,,SING,C1B,C2B,no,N,31,,93482,18787,HEM
32,,SING,C1B,NB,yes,N,32,,93482,18787,HEM
33,,DOUB,C2B,C3B,yes,N,33,,93482,18787,HEM
34,,SING,C2B,CMB,yes,N,34,,93482,18787,HEM
35,,SING,C3B,C4B,no,N,35,,93482,18787,HEM
36,,SING,C3B,CAB,yes,N,36,,93482,18787,HEM
37,,DOUB,C4B,NB,no,N,37,,93482,18787,HEM
38,,SING,CMB,HMB,yes,N,38,,93482,18787,HEM
39,,SING,CMB,HMBA,no,N,39,,93482,18787,HEM
40,,SING,CMB,HMBB,no,N,40,,93482,18787,HEM
41,,DOUB,CAB,CBB,no,N,41,,93482,18787,HEM
42,,SING,CAB,HAB,no,N,42,,93482,18787,HEM
43,,SING,CBB,HBB,no,N,43,,93482,18787,HEM
44,,SING,CBB,HBBA,no,N,44,,93482,18787,HEM
45,,SING,C1C,C2C,no,N,45,,93482,18787,HEM
46,,SING,C1C,NC,yes,N,46,,93482,18787,HEM
47,,DOUB,C2C,C3C,yes,N,47,,93482,18787,HEM
48,,SING,C2C,CMC,yes,N,48,,93482,18787,HEM
49,,SING,C3C,C4C,no,N,49,,93482,18787,HEM
50,,SING,C3C,CAC,yes,N,50,,93482,18787,HEM
51,,SING,C4C,NC,no,N,51,,93482,18787,HEM
52,,SING,CMC,HMC,yes,N,52,,93482,18787,HEM
53,,SING,CMC,HMCA,no,N,53,,93482,18787,HEM
54,,SING,CMC,HMCB,no,N,54,,93482,18787,HEM
55,,DOUB,CAC,CBC,no,N,55,,93482,18787,HEM
56,,SING,CAC,HAC,no,N,56,,93482,18787,HEM
57,,SING,CBC,HBC,no,N,57,,93482,18787,HEM
58,,SING,CBC,HBCA,no,N,58,,93482,18787,HEM
59,,SING,C1D,C2D,no,N,59,,93482,18787,HEM
60,,DOUB,C1D,ND,yes,N,60,,93482,18787,HEM
61,,DOUB,C2D,C3D,yes,N,61,,93482,18787,HEM
62,,SING,C2D,CMD,yes,N,62,,93482,18787,HEM
63,,SING,C3D,C4D,no,N,63,,93482,18787,HEM
64,,SING,C3D,CAD,yes,N,64,,93482,18787,HEM
65,,SING,C4D,ND,no,N,65,,93482,18787,HEM
66,,SING,CMD,HMD,yes,N,66,,93482,18787,HEM
67,,SING,CMD,HMDA,no,N,67,,93482,18787,HEM
68,,SING,CMD,HMDB,no,N,68,,93482,18787,HEM
69,,SING,CAD,CBD,no,N,69,,93482,18787,HEM
70,,SING,CAD,HAD,no,N,70,,93482,18787,HEM
71,,SING,CAD,HADA,no,N,71,,93482,18787,HEM
72,,SING,CBD,CGD,no,N,72,,93482,18787,HEM
73,,SING,CBD,HBD,no,N,73,,93482,18787,HEM
74,,SING,CBD,HBDA,no,N,74,,93482,18787,HEM
75,,DOUB,CGD,O1D,no,N,75,,93482,18787,HEM
76,,SING,CGD,O2D,no,N,76,,93482,18787,HEM
77,,SING,O2A,H2A,no,N,77,,93482,18787,HEM
78,,SING,O2D,H2D,no,N,78,,93482,18787,HEM
79,,SING,FE,NA,no,N,79,,93482,18787,HEM
80,,SING,FE,NB,no,N,80,,93482,18787,HEM
81,,SING,FE,NC,no,N,81,,93482,18787,HEM
82,,SING,FE,ND,no,N,82,,93482,18787,HEM
1,,SING,ZN,NA,no,N,1,,93715,18800,ZNH
2,,SING,ZN,NB,no,N,2,,93715,18800,ZNH
3,,SING,ZN,NC,no,N,3,,93715,18800,ZNH
4,,SING,ZN,ND,no,N,4,,93715,18800,ZNH
5,,DOUB,CHA,C1A,yes,N,5,,93715,18800,ZNH
6,,SING,CHA,C4D,yes,N,6,,93715,18800,ZNH
7,,SING,CHA,HHA,no,N,7,,93715,18800,ZNH
8,,DOUB,CHB,C4A,yes,N,8,,93715,18800,ZNH
9,,SING,CHB,C1B,yes,N,9,,93715,18800,ZNH
10,,SING,CHB,HHB,no,N,10,,93715,18800,ZNH
11,,DOUB,CHC,C4B,yes,N,11,,93715,18800,ZNH
12,,SING,CHC,C1C,yes,N,12,,93715,18800,ZNH
13,,SING,CHC,HHC,no,N,13,,93715,18800,ZNH
14,,SING,CHD,C4C,yes,N,14,,93715,18800,ZNH
15,,DOUB,CHD,C1D,yes,N,15,,93715,18800,ZNH
16,,SING,CHD,HHD,no,N,16,,93715,18800,ZNH
17,,SING,NA,C1A,yes,N,17,,93715,18800,ZNH
18,,SING,NA,C4A,yes,N,18,,93715,18800,ZNH
19,,SING,C1A,C2A,yes,N,19,,93715,18800,ZNH
20,,DOUB,C2A,C3A,yes,N,20,,93715,18800,ZNH
21,,SING,C2A,CAA,no,N,21,,93715,18800,ZNH
22,,SING,C3A,C4A,yes,N,22,,93715,18800,ZNH
23,,SING,C3A,CMA,no,N,23,,93715,18800,ZNH
24,,SING,CMA,HMA1,no,N,24,,93715,18800,ZNH
25,,SING,CMA,HMA2,no,N,25,,93715,18800,ZNH
26,,SING,CMA,HMA3,no,N,26,,93715,18800,ZNH
27,,SING,CAA,CBA,no,N,27,,93715,18800,ZNH
28,,SING,CAA,HAA1,no,N,28,,93715,18800,ZNH
29,,SING,CAA,HAA2,no,N,29,,93715,18800,ZNH
30,,SING,CBA,CGA,no,N,30,,93715,18800,ZNH
31,,SING,CBA,HBA1,no,N,31,,93715,18800,ZNH
32,,SING,CBA,HBA2,no,N,32,,93715,18800,ZNH
33,,DOUB,CGA,O1A,no,N,33,,93715,18800,ZNH
34,,SING,CGA,O2A,no,N,34,,93715,18800,ZNH
35,,SING,O2A,H2A,no,N,35,,93715,18800,ZNH
36,,DOUB,NB,C1B,yes,N,36,,93715,18800,ZNH
37,,SING,NB,C4B,yes,N,37,,93715,18800,ZNH
38,,SING,C1B,C2B,no,N,38,,93715,18800,ZNH
39,,DOUB,C2B,C3B,no,N,39,,93715,18800,ZNH
40,,SING,C2B,CMB,no,N,40,,93715,18800,ZNH
41,,SING,C3B,C4B,no,N,41,,93715,18800,ZNH
42,,SING,C3B,CAB,no,N,42,,93715,18800,ZNH
43,,SING,CMB,HMB1,no,N,43,,93715,18800,ZNH
44,,SING,CMB,HMB2,no,N,44,,93715,18800,ZNH
45,,SING,CMB,HMB3,no,N,45,,93715,18800,ZNH
46,,DOUB,CAB,CBB,no,N,46,,93715,18800,ZNH
47,,SING,CAB,HAB,no,N,47,,93715,18800,ZNH
48,,SING,CBB,HBB1,no,N,48,,93715,18800,ZNH
49,,SING,CBB,HBB2,no,N,49,,93715,18800,ZNH
50,,SING,NC,C1C,yes,N,50,,93715,18800,ZNH
51,,SING,NC,C4C,yes,N,51,,93715,18800,ZNH
52,,DOUB,C1C,C2C,yes,N,52,,93715,18800,ZNH
53,,SING,C2C,C3C,yes,N,53,,93715,18800,ZNH
54,,SING,C2C,CMC,no,N,54,,93715,18800,ZNH
55,,DOUB,C3C,C4C,yes,N,55,,93715,18800,ZNH
56,,SING,C3C,CAC,no,N,56,,93715,18800,ZNH
57,,SING,CMC,HMC1,no,N,57,,93715,18800,ZNH
58,,SING,CMC,HMC2,no,N,58,,93715,18800,ZNH
59,,SING,CMC,HMC3,no,N,59,,93715,18800,ZNH
60,,DOUB,CAC,CBC,no,N,60,,93715,18800,ZNH
61,,SING,CAC,HAC,no,N,61,,93715,18800,ZNH
62,,SING,CBC,HBC1,no,N,62,,93715,18800,ZNH
63,,SING,CBC,HBC2,no,N,63,,93715,18800,ZNH
64,,SING,ND,C1D,yes,N,64,,93715,18800,ZNH
65,,DOUB,ND,C4D,yes,N,65,,93715,18800,ZNH
66,,SING,C1D,C2D,no,N,66,,93715,18800,ZNH
67,,DOUB,C2D,C3D,no,N,67,,93715,18800,ZNH
68,,SING,C2D,CMD,no,N,68,,93715,18800,ZNH
69,,SING,C3D,C4D,no,N,69,,93715,18800,ZNH
70,,SING,C3D,CAD,no,N,70,,93715,18800,ZNH
71,,SING,CMD,HMD1,no,N,71,,93715,18800,ZNH
72,,SING,CMD,HMD2,no,N,72,,93715,18800,ZNH
73,,SING,CMD,HMD3,no,N,73,,93715,18800,ZNH
74,,SING,CAD,CBD,no,N,74,,93715,18800,ZNH
75,,SING,CAD,HAD1,no,N,75,,93715,18800,ZNH
76,,SING,CAD,HAD2,no,N,76,,93715,18800,ZNH
77,,SING,CBD,CGD,no,N,77,,93715,18800,ZNH
78,,SING,CBD,HBD1,no,N,78,,93715,18800,ZNH
79,,SING,CBD,HBD2,no,N,79,,93715,18800,ZNH
80,,DOUB,CGD,O1D,no,N,80,,93715,18800,ZNH
81,,SING,CGD,O2D,no,N,81,,93715,18800,ZNH
82,,SING,O2D,H2D,no,N,82,,93715,18800,ZNH
1,,SING,N,CA,no,N,1,,93963,18813,M3L
2,,SING,N,H,no,N,2,,93963,18813,M3L
3,,SING,N,H2,no,N,3,,93963,18813,M3L
4,,SING,CA,CB,no,N,4,,93963,18813,M3L
5,,SING,CA,C,no,N,5,,93963,18813,M3L
6,,SING,CA,HA,no,N,6,,93963,18813,M3L
7,,SING,CB,CG,no,N,7,,93963,18813,M3L
8,,SING,CB,HB2,no,N,8,,93963,18813,M3L
9,,SING,CB,HB3,no,N,9,,93963,18813,M3L
10,,SING,CG,CD,no,N,10,,93963,18813,M3L
11,,SING,CG,HG2,no,N,11,,93963,18813,M3L
12,,SING,CG,HG3,no,N,12,,93963,18813,M3L
13,,SING,CD,CE,no,N,13,,93963,18813,M3L
14,,SING,CD,HD2,no,N,14,,93963,18813,M3L
15,,SING,CD,HD3,no,N,15,,93963,18813,M3L
16,,SING,CE,NZ,no,N,16,,93963,18813,M3L
17,,SING,CE,HE2,no,N,17,,93963,18813,M3L
18,,SING,CE,HE3,no,N,18,,93963,18813,M3L
19,,SING,NZ,CM1,no,N,19,,93963,18813,M3L
20,,SING,NZ,CM2,no,N,20,,93963,18813,M3L
21,,SING,NZ,CM3,no,N,21,,93963,18813,M3L
22,,DOUB,C,O,no,N,22,,93963,18813,M3L
23,,SING,C,OXT,no,N,23,,93963,18813,M3L
24,,SING,OXT,HXT,no,N,24,,93963,18813,M3L
25,,SING,CM1,HM11,no,N,25,,93963,18813,M3L
26,,SING,CM1,HM12,no,N,26,,93963,18813,M3L
27,,SING,CM1,HM13,no,N,27,,93963,18813,M3L
28,,SING,CM2,HM21,no,N,28,,93963,18813,M3L
29,,SING,CM2,HM22,no,N,29,,93963,18813,M3L
30,,SING,CM2,HM23,no,N,30,,93963,18813,M3L
31,,SING,CM3,HM31,no,N,31,,93963,18813,M3L
32,,SING,CM3,HM32,no,N,32,,93963,18813,M3L
33,,SING,CM3,HM33,no,N,33,,93963,18813,M3L
1,,SING,FE,NA,no,N,1,,94261,18828,HEC
2,,SING,FE,NB,no,N,2,,94261,18828,HEC
3,,SING,FE,NC,no,N,3,,94261,18828,HEC
4,,SING,FE,ND,no,N,4,,94261,18828,HEC
5,,DOUB,CHA,C1A,no,N,5,,94261,18828,HEC
6,,SING,CHA,C4D,no,N,6,,94261,18828,HEC
7,,SING,CHA,HHA,no,N,7,,94261,18828,HEC
8,,DOUB,CHB,C4A,no,N,8,,94261,18828,HEC
9,,SING,CHB,C1B,no,N,9,,94261,18828,HEC
10,,SING,CHB,HHB,no,N,10,,94261,18828,HEC
11,,DOUB,CHC,C4B,no,N,11,,94261,18828,HEC
12,,SING,CHC,C1C,no,N,12,,94261,18828,HEC
13,,SING,CHC,HHC,no,N,13,,94261,18828,HEC
14,,DOUB,CHD,C4C,no,N,14,,94261,18828,HEC
15,,SING,CHD,C1D,no,N,15,,94261,18828,HEC
16,,SING,CHD,HHD,no,N,16,,94261,18828,HEC
17,,SING,NA,C1A,yes,N,17,,94261,18828,HEC
18,,SING,NA,C4A,yes,N,18,,94261,18828,HEC
19,,SING,C1A,C2A,yes,N,19,,94261,18828,HEC
20,,DOUB,C2A,C3A,yes,N,20,,94261,18828,HEC
21,,SING,C2A,CAA,no,N,21,,94261,18828,HEC
22,,SING,C3A,C4A,yes,N,22,,94261,18828,HEC
23,,SING,C3A,CMA,no,N,23,,94261,18828,HEC
24,,SING,CMA,HMA1,no,N,24,,94261,18828,HEC
25,,SING,CMA,HMA2,no,N,25,,94261,18828,HEC
26,,SING,CMA,HMA3,no,N,26,,94261,18828,HEC
27,,SING,CAA,CBA,no,N,27,,94261,18828,HEC
28,,SING,CAA,HAA1,no,N,28,,94261,18828,HEC
29,,SING,CAA,HAA2,no,N,29,,94261,18828,HEC
30,,SING,CBA,CGA,no,N,30,,94261,18828,HEC
31,,SING,CBA,HBA1,no,N,31,,94261,18828,HEC
32,,SING,CBA,HBA2,no,N,32,,94261,18828,HEC
33,,DOUB,CGA,O1A,no,N,33,,94261,18828,HEC
34,,SING,CGA,O2A,no,N,34,,94261,18828,HEC
35,,SING,O2A,H2A,no,N,35,,94261,18828,HEC
36,,SING,NB,C1B,yes,N,36,,94261,18828,HEC
37,,SING,NB,C4B,yes,N,37,,94261,18828,HEC
38,,DOUB,C1B,C2B,yes,N,38,,94261,18828,HEC
39,,SING,C2B,C3B,yes,N,39,,94261,18828,HEC
40,,SING,C2B,CMB,no,N,40,,94261,18828,HEC
41,,SING,C3B,C4B,yes,N,41,,94261,18828,HEC
42,,DOUB,C3B,CAB,no,E,42,,94261,18828,HEC
43,,SING,CMB,HMB1,no,N,43,,94261,18828,HEC
44,,SING,CMB,HMB2,no,N,44,,94261,18828,HEC
45,,SING,CMB,HMB3,no,N,45,,94261,18828,HEC
46,,SING,CAB,CBB,no,N,46,,94261,18828,HEC
47,,SING,CAB,HAB,no,N,47,,94261,18828,HEC
48,,SING,CBB,HBB1,no,N,48,,94261,18828,HEC
49,,SING,CBB,HBB2,no,N,49,,94261,18828,HEC
50,,SING,CBB,HBB3,no,N,50,,94261,18828,HEC
51,,SING,NC,C1C,yes,N,51,,94261,18828,HEC
52,,SING,NC,C4C,yes,N,52,,94261,18828,HEC
53,,DOUB,C1C,C2C,yes,N,53,,94261,18828,HEC
54,,SING,C2C,C3C,yes,N,54,,94261,18828,HEC
55,,SING,C2C,CMC,no,N,55,,94261,18828,HEC
56,,SING,C3C,C4C,yes,N,56,,94261,18828,HEC
57,,DOUB,C3C,CAC,no,E,57,,94261,18828,HEC
58,,SING,CMC,HMC1,no,N,58,,94261,18828,HEC
59,,SING,CMC,HMC2,no,N,59,,94261,18828,HEC
60,,SING,CMC,HMC3,no,N,60,,94261,18828,HEC
61,,SING,CAC,CBC,no,N,61,,94261,18828,HEC
62,,SING,CAC,HAC,no,N,62,,94261,18828,HEC
63,,SING,CBC,HBC1,no,N,63,,94261,18828,HEC
64,,SING,CBC,HBC2,no,N,64,,94261,18828,HEC
65,,SING,CBC,HBC3,no,N,65,,94261,18828,HEC
66,,SING,ND,C1D,yes,N,66,,94261,18828,HEC
67,,SING,ND,C4D,yes,N,67,,94261,18828,HEC
68,,DOUB,C1D,C2D,yes,N,68,,94261,18828,HEC
69,,SING,C2D,C3D,yes,N,69,,94261,18828,HEC
70,,SING,C2D,CMD,no,N,70,,94261,18828,HEC
71,,DOUB,C3D,C4D,yes,N,71,,94261,18828,HEC
72,,SING,C3D,CAD,no,N,72,,94261,18828,HEC
73,,SING,CMD,HMD1,no,N,73,,94261,18828,HEC
74,,SING,CMD,HMD2,no,N,74,,94261,18828,HEC
75,,SING,CMD,HMD3,no,N,75,,94261,18828,HEC
76,,SING,CAD,CBD,no,N,76,,94261,18828,HEC
3,,SING,C3,C4,,,,,240371,6145,TPLi
77,,SING,CAD,HAD1,no,N,77,,94261,18828,HEC
78,,SING,CAD,HAD2,no,N,78,,94261,18828,HEC
79,,SING,CBD,CGD,no,N,79,,94261,18828,HEC
80,,SING,CBD,HBD1,no,N,80,,94261,18828,HEC
81,,SING,CBD,HBD2,no,N,81,,94261,18828,HEC
82,,DOUB,CGD,O1D,no,N,82,,94261,18828,HEC
83,,SING,CGD,O2D,no,N,83,,94261,18828,HEC
84,,SING,O2D,H2D,no,N,84,,94261,18828,HEC
1,,SING,C1,C2,no,N,1,,94356,18833,33B
2,,SING,C1,H1,no,N,2,,94356,18833,33B
3,,SING,C1,H1A,no,N,3,,94356,18833,33B
4,,SING,C2,N3,no,N,4,,94356,18833,33B
5,,DOUB,O2,C2,no,N,5,,94356,18833,33B
6,,SING,N3,HN3,no,N,6,,94356,18833,33B
7,,SING,C4,N3,no,N,7,,94356,18833,33B
8,,SING,C4,C5,yes,N,8,,94356,18833,33B
9,,SING,C5,H5,no,N,9,,94356,18833,33B
10,,DOUB,C6,C4,yes,N,10,,94356,18833,33B
11,,SING,S6,C6,no,N,11,,94356,18833,33B
12,,SING,S6,O62,no,N,12,,94356,18833,33B
13,,DOUB,C7,C5,yes,N,13,,94356,18833,33B
14,,SING,C7,H7,no,N,14,,94356,18833,33B
15,,SING,C8,C6,yes,N,15,,94356,18833,33B
16,,DOUB,C8,C9,yes,N,16,,94356,18833,33B
17,,SING,C9,C7,yes,N,17,,94356,18833,33B
18,,SING,N10,C9,no,N,18,,94356,18833,33B
19,,DOUB,N10,N11,no,N,19,,94356,18833,33B
20,,SING,C12,N11,no,N,20,,94356,18833,33B
21,,SING,C12,C13,yes,N,21,,94356,18833,33B
22,,SING,C13,H13,no,N,22,,94356,18833,33B
23,,DOUB,C14,C12,yes,N,23,,94356,18833,33B
24,,DOUB,C15,C13,yes,N,24,,94356,18833,33B
25,,SING,C15,H15,no,N,25,,94356,18833,33B
26,,SING,C16,C14,yes,N,26,,94356,18833,33B
27,,DOUB,C16,C17,yes,N,27,,94356,18833,33B
28,,SING,C17,C15,yes,N,28,,94356,18833,33B
29,,SING,S17,C16,no,N,29,,94356,18833,33B
30,,SING,N18,C17,no,N,30,,94356,18833,33B
31,,SING,N18,C19,no,N,31,,94356,18833,33B
32,,DOUB,C19,O19,no,N,32,,94356,18833,33B
33,,SING,C20,C19,no,N,33,,94356,18833,33B
34,,SING,C20,CL2,no,N,34,,94356,18833,33B
35,,SING,C20,H20A,no,N,35,,94356,18833,33B
36,,DOUB,O61,S6,no,N,36,,94356,18833,33B
37,,SING,O62,HO62,no,N,37,,94356,18833,33B
38,,DOUB,O63,S6,no,N,38,,94356,18833,33B
39,,DOUB,O71,S17,no,N,39,,94356,18833,33B
40,,SING,O72,S17,no,N,40,,94356,18833,33B
41,,SING,O72,HO72,no,N,41,,94356,18833,33B
42,,DOUB,O73,S17,no,N,42,,94356,18833,33B
43,,SING,H8,C8,no,N,43,,94356,18833,33B
44,,SING,CL1,C1,no,N,44,,94356,18833,33B
45,,SING,H14,C14,no,N,45,,94356,18833,33B
46,,SING,HN18,N18,no,N,46,,94356,18833,33B
47,,SING,H20,C20,no,N,47,,94356,18833,33B
1,,SING,C1,C2,no,N,1,,94383,18834,33B
2,,SING,C1,H1,no,N,2,,94383,18834,33B
3,,SING,C1,H1A,no,N,3,,94383,18834,33B
4,,SING,C2,N3,no,N,4,,94383,18834,33B
5,,DOUB,O2,C2,no,N,5,,94383,18834,33B
6,,SING,N3,HN3,no,N,6,,94383,18834,33B
7,,SING,C4,N3,no,N,7,,94383,18834,33B
8,,SING,C4,C5,yes,N,8,,94383,18834,33B
9,,SING,C5,H5,no,N,9,,94383,18834,33B
10,,DOUB,C6,C4,yes,N,10,,94383,18834,33B
11,,SING,S6,C6,no,N,11,,94383,18834,33B
12,,SING,S6,O62,no,N,12,,94383,18834,33B
13,,DOUB,C7,C5,yes,N,13,,94383,18834,33B
14,,SING,C7,H7,no,N,14,,94383,18834,33B
15,,SING,C8,C6,yes,N,15,,94383,18834,33B
16,,DOUB,C8,C9,yes,N,16,,94383,18834,33B
17,,SING,C9,C7,yes,N,17,,94383,18834,33B
18,,SING,N10,C9,no,N,18,,94383,18834,33B
19,,DOUB,N10,N11,no,N,19,,94383,18834,33B
20,,SING,C12,N11,no,N,20,,94383,18834,33B
21,,SING,C12,C13,yes,N,21,,94383,18834,33B
22,,SING,C13,H13,no,N,22,,94383,18834,33B
23,,DOUB,C14,C12,yes,N,23,,94383,18834,33B
24,,DOUB,C15,C13,yes,N,24,,94383,18834,33B
25,,SING,C15,H15,no,N,25,,94383,18834,33B
26,,SING,C16,C14,yes,N,26,,94383,18834,33B
27,,DOUB,C16,C17,yes,N,27,,94383,18834,33B
28,,SING,C17,C15,yes,N,28,,94383,18834,33B
29,,SING,S17,C16,no,N,29,,94383,18834,33B
30,,SING,N18,C17,no,N,30,,94383,18834,33B
31,,SING,N18,C19,no,N,31,,94383,18834,33B
32,,DOUB,C19,O19,no,N,32,,94383,18834,33B
33,,SING,C20,C19,no,N,33,,94383,18834,33B
34,,SING,C20,CL2,no,N,34,,94383,18834,33B
35,,SING,C20,H20A,no,N,35,,94383,18834,33B
36,,DOUB,O61,S6,no,N,36,,94383,18834,33B
37,,SING,O62,HO62,no,N,37,,94383,18834,33B
38,,DOUB,O63,S6,no,N,38,,94383,18834,33B
39,,DOUB,O71,S17,no,N,39,,94383,18834,33B
40,,SING,O72,S17,no,N,40,,94383,18834,33B
41,,SING,O72,HO72,no,N,41,,94383,18834,33B
42,,DOUB,O73,S17,no,N,42,,94383,18834,33B
43,,SING,H8,C8,no,N,43,,94383,18834,33B
44,,SING,CL1,C1,no,N,44,,94383,18834,33B
45,,SING,H14,C14,no,N,45,,94383,18834,33B
46,,SING,HN18,N18,no,N,46,,94383,18834,33B
47,,SING,H20,C20,no,N,47,,94383,18834,33B
1,,SING,O3',C3',no,N,1,,94409,18835,D3N
2,,SING,C2',C3',no,N,2,,94409,18835,D3N
4,,SING,C3,C5,,,,,240371,6145,TPLi
3,,SING,C2',C1',no,N,3,,94409,18835,D3N
4,,SING,C3',C4',no,N,4,,94409,18835,D3N
5,,SING,C1',N1,no,N,5,,94409,18835,D3N
6,,SING,C1',O4',no,N,6,,94409,18835,D3N
7,,DOUB,O2,C2,no,N,7,,94409,18835,D3N
8,,SING,N1,C2,no,N,8,,94409,18835,D3N
9,,SING,N1,C6,no,N,9,,94409,18835,D3N
10,,SING,C2,N3,no,N,10,,94409,18835,D3N
11,,DOUB,C7,C6,yes,N,11,,94409,18835,D3N
12,,SING,C7,C8,yes,N,12,,94409,18835,D3N
13,,SING,C6,C5,yes,N,13,,94409,18835,D3N
14,,SING,C4',O4',no,N,14,,94409,18835,D3N
15,,SING,C4',C5',no,N,15,,94409,18835,D3N
16,,DOUB,C8,C9,yes,N,16,,94409,18835,D3N
17,,SING,N3,C4,no,N,17,,94409,18835,D3N
18,,DOUB,C5,C4,yes,N,18,,94409,18835,D3N
19,,SING,C5,C10,yes,N,19,,94409,18835,D3N
20,,SING,C4,C13,yes,N,20,,94409,18835,D3N
21,,SING,C9,C10,yes,N,21,,94409,18835,D3N
22,,DOUB,C10,C11,yes,N,22,,94409,18835,D3N
23,,DOUB,C13,C12,yes,N,23,,94409,18835,D3N
24,,SING,C5',O5',no,N,24,,94409,18835,D3N
25,,SING,C11,C12,yes,N,25,,94409,18835,D3N
26,,SING,O5',P,no,N,26,,94409,18835,D3N
27,,DOUB,O2P,P,no,N,27,,94409,18835,D3N
28,,SING,P,O1P,no,N,28,,94409,18835,D3N
29,,SING,O1P,H1,no,N,29,,94409,18835,D3N
30,,SING,C5',H3,no,N,30,,94409,18835,D3N
31,,SING,C5',H4,no,N,31,,94409,18835,D3N
32,,SING,C4',H5,no,N,32,,94409,18835,D3N
33,,SING,C3',H6,no,N,33,,94409,18835,D3N
34,,SING,O3',H7,no,N,34,,94409,18835,D3N
35,,SING,C2',H8,no,N,35,,94409,18835,D3N
36,,SING,C2',H9,no,N,36,,94409,18835,D3N
37,,SING,C1',H10,no,N,37,,94409,18835,D3N
38,,SING,N3,H11,no,N,38,,94409,18835,D3N
39,,SING,C7,H12,no,N,39,,94409,18835,D3N
40,,SING,C8,H13,no,N,40,,94409,18835,D3N
41,,SING,C9,H14,no,N,41,,94409,18835,D3N
42,,SING,C11,H15,no,N,42,,94409,18835,D3N
43,,SING,C12,H16,no,N,43,,94409,18835,D3N
44,,SING,C13,H17,no,N,44,,94409,18835,D3N
45,,SING,P,OP3,no,N,45,,94409,18835,D3N
46,,SING,OP3,H2,no,N,46,,94409,18835,D3N
1,,SING,C22,C20,no,N,1,,94639,18844,LL5
2,,SING,C22,H22,no,N,2,,94639,18844,LL5
3,,SING,C22,H22A,no,N,3,,94639,18844,LL5
4,,SING,C22,H22B,no,N,4,,94639,18844,LL5
5,,SING,C20,C19,no,N,5,,94639,18844,LL5
6,,SING,C20,C21,no,N,6,,94639,18844,LL5
7,,SING,C20,H20,no,N,7,,94639,18844,LL5
8,,SING,C21,H21,no,N,8,,94639,18844,LL5
9,,SING,C21,H21A,no,N,9,,94639,18844,LL5
10,,SING,C21,H21B,no,N,10,,94639,18844,LL5
11,,SING,C7,C19,no,N,11,,94639,18844,LL5
12,,SING,N33,C19,no,N,12,,94639,18844,LL5
13,,SING,C19,H19,no,N,13,,94639,18844,LL5
14,,SING,N33,HN33,no,N,14,,94639,18844,LL5
15,,SING,N33,HN3A,no,N,15,,94639,18844,LL5
16,,DOUB,O32,C7,no,N,16,,94639,18844,LL5
17,,SING,C7,N1,no,N,17,,94639,18844,LL5
18,,SING,C6,N1,no,N,18,,94639,18844,LL5
19,,SING,N1,C2,no,N,19,,94639,18844,LL5
20,,SING,C3,C2,no,N,20,,94639,18844,LL5
21,,SING,C2,H2,no,N,21,,94639,18844,LL5
22,,SING,C2,H2A,no,N,22,,94639,18844,LL5
23,,SING,C4,C3,no,N,23,,94639,18844,LL5
24,,SING,C3,H3,no,N,24,,94639,18844,LL5
25,,SING,C3,H3A,no,N,25,,94639,18844,LL5
26,,SING,C5,C6,no,N,26,,94639,18844,LL5
27,,SING,C6,H6,no,N,27,,94639,18844,LL5
28,,SING,C6,H6A,no,N,28,,94639,18844,LL5
29,,SING,C5,C4,no,N,29,,94639,18844,LL5
30,,SING,C5,H5,no,N,30,,94639,18844,LL5
31,,SING,C5,H5A,no,N,31,,94639,18844,LL5
32,,SING,C14,C4,no,N,32,,94639,18844,LL5
33,,SING,C4,H4,no,N,33,,94639,18844,LL5
34,,SING,O26,C14,yes,N,34,,94639,18844,LL5
35,,DOUB,C14,N23,yes,N,35,,94639,18844,LL5
36,,SING,C24,N23,yes,N,36,,94639,18844,LL5
37,,SING,N25,O26,yes,N,37,,94639,18844,LL5
38,,DOUB,N25,C24,yes,N,38,,94639,18844,LL5
39,,SING,C24,C27,yes,N,39,,94639,18844,LL5
40,,SING,S28,C27,yes,N,40,,94639,18844,LL5
41,,DOUB,C27,C31,yes,N,41,,94639,18844,LL5
42,,SING,C30,C31,yes,N,42,,94639,18844,LL5
43,,SING,C31,H31,no,N,43,,94639,18844,LL5
44,,DOUB,C29,C30,yes,N,44,,94639,18844,LL5
45,,SING,C30,H30,no,N,45,,94639,18844,LL5
46,,SING,S28,C29,yes,N,46,,94639,18844,LL5
47,,SING,C29,H29,no,N,47,,94639,18844,LL5
1,,SING,N,CA,no,N,1,,94750,1885,SET
2,,SING,N,H,no,N,2,,94750,1885,SET
3,,SING,N,H2,no,N,3,,94750,1885,SET
4,,SING,CA,CB,no,N,4,,94750,1885,SET
5,,SING,CA,C,no,N,5,,94750,1885,SET
6,,SING,CA,HA,no,N,6,,94750,1885,SET
7,,SING,CB,OG,no,N,7,,94750,1885,SET
8,,SING,CB,HB2,no,N,8,,94750,1885,SET
9,,SING,CB,HB3,no,N,9,,94750,1885,SET
10,,SING,OG,HG,no,N,10,,94750,1885,SET
11,,SING,NT,C,no,N,11,,94750,1885,SET
12,,SING,NT,HNT1,no,N,12,,94750,1885,SET
13,,SING,NT,HNT2,no,N,13,,94750,1885,SET
14,,DOUB,C,O,no,N,14,,94750,1885,SET
1,,SING,N,CA,no,N,1,,95005,1886,CY3
2,,SING,N,H,no,N,2,,95005,1886,CY3
3,,SING,N,H2,no,N,3,,95005,1886,CY3
4,,SING,CA,C,no,N,4,,95005,1886,CY3
5,,SING,CA,CB,no,N,5,,95005,1886,CY3
6,,SING,CA,HA,no,N,6,,95005,1886,CY3
7,,DOUB,C,O,no,N,7,,95005,1886,CY3
8,,SING,C,N1,no,N,8,,95005,1886,CY3
9,,SING,CB,SG,no,N,9,,95005,1886,CY3
10,,SING,CB,HB2,no,N,10,,95005,1886,CY3
11,,SING,CB,HB3,no,N,11,,95005,1886,CY3
12,,SING,SG,HG,no,N,12,,95005,1886,CY3
13,,SING,N1,HN11,no,N,13,,95005,1886,CY3
14,,SING,N1,HN12,no,N,14,,95005,1886,CY3
1,,DOUB,C,O,no,N,1,,95036,18861,ACE
2,,SING,C,CH3,no,N,2,,95036,18861,ACE
3,,SING,C,H,no,N,3,,95036,18861,ACE
4,,SING,CH3,H1,no,N,4,,95036,18861,ACE
5,,SING,CH3,H2,no,N,5,,95036,18861,ACE
6,,SING,CH3,H3,no,N,6,,95036,18861,ACE
1,,SING,N,CA,no,N,1,,95037,18861,AIB
2,,SING,N,H,no,N,2,,95037,18861,AIB
3,,SING,N,H2,no,N,3,,95037,18861,AIB
4,,SING,CA,C,no,N,4,,95037,18861,AIB
5,,SING,CA,CB1,no,N,5,,95037,18861,AIB
6,,SING,CA,CB2,no,N,6,,95037,18861,AIB
7,,DOUB,C,O,no,N,7,,95037,18861,AIB
8,,SING,C,OXT,no,N,8,,95037,18861,AIB
9,,SING,OXT,HO2,no,N,9,,95037,18861,AIB
10,,SING,CB1,HB11,no,N,10,,95037,18861,AIB
11,,SING,CB1,HB12,no,N,11,,95037,18861,AIB
12,,SING,CB1,HB13,no,N,12,,95037,18861,AIB
13,,SING,CB2,HB21,no,N,13,,95037,18861,AIB
14,,SING,CB2,HB22,no,N,14,,95037,18861,AIB
15,,SING,CB2,HB23,no,N,15,,95037,18861,AIB
1,,SING,N,CA,no,N,1,,95038,18861,DIV
2,,SING,N,H,no,N,2,,95038,18861,DIV
3,,SING,N,H2,no,N,3,,95038,18861,DIV
4,,SING,CA,CB1,no,N,4,,95038,18861,DIV
5,,SING,CA,CB2,no,N,5,,95038,18861,DIV
6,,SING,CA,C,no,N,6,,95038,18861,DIV
7,,SING,CB1,CG1,no,N,7,,95038,18861,DIV
8,,SING,CB1,HB11,no,N,8,,95038,18861,DIV
9,,SING,CB1,HB12,no,N,9,,95038,18861,DIV
10,,SING,CG1,HG11,no,N,10,,95038,18861,DIV
11,,SING,CG1,HG12,no,N,11,,95038,18861,DIV
12,,SING,CG1,HG13,no,N,12,,95038,18861,DIV
13,,SING,CB2,HB21,no,N,13,,95038,18861,DIV
14,,SING,CB2,HB22,no,N,14,,95038,18861,DIV
15,,SING,CB2,HB23,no,N,15,,95038,18861,DIV
16,,DOUB,C,O,no,N,16,,95038,18861,DIV
17,,SING,C,OXT,no,N,17,,95038,18861,DIV
18,,SING,OXT,HXT,no,N,18,,95038,18861,DIV
1,,SING,N,CA,no,N,1,,95039,18861,HYP
2,,SING,N,CD,no,N,2,,95039,18861,HYP
3,,SING,N,H,no,N,3,,95039,18861,HYP
4,,SING,CA,C,no,N,4,,95039,18861,HYP
5,,SING,CA,CB,no,N,5,,95039,18861,HYP
6,,SING,CA,HA,no,N,6,,95039,18861,HYP
7,,DOUB,C,O,no,N,7,,95039,18861,HYP
8,,SING,C,OXT,no,N,8,,95039,18861,HYP
9,,SING,CB,CG,no,N,9,,95039,18861,HYP
10,,SING,CB,HB2,no,N,10,,95039,18861,HYP
11,,SING,CB,HB3,no,N,11,,95039,18861,HYP
12,,SING,CG,CD,no,N,12,,95039,18861,HYP
13,,SING,CG,OD1,no,N,13,,95039,18861,HYP
14,,SING,CG,HG,no,N,14,,95039,18861,HYP
15,,SING,CD,HD22,no,N,15,,95039,18861,HYP
16,,SING,CD,HD23,no,N,16,,95039,18861,HYP
17,,SING,OD1,HD1,no,N,17,,95039,18861,HYP
18,,SING,OXT,HXT,no,N,18,,95039,18861,HYP
1,,SING,N,CA,no,N,1,,95040,18861,PHL
2,,SING,N,H,no,N,2,,95040,18861,PHL
3,,SING,N,H2,no,N,3,,95040,18861,PHL
4,,SING,CA,C,no,N,4,,95040,18861,PHL
5,,SING,CA,CB,no,N,5,,95040,18861,PHL
6,,SING,CA,HA,no,N,6,,95040,18861,PHL
7,,SING,C,O,no,N,7,,95040,18861,PHL
8,,SING,C,HC1,no,N,8,,95040,18861,PHL
9,,SING,C,HC2,no,N,9,,95040,18861,PHL
10,,SING,O,HO,no,N,10,,95040,18861,PHL
11,,SING,CB,CG,no,N,11,,95040,18861,PHL
12,,SING,CB,HB2,no,N,12,,95040,18861,PHL
13,,SING,CB,HB3,no,N,13,,95040,18861,PHL
14,,DOUB,CG,CD1,yes,N,14,,95040,18861,PHL
15,,SING,CG,CD2,yes,N,15,,95040,18861,PHL
16,,SING,CD1,CE1,yes,N,16,,95040,18861,PHL
17,,SING,CD1,HD1,no,N,17,,95040,18861,PHL
18,,DOUB,CD2,CE2,yes,N,18,,95040,18861,PHL
19,,SING,CD2,HD2,no,N,19,,95040,18861,PHL
20,,DOUB,CE1,CZ,yes,N,20,,95040,18861,PHL
21,,SING,CE1,HE1,no,N,21,,95040,18861,PHL
22,,SING,CE2,CZ,yes,N,22,,95040,18861,PHL
23,,SING,CE2,HE2,no,N,23,,95040,18861,PHL
24,,SING,CZ,HZ,no,N,24,,95040,18861,PHL
1,,SING,O3P,P,no,N,1,,95059,18862,GFL
2,,SING,O3P,HO3P,no,N,2,,95059,18862,GFL
3,,DOUB,P,O1P,no,N,3,,95059,18862,GFL
4,,SING,P,O2P,no,N,4,,95059,18862,GFL
5,,SING,P,O5',no,N,5,,95059,18862,GFL
6,,SING,O2P,HO2P,no,N,6,,95059,18862,GFL
7,,SING,O5',C5',no,N,7,,95059,18862,GFL
8,,SING,C5',C4',no,N,8,,95059,18862,GFL
9,,SING,C5',H5'1,no,N,9,,95059,18862,GFL
10,,SING,C5',H5'2,no,N,10,,95059,18862,GFL
5,,SING,C1,H11,,,,,240371,6145,TPLi
11,,SING,C4',O4',no,N,11,,95059,18862,GFL
12,,SING,C4',C3',no,N,12,,95059,18862,GFL
13,,SING,C4',H4',no,N,13,,95059,18862,GFL
14,,SING,O4',C1',no,N,14,,95059,18862,GFL
15,,SING,C3',O3',no,N,15,,95059,18862,GFL
16,,SING,C3',C2',no,N,16,,95059,18862,GFL
17,,SING,C3',H3',no,N,17,,95059,18862,GFL
18,,SING,O3',HO3',no,N,18,,95059,18862,GFL
19,,SING,C2',C1',no,N,19,,95059,18862,GFL
20,,SING,C2',F,no,N,20,,95059,18862,GFL
21,,SING,C2',H2',no,N,21,,95059,18862,GFL
22,,SING,C1',N9,no,N,22,,95059,18862,GFL
23,,SING,C1',H1',no,N,23,,95059,18862,GFL
24,,SING,N9,C8,yes,N,24,,95059,18862,GFL
25,,SING,N9,C4,yes,N,25,,95059,18862,GFL
26,,DOUB,C8,N7,yes,N,26,,95059,18862,GFL
27,,SING,C8,H8,no,N,27,,95059,18862,GFL
28,,SING,N7,C5,yes,N,28,,95059,18862,GFL
29,,SING,C5,C6,no,N,29,,95059,18862,GFL
30,,DOUB,C5,C4,yes,N,30,,95059,18862,GFL
31,,DOUB,C6,O6,no,N,31,,95059,18862,GFL
32,,SING,C6,N1,no,N,32,,95059,18862,GFL
33,,SING,N1,C2,no,N,33,,95059,18862,GFL
34,,SING,N1,HN1,no,N,34,,95059,18862,GFL
35,,SING,C2,N2,no,N,35,,95059,18862,GFL
36,,DOUB,C2,N3,no,N,36,,95059,18862,GFL
37,,SING,N2,HN21,no,N,37,,95059,18862,GFL
38,,SING,N2,HN22,no,N,38,,95059,18862,GFL
39,,SING,N3,C4,no,N,39,,95059,18862,GFL
1,,SING,N,CA,no,N,1,,95252,1887,CY3
2,,SING,N,H,no,N,2,,95252,1887,CY3
3,,SING,N,H2,no,N,3,,95252,1887,CY3
4,,SING,CA,C,no,N,4,,95252,1887,CY3
5,,SING,CA,CB,no,N,5,,95252,1887,CY3
6,,SING,CA,HA,no,N,6,,95252,1887,CY3
7,,DOUB,C,O,no,N,7,,95252,1887,CY3
8,,SING,C,N1,no,N,8,,95252,1887,CY3
9,,SING,CB,SG,no,N,9,,95252,1887,CY3
10,,SING,CB,HB2,no,N,10,,95252,1887,CY3
11,,SING,CB,HB3,no,N,11,,95252,1887,CY3
12,,SING,SG,HG,no,N,12,,95252,1887,CY3
13,,SING,N1,HN11,no,N,13,,95252,1887,CY3
14,,SING,N1,HN12,no,N,14,,95252,1887,CY3
1,,SING,C1,C2,no,N,1,,95319,18873,NAG
2,,SING,C1,O1,no,N,2,,95319,18873,NAG
3,,SING,C1,O5,no,N,3,,95319,18873,NAG
4,,SING,C1,H1,no,N,4,,95319,18873,NAG
5,,SING,C2,C3,no,N,5,,95319,18873,NAG
6,,SING,C2,N2,no,N,6,,95319,18873,NAG
7,,SING,C2,H2,no,N,7,,95319,18873,NAG
8,,SING,C3,C4,no,N,8,,95319,18873,NAG
9,,SING,C3,O3,no,N,9,,95319,18873,NAG
10,,SING,C3,H3,no,N,10,,95319,18873,NAG
11,,SING,C4,C5,no,N,11,,95319,18873,NAG
12,,SING,C4,O4,no,N,12,,95319,18873,NAG
13,,SING,C4,H4,no,N,13,,95319,18873,NAG
14,,SING,C5,C6,no,N,14,,95319,18873,NAG
15,,SING,C5,O5,no,N,15,,95319,18873,NAG
16,,SING,C5,H5,no,N,16,,95319,18873,NAG
17,,SING,C6,O6,no,N,17,,95319,18873,NAG
18,,SING,C6,H61,no,N,18,,95319,18873,NAG
19,,SING,C6,H62,no,N,19,,95319,18873,NAG
20,,SING,C7,C8,no,N,20,,95319,18873,NAG
21,,SING,C7,N2,no,N,21,,95319,18873,NAG
22,,DOUB,C7,O7,no,N,22,,95319,18873,NAG
23,,SING,C8,H81,no,N,23,,95319,18873,NAG
24,,SING,C8,H82,no,N,24,,95319,18873,NAG
25,,SING,C8,H83,no,N,25,,95319,18873,NAG
26,,SING,N2,HN2,no,N,26,,95319,18873,NAG
27,,SING,O1,HO1,no,N,27,,95319,18873,NAG
28,,SING,O3,HO3,no,N,28,,95319,18873,NAG
29,,SING,O4,HO4,no,N,29,,95319,18873,NAG
30,,SING,O6,HO6,no,N,30,,95319,18873,NAG
1,,SING,C1,C2,no,N,1,,95320,18873,GAL
2,,SING,C1,O1,no,N,2,,95320,18873,GAL
3,,SING,C1,O5,no,N,3,,95320,18873,GAL
4,,SING,C1,H1,no,N,4,,95320,18873,GAL
5,,SING,C2,C3,no,N,5,,95320,18873,GAL
6,,SING,C2,O2,no,N,6,,95320,18873,GAL
7,,SING,C2,H2,no,N,7,,95320,18873,GAL
8,,SING,C3,C4,no,N,8,,95320,18873,GAL
9,,SING,C3,O3,no,N,9,,95320,18873,GAL
10,,SING,C3,H3,no,N,10,,95320,18873,GAL
11,,SING,C4,C5,no,N,11,,95320,18873,GAL
12,,SING,C4,O4,no,N,12,,95320,18873,GAL
13,,SING,C4,H4,no,N,13,,95320,18873,GAL
14,,SING,C5,C6,no,N,14,,95320,18873,GAL
15,,SING,C5,O5,no,N,15,,95320,18873,GAL
16,,SING,C5,H5,no,N,16,,95320,18873,GAL
17,,SING,C6,O6,no,N,17,,95320,18873,GAL
18,,SING,C6,H61,no,N,18,,95320,18873,GAL
19,,SING,C6,H62,no,N,19,,95320,18873,GAL
20,,SING,O1,HO1,no,N,20,,95320,18873,GAL
21,,SING,O2,HO2,no,N,21,,95320,18873,GAL
22,,SING,O3,HO3,no,N,22,,95320,18873,GAL
23,,SING,O4,HO4,no,N,23,,95320,18873,GAL
24,,SING,O6,HO6,no,N,24,,95320,18873,GAL
1,,SING,C1,C2,no,N,1,,95321,18873,FUC
2,,SING,C1,O1,no,N,2,,95321,18873,FUC
3,,SING,C1,O5,no,N,3,,95321,18873,FUC
4,,SING,C1,H1,no,N,4,,95321,18873,FUC
5,,SING,C2,C3,no,N,5,,95321,18873,FUC
6,,SING,C2,O2,no,N,6,,95321,18873,FUC
7,,SING,C2,H2,no,N,7,,95321,18873,FUC
8,,SING,C3,C4,no,N,8,,95321,18873,FUC
9,,SING,C3,O3,no,N,9,,95321,18873,FUC
10,,SING,C3,H3,no,N,10,,95321,18873,FUC
11,,SING,C4,C5,no,N,11,,95321,18873,FUC
12,,SING,C4,O4,no,N,12,,95321,18873,FUC
13,,SING,C4,H4,no,N,13,,95321,18873,FUC
14,,SING,C5,C6,no,N,14,,95321,18873,FUC
15,,SING,C5,O5,no,N,15,,95321,18873,FUC
16,,SING,C5,H5,no,N,16,,95321,18873,FUC
17,,SING,C6,H61,no,N,17,,95321,18873,FUC
18,,SING,C6,H62,no,N,18,,95321,18873,FUC
19,,SING,C6,H63,no,N,19,,95321,18873,FUC
20,,SING,O1,HO1,no,N,20,,95321,18873,FUC
21,,SING,O2,HO2,no,N,21,,95321,18873,FUC
22,,SING,O3,HO3,no,N,22,,95321,18873,FUC
23,,SING,O4,HO4,no,N,23,,95321,18873,FUC
1,,DOUB,C,O,no,N,1,,95322,18873,ACY
2,,SING,C,OXT,no,N,2,,95322,18873,ACY
3,,SING,C,CH3,no,N,3,,95322,18873,ACY
4,,SING,OXT,HXT,no,N,4,,95322,18873,ACY
5,,SING,CH3,H1,no,N,5,,95322,18873,ACY
6,,SING,CH3,H2,no,N,6,,95322,18873,ACY
7,,SING,CH3,H3,no,N,7,,95322,18873,ACY
1,,SING,N,CA,no,N,1,,95361,18875,ABU
2,,SING,N,H,no,N,2,,95361,18875,ABU
3,,SING,N,HN2,no,N,3,,95361,18875,ABU
4,,SING,CA,CB,no,N,4,,95361,18875,ABU
5,,SING,CA,HA1,no,N,5,,95361,18875,ABU
6,,SING,CA,HA2,no,N,6,,95361,18875,ABU
7,,SING,CB,CG,no,N,7,,95361,18875,ABU
8,,SING,CB,HB1,no,N,8,,95361,18875,ABU
9,,SING,CB,HB2,no,N,9,,95361,18875,ABU
10,,SING,CG,CD,no,N,10,,95361,18875,ABU
11,,SING,CG,HG1,no,N,11,,95361,18875,ABU
12,,SING,CG,HG2,no,N,12,,95361,18875,ABU
13,,DOUB,CD,OE1,no,N,13,,95361,18875,ABU
14,,SING,CD,OE2,no,N,14,,95361,18875,ABU
15,,SING,OE2,HE2,no,N,15,,95361,18875,ABU
1,,SING,O,C5,no,N,1,,95826,18897,A2G
2,,SING,C1,O,no,N,2,,95826,18897,A2G
3,,SING,C1,C2,no,N,3,,95826,18897,A2G
4,,SING,C1,H1,no,N,4,,95826,18897,A2G
5,,SING,O1,C1,no,N,5,,95826,18897,A2G
6,,SING,O1,HO1,no,N,6,,95826,18897,A2G
7,,SING,C2,C3,no,N,7,,95826,18897,A2G
8,,SING,C2,H2,no,N,8,,95826,18897,A2G
9,,SING,N2,C2,no,N,9,,95826,18897,A2G
10,,SING,N2,HN2,no,N,10,,95826,18897,A2G
11,,SING,C3,C4,no,N,11,,95826,18897,A2G
12,,SING,C3,O3,no,N,12,,95826,18897,A2G
13,,SING,C3,H3,no,N,13,,95826,18897,A2G
14,,SING,O3,HO3,no,N,14,,95826,18897,A2G
15,,SING,C4,O4,no,N,15,,95826,18897,A2G
16,,SING,C4,H4,no,N,16,,95826,18897,A2G
17,,SING,O4,HO4,no,N,17,,95826,18897,A2G
18,,SING,C5,C4,no,N,18,,95826,18897,A2G
19,,SING,C5,C6,no,N,19,,95826,18897,A2G
20,,SING,C5,H5,no,N,20,,95826,18897,A2G
21,,SING,C6,O6,no,N,21,,95826,18897,A2G
22,,SING,C6,H6,no,N,22,,95826,18897,A2G
23,,SING,C7,N2,no,N,23,,95826,18897,A2G
24,,DOUB,O7,C7,no,N,24,,95826,18897,A2G
25,,SING,C8,C7,no,N,25,,95826,18897,A2G
26,,SING,C8,H8,no,N,26,,95826,18897,A2G
27,,SING,C8,H8A,no,N,27,,95826,18897,A2G
28,,SING,C8,H8B,no,N,28,,95826,18897,A2G
29,,SING,C6,H14,no,N,29,,95826,18897,A2G
30,,SING,O6,H15,no,N,30,,95826,18897,A2G
1,,SING,C1,C2,no,N,1,,95827,18897,NDG
2,,SING,C1,O,no,N,2,,95827,18897,NDG
3,,SING,C1,O1L,no,N,3,,95827,18897,NDG
4,,SING,C1,H1,no,N,4,,95827,18897,NDG
5,,SING,C2,C3,no,N,5,,95827,18897,NDG
6,,SING,C2,N2,no,N,6,,95827,18897,NDG
7,,SING,C2,H2,no,N,7,,95827,18897,NDG
8,,SING,C3,C4,no,N,8,,95827,18897,NDG
9,,SING,C3,O3,no,N,9,,95827,18897,NDG
10,,SING,C3,H3,no,N,10,,95827,18897,NDG
11,,SING,C4,C5,no,N,11,,95827,18897,NDG
12,,SING,C4,O4,no,N,12,,95827,18897,NDG
13,,SING,C4,H4,no,N,13,,95827,18897,NDG
14,,SING,C5,C6,no,N,14,,95827,18897,NDG
15,,SING,C5,O,no,N,15,,95827,18897,NDG
16,,SING,C5,H5,no,N,16,,95827,18897,NDG
17,,SING,C6,O6,no,N,17,,95827,18897,NDG
18,,SING,C6,H6C1,no,N,18,,95827,18897,NDG
19,,SING,C6,H6C2,no,N,19,,95827,18897,NDG
20,,SING,C7,C8,no,N,20,,95827,18897,NDG
21,,DOUB,C7,O7,no,N,21,,95827,18897,NDG
22,,SING,C7,N2,no,N,22,,95827,18897,NDG
23,,SING,C8,H8C1,no,N,23,,95827,18897,NDG
24,,SING,C8,H8C2,no,N,24,,95827,18897,NDG
25,,SING,C8,H8C3,no,N,25,,95827,18897,NDG
26,,SING,O3,HB,no,N,26,,95827,18897,NDG
27,,SING,O4,HC,no,N,27,,95827,18897,NDG
28,,SING,O6,H6,no,N,28,,95827,18897,NDG
29,,SING,N2,HA,no,N,29,,95827,18897,NDG
30,,SING,O1L,H1L,no,N,30,,95827,18897,NDG
1,,SING,C1,C2,no,N,1,,95828,18897,GXL
2,,SING,C1,O1,no,N,2,,95828,18897,GXL
3,,SING,C1,O5,no,N,3,,95828,18897,GXL
4,,SING,C1,H1,no,N,4,,95828,18897,GXL
5,,SING,C2,C3,no,N,5,,95828,18897,GXL
6,,SING,C2,O2,no,N,6,,95828,18897,GXL
7,,SING,C2,HA,no,N,7,,95828,18897,GXL
8,,SING,C3,C4,no,N,8,,95828,18897,GXL
9,,SING,C3,O3,no,N,9,,95828,18897,GXL
10,,SING,C3,H3,no,N,10,,95828,18897,GXL
11,,SING,C4,C5,no,N,11,,95828,18897,GXL
12,,SING,C4,O4,no,N,12,,95828,18897,GXL
13,,SING,C4,H4,no,N,13,,95828,18897,GXL
14,,SING,C5,C6,no,N,14,,95828,18897,GXL
15,,SING,C5,O5,no,N,15,,95828,18897,GXL
16,,SING,C5,H5,no,N,16,,95828,18897,GXL
17,,SING,C6,O6,no,N,17,,95828,18897,GXL
18,,SING,C6,H6C1,no,N,18,,95828,18897,GXL
19,,SING,C6,H6C2,no,N,19,,95828,18897,GXL
20,,SING,O1,HB,no,N,20,,95828,18897,GXL
21,,SING,O2,H2,no,N,21,,95828,18897,GXL
22,,SING,O3,HC,no,N,22,,95828,18897,GXL
23,,SING,O4,HD,no,N,23,,95828,18897,GXL
24,,SING,O6,H6,no,N,24,,95828,18897,GXL
1,,SING,C1,C2,no,N,1,,95829,18897,GAL
2,,SING,C1,O1,no,N,2,,95829,18897,GAL
3,,SING,C1,O5,no,N,3,,95829,18897,GAL
4,,SING,C1,H1,no,N,4,,95829,18897,GAL
5,,SING,C2,C3,no,N,5,,95829,18897,GAL
6,,SING,C2,O2,no,N,6,,95829,18897,GAL
7,,SING,C2,H2,no,N,7,,95829,18897,GAL
8,,SING,C3,C4,no,N,8,,95829,18897,GAL
9,,SING,C3,O3,no,N,9,,95829,18897,GAL
10,,SING,C3,H3,no,N,10,,95829,18897,GAL
11,,SING,C4,C5,no,N,11,,95829,18897,GAL
12,,SING,C4,O4,no,N,12,,95829,18897,GAL
13,,SING,C4,H4,no,N,13,,95829,18897,GAL
14,,SING,C5,C6,no,N,14,,95829,18897,GAL
15,,SING,C5,O5,no,N,15,,95829,18897,GAL
16,,SING,C5,H5,no,N,16,,95829,18897,GAL
17,,SING,C6,O6,no,N,17,,95829,18897,GAL
18,,SING,C6,H61,no,N,18,,95829,18897,GAL
19,,SING,C6,H62,no,N,19,,95829,18897,GAL
20,,SING,O1,HO1,no,N,20,,95829,18897,GAL
21,,SING,O2,HO2,no,N,21,,95829,18897,GAL
22,,SING,O3,HO3,no,N,22,,95829,18897,GAL
23,,SING,O4,HO4,no,N,23,,95829,18897,GAL
24,,SING,O6,HO6,no,N,24,,95829,18897,GAL
1,,SING,N,CA,no,N,1,,95830,18897,HYP
2,,SING,N,CD,no,N,2,,95830,18897,HYP
3,,SING,N,H,no,N,3,,95830,18897,HYP
4,,SING,CA,C,no,N,4,,95830,18897,HYP
5,,SING,CA,CB,no,N,5,,95830,18897,HYP
6,,SING,CA,HA,no,N,6,,95830,18897,HYP
7,,DOUB,C,O,no,N,7,,95830,18897,HYP
8,,SING,C,OXT,no,N,8,,95830,18897,HYP
9,,SING,CB,CG,no,N,9,,95830,18897,HYP
10,,SING,CB,HB2,no,N,10,,95830,18897,HYP
11,,SING,CB,HB3,no,N,11,,95830,18897,HYP
12,,SING,CG,CD,no,N,12,,95830,18897,HYP
13,,SING,CG,OD1,no,N,13,,95830,18897,HYP
14,,SING,CG,HG,no,N,14,,95830,18897,HYP
15,,SING,CD,HD22,no,N,15,,95830,18897,HYP
16,,SING,CD,HD23,no,N,16,,95830,18897,HYP
17,,SING,OD1,HD1,no,N,17,,95830,18897,HYP
18,,SING,OXT,HXT,no,N,18,,95830,18897,HYP
1,,DOUB,C,O,no,N,1,,96118,18911,1RG
2,,SING,C,CA,no,N,2,,96118,18911,1RG
3,,SING,C,NAX,no,N,3,,96118,18911,1RG
4,,SING,N,CA,no,N,4,,96118,18911,1RG
5,,SING,N,CD,no,N,5,,96118,18911,1RG
6,,SING,CA,CB,no,N,6,,96118,18911,1RG
7,,SING,CB,CG,no,N,7,,96118,18911,1RG
8,,SING,CD,CG,no,N,8,,96118,18911,1RG
9,,SING,CG,SAK,no,N,9,,96118,18911,1RG
10,,SING,CAA,CAB,no,N,10,,96118,18911,1RG
11,,DOUB,CAA,OAC,no,N,11,,96118,18911,1RG
12,,SING,CAB,CAD,no,N,12,,96118,18911,1RG
13,,SING,CAB,CAE,no,N,13,,96118,18911,1RG
14,,SING,CAD,CAH,no,N,14,,96118,18911,1RG
15,,SING,CAD,NAJ,no,N,15,,96118,18911,1RG
16,,SING,CAE,CAF,no,N,16,,96118,18911,1RG
17,,SING,CAE,OAG,no,N,17,,96118,18911,1RG
18,,SING,CAH,CAI,no,N,18,,96118,18911,1RG
19,,SING,CAH,CAS,no,N,19,,96118,18911,1RG
20,,SING,CAI,SAK,no,N,20,,96118,18911,1RG
21,,DOUB,CAI,CAL,no,N,21,,96118,18911,1RG
22,,SING,NAJ,CAL,no,N,22,,96118,18911,1RG
23,,SING,CAL,CAM,no,N,23,,96118,18911,1RG
24,,DOUB,CAM,OAT,no,N,24,,96118,18911,1RG
25,,SING,CAM,OAU,no,N,25,,96118,18911,1RG
26,,SING,NAX,CAY,no,N,26,,96118,18911,1RG
27,,DOUB,CAY,CAZ,yes,N,27,,96118,18911,1RG
28,,SING,CAY,CBD,yes,N,28,,96118,18911,1RG
29,,SING,CAZ,CBA,yes,N,29,,96118,18911,1RG
30,,DOUB,CBA,CBB,yes,N,30,,96118,18911,1RG
31,,SING,CBA,CBE,no,N,31,,96118,18911,1RG
32,,SING,CBB,CBC,yes,N,32,,96118,18911,1RG
33,,DOUB,CBC,CBD,yes,N,33,,96118,18911,1RG
34,,SING,CBE,OBF,no,N,34,,96118,18911,1RG
35,,DOUB,CBE,OBG,no,N,35,,96118,18911,1RG
36,,SING,N,HN,no,N,36,,96118,18911,1RG
37,,SING,CA,HA,no,N,37,,96118,18911,1RG
38,,SING,CB,HB,no,N,38,,96118,18911,1RG
39,,SING,CB,HBA,no,N,39,,96118,18911,1RG
40,,SING,CD,HD,no,N,40,,96118,18911,1RG
41,,SING,CD,HDA,no,N,41,,96118,18911,1RG
42,,SING,CG,HG,no,N,42,,96118,18911,1RG
43,,SING,CAA,HAA,no,N,43,,96118,18911,1RG
44,,SING,CAB,HAB,no,N,44,,96118,18911,1RG
45,,SING,CAD,HAD,no,N,45,,96118,18911,1RG
46,,SING,CAE,HAE,no,N,46,,96118,18911,1RG
47,,SING,CAF,HAF,no,N,47,,96118,18911,1RG
48,,SING,CAF,HAFA,no,N,48,,96118,18911,1RG
49,,SING,CAF,HAFB,no,N,49,,96118,18911,1RG
50,,SING,OAG,HOAG,no,N,50,,96118,18911,1RG
51,,SING,CAH,HAH,no,N,51,,96118,18911,1RG
52,,SING,NAJ,HNAJ,no,N,52,,96118,18911,1RG
53,,SING,CAS,HAS,no,N,53,,96118,18911,1RG
54,,SING,CAS,HASA,no,N,54,,96118,18911,1RG
55,,SING,CAS,HASB,no,N,55,,96118,18911,1RG
56,,SING,NAX,HNAX,no,N,56,,96118,18911,1RG
57,,SING,CAZ,HAZ,no,N,57,,96118,18911,1RG
58,,SING,CBB,HBB,no,N,58,,96118,18911,1RG
59,,SING,CBC,HBC,no,N,59,,96118,18911,1RG
60,,SING,CBD,HBD,no,N,60,,96118,18911,1RG
61,,SING,OAU,HOAU,no,N,61,,96118,18911,1RG
62,,SING,OBF,HOBF,no,N,62,,96118,18911,1RG
1,,SING,N,CA,no,N,1,,96156,18913,ABA
2,,SING,N,H,no,N,2,,96156,18913,ABA
3,,SING,N,HN2,no,N,3,,96156,18913,ABA
4,,SING,CA,C,no,N,4,,96156,18913,ABA
5,,SING,CA,CB,no,N,5,,96156,18913,ABA
6,,SING,CA,HA,no,N,6,,96156,18913,ABA
7,,DOUB,C,O,no,N,7,,96156,18913,ABA
8,,SING,C,OXT,no,N,8,,96156,18913,ABA
9,,SING,CB,CG,no,N,9,,96156,18913,ABA
10,,SING,CB,HB3,no,N,10,,96156,18913,ABA
11,,SING,CB,HB2,no,N,11,,96156,18913,ABA
12,,SING,CG,HG1,no,N,12,,96156,18913,ABA
13,,SING,CG,HG3,no,N,13,,96156,18913,ABA
14,,SING,CG,HG2,no,N,14,,96156,18913,ABA
15,,SING,OXT,HXT,no,N,15,,96156,18913,ABA
1,,SING,N,CA,no,N,1,,96176,18914,ABA
2,,SING,N,H,no,N,2,,96176,18914,ABA
3,,SING,N,HN2,no,N,3,,96176,18914,ABA
4,,SING,CA,C,no,N,4,,96176,18914,ABA
5,,SING,CA,CB,no,N,5,,96176,18914,ABA
6,,SING,CA,HA,no,N,6,,96176,18914,ABA
7,,DOUB,C,O,no,N,7,,96176,18914,ABA
8,,SING,C,OXT,no,N,8,,96176,18914,ABA
9,,SING,CB,CG,no,N,9,,96176,18914,ABA
10,,SING,CB,HB3,no,N,10,,96176,18914,ABA
11,,SING,CB,HB2,no,N,11,,96176,18914,ABA
12,,SING,CG,HG1,no,N,12,,96176,18914,ABA
13,,SING,CG,HG3,no,N,13,,96176,18914,ABA
14,,SING,CG,HG2,no,N,14,,96176,18914,ABA
15,,SING,OXT,HXT,no,N,15,,96176,18914,ABA
1,,SING,FE,NA,no,N,1,,96274,18919,HEB
2,,SING,FE,NB,no,N,2,,96274,18919,HEB
3,,SING,FE,NC,no,N,3,,96274,18919,HEB
4,,SING,FE,ND,no,N,4,,96274,18919,HEB
5,,DOUB,CHA,C1A,yes,N,5,,96274,18919,HEB
6,,SING,CHA,C4D,yes,N,6,,96274,18919,HEB
7,,SING,CHA,HHA,no,N,7,,96274,18919,HEB
8,,DOUB,CHB,C4A,yes,N,8,,96274,18919,HEB
9,,SING,CHB,C1B,yes,N,9,,96274,18919,HEB
10,,SING,CHB,HHB,no,N,10,,96274,18919,HEB
11,,DOUB,CHC,C4B,yes,N,11,,96274,18919,HEB
12,,SING,CHC,C1C,yes,N,12,,96274,18919,HEB
13,,SING,CHC,HHC,no,N,13,,96274,18919,HEB
14,,SING,CHD,C4C,yes,N,14,,96274,18919,HEB
15,,DOUB,CHD,C1D,yes,N,15,,96274,18919,HEB
16,,SING,CHD,HHD,no,N,16,,96274,18919,HEB
17,,SING,NA,C1A,yes,N,17,,96274,18919,HEB
18,,SING,NA,C4A,yes,N,18,,96274,18919,HEB
19,,SING,C1A,C2A,yes,N,19,,96274,18919,HEB
20,,DOUB,C2A,C3A,yes,N,20,,96274,18919,HEB
21,,SING,C2A,CAA,no,N,21,,96274,18919,HEB
22,,SING,C3A,C4A,yes,N,22,,96274,18919,HEB
23,,SING,C3A,CMA,no,N,23,,96274,18919,HEB
24,,SING,CMA,HMA1,no,N,24,,96274,18919,HEB
25,,SING,CMA,HMA2,no,N,25,,96274,18919,HEB
26,,SING,CMA,HMA3,no,N,26,,96274,18919,HEB
27,,SING,CAA,CBA,no,N,27,,96274,18919,HEB
28,,SING,CAA,HAA1,no,N,28,,96274,18919,HEB
29,,SING,CAA,HAA2,no,N,29,,96274,18919,HEB
30,,SING,CBA,CGA,no,N,30,,96274,18919,HEB
31,,SING,CBA,HBA1,no,N,31,,96274,18919,HEB
32,,SING,CBA,HBA2,no,N,32,,96274,18919,HEB
33,,DOUB,CGA,O1A,no,N,33,,96274,18919,HEB
34,,SING,CGA,O2A,no,N,34,,96274,18919,HEB
35,,SING,O2A,H2A,no,N,35,,96274,18919,HEB
36,,DOUB,NB,C1B,yes,N,36,,96274,18919,HEB
37,,SING,NB,C4B,yes,N,37,,96274,18919,HEB
38,,SING,C1B,C2B,no,N,38,,96274,18919,HEB
39,,DOUB,C2B,C3B,no,N,39,,96274,18919,HEB
40,,SING,C2B,CMB,no,N,40,,96274,18919,HEB
41,,SING,C3B,C4B,no,N,41,,96274,18919,HEB
42,,SING,C3B,CAB,no,N,42,,96274,18919,HEB
43,,SING,CMB,HMB1,no,N,43,,96274,18919,HEB
44,,SING,CMB,HMB2,no,N,44,,96274,18919,HEB
45,,SING,CMB,HMB3,no,N,45,,96274,18919,HEB
46,,SING,CAB,CBB,no,N,46,,96274,18919,HEB
47,,SING,CAB,HAB,no,N,47,,96274,18919,HEB
48,,SING,CAB,HAB2,no,N,48,,96274,18919,HEB
49,,SING,CBB,HBB1,no,N,49,,96274,18919,HEB
50,,SING,CBB,HBB2,no,N,50,,96274,18919,HEB
51,,SING,CBB,HBB3,no,N,51,,96274,18919,HEB
52,,SING,NC,C1C,yes,N,52,,96274,18919,HEB
53,,SING,NC,C4C,yes,N,53,,96274,18919,HEB
54,,DOUB,C1C,C2C,yes,N,54,,96274,18919,HEB
55,,SING,C2C,C3C,yes,N,55,,96274,18919,HEB
56,,SING,C2C,CMC,no,N,56,,96274,18919,HEB
57,,DOUB,C3C,C4C,yes,N,57,,96274,18919,HEB
58,,SING,C3C,CAC,no,N,58,,96274,18919,HEB
59,,SING,CMC,HMC1,no,N,59,,96274,18919,HEB
60,,SING,CMC,HMC2,no,N,60,,96274,18919,HEB
61,,SING,CMC,HMC3,no,N,61,,96274,18919,HEB
62,,DOUB,CAC,CBC,no,N,62,,96274,18919,HEB
63,,SING,CAC,HAC,no,N,63,,96274,18919,HEB
64,,SING,CBC,HBC1,no,N,64,,96274,18919,HEB
65,,SING,CBC,HBC2,no,N,65,,96274,18919,HEB
66,,SING,ND,C1D,yes,N,66,,96274,18919,HEB
67,,DOUB,ND,C4D,yes,N,67,,96274,18919,HEB
68,,SING,C1D,C2D,no,N,68,,96274,18919,HEB
69,,DOUB,C2D,C3D,no,N,69,,96274,18919,HEB
70,,SING,C2D,CMD,no,N,70,,96274,18919,HEB
71,,SING,C3D,C4D,no,N,71,,96274,18919,HEB
72,,SING,C3D,CAD,no,N,72,,96274,18919,HEB
73,,SING,CMD,HMD1,no,N,73,,96274,18919,HEB
74,,SING,CMD,HMD2,no,N,74,,96274,18919,HEB
75,,SING,CMD,HMD3,no,N,75,,96274,18919,HEB
76,,SING,CAD,CBD,no,N,76,,96274,18919,HEB
77,,SING,CAD,HAD1,no,N,77,,96274,18919,HEB
78,,SING,CAD,HAD2,no,N,78,,96274,18919,HEB
79,,SING,CBD,CGD,no,N,79,,96274,18919,HEB
80,,SING,CBD,HBD1,no,N,80,,96274,18919,HEB
81,,SING,CBD,HBD2,no,N,81,,96274,18919,HEB
82,,DOUB,CGD,O1D,no,N,82,,96274,18919,HEB
83,,SING,CGD,O2D,no,N,83,,96274,18919,HEB
84,,SING,O2D,H2D,no,N,84,,96274,18919,HEB
1,,SING,N,C5,no,N,1,,96458,18929,DPV
2,,SING,N,C6,no,N,2,,96458,18929,DPV
3,,SING,N,C7,no,N,3,,96458,18929,DPV
4,,SING,N,C8,no,N,4,,96458,18929,DPV
5,,SING,P,O1P,no,N,5,,96458,18929,DPV
6,,DOUB,P,O2P,no,N,6,,96458,18929,DPV
7,,SING,P,O3P,no,N,7,,96458,18929,DPV
8,,SING,P,O4P,no,N,8,,96458,18929,DPV
9,,SING,C1,C2,no,N,9,,96458,18929,DPV
10,,SING,C1,O3P,no,N,10,,96458,18929,DPV
11,,SING,C2,C3,no,N,11,,96458,18929,DPV
12,,SING,C3,C15,no,N,12,,96458,18929,DPV
13,,SING,C4,C5,no,N,13,,96458,18929,DPV
14,,SING,C4,O4P,no,N,14,,96458,18929,DPV
15,,SING,C15,C16,no,N,15,,96458,18929,DPV
16,,SING,C16,C17,no,N,16,,96458,18929,DPV
17,,SING,C17,C18,no,N,17,,96458,18929,DPV
18,,SING,C18,C19,no,N,18,,96458,18929,DPV
19,,SING,C19,C20,no,N,19,,96458,18929,DPV
20,,SING,C20,C21,no,N,20,,96458,18929,DPV
21,,SING,C21,C22,no,N,21,,96458,18929,DPV
22,,SING,C22,C23,no,N,22,,96458,18929,DPV
23,,SING,C1,H1,no,N,23,,96458,18929,DPV
24,,SING,C1,H1A,no,N,24,,96458,18929,DPV
25,,SING,C2,H2,no,N,25,,96458,18929,DPV
26,,SING,C2,H2A,no,N,26,,96458,18929,DPV
27,,SING,C3,H3,no,N,27,,96458,18929,DPV
28,,SING,C3,H3A,no,N,28,,96458,18929,DPV
29,,SING,C4,H4,no,N,29,,96458,18929,DPV
30,,SING,C4,H4A,no,N,30,,96458,18929,DPV
31,,SING,C5,H5,no,N,31,,96458,18929,DPV
32,,SING,C5,H5A,no,N,32,,96458,18929,DPV
33,,SING,C6,H6,no,N,33,,96458,18929,DPV
34,,SING,C6,H6A,no,N,34,,96458,18929,DPV
35,,SING,C6,H6B,no,N,35,,96458,18929,DPV
36,,SING,C7,H7,no,N,36,,96458,18929,DPV
37,,SING,C7,H7A,no,N,37,,96458,18929,DPV
38,,SING,C7,H7B,no,N,38,,96458,18929,DPV
39,,SING,C8,H8,no,N,39,,96458,18929,DPV
40,,SING,C8,H8A,no,N,40,,96458,18929,DPV
41,,SING,C8,H8B,no,N,41,,96458,18929,DPV
42,,SING,C15,H15,no,N,42,,96458,18929,DPV
43,,SING,C15,H15A,no,N,43,,96458,18929,DPV
44,,SING,C16,H16,no,N,44,,96458,18929,DPV
45,,SING,C16,H16A,no,N,45,,96458,18929,DPV
46,,SING,C17,H17,no,N,46,,96458,18929,DPV
47,,SING,C17,H17A,no,N,47,,96458,18929,DPV
48,,SING,C18,H18,no,N,48,,96458,18929,DPV
49,,SING,C18,H18A,no,N,49,,96458,18929,DPV
50,,SING,C19,H19,no,N,50,,96458,18929,DPV
51,,SING,C19,H19A,no,N,51,,96458,18929,DPV
52,,SING,C20,H20,no,N,52,,96458,18929,DPV
53,,SING,C20,H20A,no,N,53,,96458,18929,DPV
54,,SING,C21,H21,no,N,54,,96458,18929,DPV
55,,SING,C21,H21A,no,N,55,,96458,18929,DPV
56,,SING,C22,H22,no,N,56,,96458,18929,DPV
57,,SING,C22,H22A,no,N,57,,96458,18929,DPV
58,,SING,C23,H23,no,N,58,,96458,18929,DPV
59,,SING,C23,H23A,no,N,59,,96458,18929,DPV
60,,SING,C23,H23B,no,N,60,,96458,18929,DPV
1,,SING,N,CA,no,N,1,,96474,1893,PCA
2,,SING,N,CD,no,N,2,,96474,1893,PCA
3,,SING,N,H,no,N,3,,96474,1893,PCA
4,,SING,CA,CB,no,N,4,,96474,1893,PCA
5,,SING,CA,C,no,N,5,,96474,1893,PCA
6,,SING,CA,HA,no,N,6,,96474,1893,PCA
7,,SING,CB,CG,no,N,7,,96474,1893,PCA
8,,SING,CB,HB2,no,N,8,,96474,1893,PCA
9,,SING,CB,HB3,no,N,9,,96474,1893,PCA
10,,SING,CG,CD,no,N,10,,96474,1893,PCA
11,,SING,CG,HG2,no,N,11,,96474,1893,PCA
12,,SING,CG,HG3,no,N,12,,96474,1893,PCA
13,,DOUB,CD,OE,no,N,13,,96474,1893,PCA
14,,DOUB,C,O,no,N,14,,96474,1893,PCA
15,,SING,C,OXT,no,N,15,,96474,1893,PCA
16,,SING,OXT,HXT,no,N,16,,96474,1893,PCA
1,,SING,N,C5,no,N,1,,96489,18930,DPV
2,,SING,N,C6,no,N,2,,96489,18930,DPV
3,,SING,N,C7,no,N,3,,96489,18930,DPV
4,,SING,N,C8,no,N,4,,96489,18930,DPV
5,,SING,P,O1P,no,N,5,,96489,18930,DPV
6,,DOUB,P,O2P,no,N,6,,96489,18930,DPV
7,,SING,P,O3P,no,N,7,,96489,18930,DPV
8,,SING,P,O4P,no,N,8,,96489,18930,DPV
9,,SING,C1,C2,no,N,9,,96489,18930,DPV
10,,SING,C1,O3P,no,N,10,,96489,18930,DPV
11,,SING,C2,C3,no,N,11,,96489,18930,DPV
12,,SING,C3,C15,no,N,12,,96489,18930,DPV
13,,SING,C4,C5,no,N,13,,96489,18930,DPV
14,,SING,C4,O4P,no,N,14,,96489,18930,DPV
15,,SING,C15,C16,no,N,15,,96489,18930,DPV
16,,SING,C16,C17,no,N,16,,96489,18930,DPV
17,,SING,C17,C18,no,N,17,,96489,18930,DPV
18,,SING,C18,C19,no,N,18,,96489,18930,DPV
19,,SING,C19,C20,no,N,19,,96489,18930,DPV
20,,SING,C20,C21,no,N,20,,96489,18930,DPV
21,,SING,C21,C22,no,N,21,,96489,18930,DPV
22,,SING,C22,C23,no,N,22,,96489,18930,DPV
23,,SING,C1,H1,no,N,23,,96489,18930,DPV
24,,SING,C1,H1A,no,N,24,,96489,18930,DPV
25,,SING,C2,H2,no,N,25,,96489,18930,DPV
26,,SING,C2,H2A,no,N,26,,96489,18930,DPV
27,,SING,C3,H3,no,N,27,,96489,18930,DPV
28,,SING,C3,H3A,no,N,28,,96489,18930,DPV
29,,SING,C4,H4,no,N,29,,96489,18930,DPV
30,,SING,C4,H4A,no,N,30,,96489,18930,DPV
31,,SING,C5,H5,no,N,31,,96489,18930,DPV
32,,SING,C5,H5A,no,N,32,,96489,18930,DPV
33,,SING,C6,H6,no,N,33,,96489,18930,DPV
34,,SING,C6,H6A,no,N,34,,96489,18930,DPV
35,,SING,C6,H6B,no,N,35,,96489,18930,DPV
36,,SING,C7,H7,no,N,36,,96489,18930,DPV
37,,SING,C7,H7A,no,N,37,,96489,18930,DPV
38,,SING,C7,H7B,no,N,38,,96489,18930,DPV
39,,SING,C8,H8,no,N,39,,96489,18930,DPV
40,,SING,C8,H8A,no,N,40,,96489,18930,DPV
41,,SING,C8,H8B,no,N,41,,96489,18930,DPV
42,,SING,C15,H15,no,N,42,,96489,18930,DPV
43,,SING,C15,H15A,no,N,43,,96489,18930,DPV
44,,SING,C16,H16,no,N,44,,96489,18930,DPV
45,,SING,C16,H16A,no,N,45,,96489,18930,DPV
46,,SING,C17,H17,no,N,46,,96489,18930,DPV
47,,SING,C17,H17A,no,N,47,,96489,18930,DPV
48,,SING,C18,H18,no,N,48,,96489,18930,DPV
49,,SING,C18,H18A,no,N,49,,96489,18930,DPV
50,,SING,C19,H19,no,N,50,,96489,18930,DPV
51,,SING,C19,H19A,no,N,51,,96489,18930,DPV
52,,SING,C20,H20,no,N,52,,96489,18930,DPV
53,,SING,C20,H20A,no,N,53,,96489,18930,DPV
54,,SING,C21,H21,no,N,54,,96489,18930,DPV
55,,SING,C21,H21A,no,N,55,,96489,18930,DPV
56,,SING,C22,H22,no,N,56,,96489,18930,DPV
57,,SING,C22,H22A,no,N,57,,96489,18930,DPV
58,,SING,C23,H23,no,N,58,,96489,18930,DPV
59,,SING,C23,H23A,no,N,59,,96489,18930,DPV
60,,SING,C23,H23B,no,N,60,,96489,18930,DPV
1,,SING,N,CA,no,N,1,,96505,18931,ABA
2,,SING,N,H,no,N,2,,96505,18931,ABA
3,,SING,N,HN2,no,N,3,,96505,18931,ABA
4,,SING,CA,C,no,N,4,,96505,18931,ABA
5,,SING,CA,CB,no,N,5,,96505,18931,ABA
6,,SING,CA,HA,no,N,6,,96505,18931,ABA
7,,DOUB,C,O,no,N,7,,96505,18931,ABA
8,,SING,C,OXT,no,N,8,,96505,18931,ABA
9,,SING,CB,CG,no,N,9,,96505,18931,ABA
10,,SING,CB,HB3,no,N,10,,96505,18931,ABA
11,,SING,CB,HB2,no,N,11,,96505,18931,ABA
12,,SING,CG,HG1,no,N,12,,96505,18931,ABA
13,,SING,CG,HG3,no,N,13,,96505,18931,ABA
14,,SING,CG,HG2,no,N,14,,96505,18931,ABA
15,,SING,OXT,HXT,no,N,15,,96505,18931,ABA
1,,SING,PG,O1G,no,N,1,,96545,18934,DGT
2,,SING,PG,O2G,no,N,2,,96545,18934,DGT
3,,SING,O1G,HO1G,no,N,3,,96545,18934,DGT
4,,SING,O2G,HO2G,no,N,4,,96545,18934,DGT
5,,DOUB,O3G,PG,no,N,5,,96545,18934,DGT
6,,SING,O3B,PG,no,N,6,,96545,18934,DGT
7,,SING,PB,O3B,no,N,7,,96545,18934,DGT
8,,SING,PB,O1B,no,N,8,,96545,18934,DGT
9,,SING,PB,O3A,no,N,9,,96545,18934,DGT
10,,SING,O1B,HO1B,no,N,10,,96545,18934,DGT
11,,DOUB,O2B,PB,no,N,11,,96545,18934,DGT
12,,SING,PA,O3A,no,N,12,,96545,18934,DGT
13,,SING,PA,O1A,no,N,13,,96545,18934,DGT
14,,SING,O1A,HO1A,no,N,14,,96545,18934,DGT
15,,DOUB,O2A,PA,no,N,15,,96545,18934,DGT
16,,SING,O5',PA,no,N,16,,96545,18934,DGT
17,,SING,O5',C5',no,N,17,,96545,18934,DGT
18,,SING,C5',H5',no,N,18,,96545,18934,DGT
19,,SING,C5',H5'A,no,N,19,,96545,18934,DGT
20,,SING,C4',C5',no,N,20,,96545,18934,DGT
21,,SING,C4',H4',no,N,21,,96545,18934,DGT
22,,SING,O4',C4',no,N,22,,96545,18934,DGT
23,,SING,C3',C4',no,N,23,,96545,18934,DGT
24,,SING,C3',O3',no,N,24,,96545,18934,DGT
25,,SING,C3',H3',no,N,25,,96545,18934,DGT
26,,SING,O3',HO3',no,N,26,,96545,18934,DGT
27,,SING,C2',C3',no,N,27,,96545,18934,DGT
28,,SING,C2',C1',no,N,28,,96545,18934,DGT
29,,SING,C2',H2',no,N,29,,96545,18934,DGT
30,,SING,C2',H2'A,no,N,30,,96545,18934,DGT
31,,SING,C1',O4',no,N,31,,96545,18934,DGT
32,,SING,C1',H1',no,N,32,,96545,18934,DGT
33,,SING,N9,C1',no,N,33,,96545,18934,DGT
34,,SING,N9,C4,yes,N,34,,96545,18934,DGT
35,,SING,C8,N9,yes,N,35,,96545,18934,DGT
36,,SING,C8,H8,no,N,36,,96545,18934,DGT
37,,DOUB,N7,C8,yes,N,37,,96545,18934,DGT
38,,SING,N7,C5,yes,N,38,,96545,18934,DGT
39,,SING,C5,C6,no,N,39,,96545,18934,DGT
6,,SING,C1,H12,,,,,240371,6145,TPLi
40,,DOUB,C5,C4,yes,N,40,,96545,18934,DGT
41,,SING,C6,N1,no,N,41,,96545,18934,DGT
42,,DOUB,O6,C6,no,N,42,,96545,18934,DGT
43,,SING,N1,C2,no,N,43,,96545,18934,DGT
44,,DOUB,C2,N3,no,N,44,,96545,18934,DGT
45,,SING,C2,N2,no,N,45,,96545,18934,DGT
46,,SING,N2,HN2,no,N,46,,96545,18934,DGT
47,,SING,N2,HN2A,no,N,47,,96545,18934,DGT
48,,SING,C4,N3,no,N,48,,96545,18934,DGT
49,,SING,N1,H16,no,N,49,,96545,18934,DGT
1,,SING,PG,O1G,no,N,1,,96568,18935,DGT
2,,SING,PG,O2G,no,N,2,,96568,18935,DGT
3,,SING,O1G,HO1G,no,N,3,,96568,18935,DGT
4,,SING,O2G,HO2G,no,N,4,,96568,18935,DGT
5,,DOUB,O3G,PG,no,N,5,,96568,18935,DGT
6,,SING,O3B,PG,no,N,6,,96568,18935,DGT
7,,SING,PB,O3B,no,N,7,,96568,18935,DGT
8,,SING,PB,O1B,no,N,8,,96568,18935,DGT
9,,SING,PB,O3A,no,N,9,,96568,18935,DGT
10,,SING,O1B,HO1B,no,N,10,,96568,18935,DGT
11,,DOUB,O2B,PB,no,N,11,,96568,18935,DGT
12,,SING,PA,O3A,no,N,12,,96568,18935,DGT
13,,SING,PA,O1A,no,N,13,,96568,18935,DGT
14,,SING,O1A,HO1A,no,N,14,,96568,18935,DGT
15,,DOUB,O2A,PA,no,N,15,,96568,18935,DGT
16,,SING,O5',PA,no,N,16,,96568,18935,DGT
17,,SING,O5',C5',no,N,17,,96568,18935,DGT
18,,SING,C5',H5',no,N,18,,96568,18935,DGT
19,,SING,C5',H5'A,no,N,19,,96568,18935,DGT
20,,SING,C4',C5',no,N,20,,96568,18935,DGT
21,,SING,C4',H4',no,N,21,,96568,18935,DGT
22,,SING,O4',C4',no,N,22,,96568,18935,DGT
23,,SING,C3',C4',no,N,23,,96568,18935,DGT
24,,SING,C3',O3',no,N,24,,96568,18935,DGT
25,,SING,C3',H3',no,N,25,,96568,18935,DGT
26,,SING,O3',HO3',no,N,26,,96568,18935,DGT
27,,SING,C2',C3',no,N,27,,96568,18935,DGT
28,,SING,C2',C1',no,N,28,,96568,18935,DGT
29,,SING,C2',H2',no,N,29,,96568,18935,DGT
30,,SING,C2',H2'A,no,N,30,,96568,18935,DGT
31,,SING,C1',O4',no,N,31,,96568,18935,DGT
32,,SING,C1',H1',no,N,32,,96568,18935,DGT
33,,SING,N9,C1',no,N,33,,96568,18935,DGT
34,,SING,N9,C4,yes,N,34,,96568,18935,DGT
35,,SING,C8,N9,yes,N,35,,96568,18935,DGT
36,,SING,C8,H8,no,N,36,,96568,18935,DGT
37,,DOUB,N7,C8,yes,N,37,,96568,18935,DGT
38,,SING,N7,C5,yes,N,38,,96568,18935,DGT
39,,SING,C5,C6,no,N,39,,96568,18935,DGT
40,,DOUB,C5,C4,yes,N,40,,96568,18935,DGT
41,,SING,C6,N1,no,N,41,,96568,18935,DGT
42,,DOUB,O6,C6,no,N,42,,96568,18935,DGT
43,,SING,N1,C2,no,N,43,,96568,18935,DGT
44,,DOUB,C2,N3,no,N,44,,96568,18935,DGT
45,,SING,C2,N2,no,N,45,,96568,18935,DGT
46,,SING,N2,HN2,no,N,46,,96568,18935,DGT
47,,SING,N2,HN2A,no,N,47,,96568,18935,DGT
48,,SING,C4,N3,no,N,48,,96568,18935,DGT
49,,SING,N1,H16,no,N,49,,96568,18935,DGT
1,,SING,N,CA,no,N,1,,96587,18937,ABA
2,,SING,N,H,no,N,2,,96587,18937,ABA
3,,SING,N,HN2,no,N,3,,96587,18937,ABA
4,,SING,CA,C,no,N,4,,96587,18937,ABA
5,,SING,CA,CB,no,N,5,,96587,18937,ABA
6,,SING,CA,HA,no,N,6,,96587,18937,ABA
7,,DOUB,C,O,no,N,7,,96587,18937,ABA
8,,SING,C,OXT,no,N,8,,96587,18937,ABA
9,,SING,CB,CG,no,N,9,,96587,18937,ABA
10,,SING,CB,HB3,no,N,10,,96587,18937,ABA
11,,SING,CB,HB2,no,N,11,,96587,18937,ABA
12,,SING,CG,HG1,no,N,12,,96587,18937,ABA
13,,SING,CG,HG3,no,N,13,,96587,18937,ABA
14,,SING,CG,HG2,no,N,14,,96587,18937,ABA
15,,SING,OXT,HXT,no,N,15,,96587,18937,ABA
1,,DOUB,C,O,no,N,1,,96681,18942,ACE
2,,SING,C,CH3,no,N,2,,96681,18942,ACE
3,,SING,C,H,no,N,3,,96681,18942,ACE
4,,SING,CH3,H1,no,N,4,,96681,18942,ACE
5,,SING,CH3,H2,no,N,5,,96681,18942,ACE
6,,SING,CH3,H3,no,N,6,,96681,18942,ACE
1,,SING,N,CA,no,N,1,,96682,18942,HYP
2,,SING,N,CD,no,N,2,,96682,18942,HYP
3,,SING,N,H,no,N,3,,96682,18942,HYP
4,,SING,CA,C,no,N,4,,96682,18942,HYP
5,,SING,CA,CB,no,N,5,,96682,18942,HYP
6,,SING,CA,HA,no,N,6,,96682,18942,HYP
7,,DOUB,C,O,no,N,7,,96682,18942,HYP
8,,SING,C,OXT,no,N,8,,96682,18942,HYP
9,,SING,CB,CG,no,N,9,,96682,18942,HYP
10,,SING,CB,HB2,no,N,10,,96682,18942,HYP
11,,SING,CB,HB3,no,N,11,,96682,18942,HYP
12,,SING,CG,CD,no,N,12,,96682,18942,HYP
13,,SING,CG,OD1,no,N,13,,96682,18942,HYP
14,,SING,CG,HG,no,N,14,,96682,18942,HYP
15,,SING,CD,HD22,no,N,15,,96682,18942,HYP
16,,SING,CD,HD23,no,N,16,,96682,18942,HYP
17,,SING,OD1,HD1,no,N,17,,96682,18942,HYP
18,,SING,OXT,HXT,no,N,18,,96682,18942,HYP
1,,SING,N,HN1,no,N,1,,96683,18942,NH2
2,,SING,N,HN2,no,N,2,,96683,18942,NH2
1,,DOUB,OP2,P,no,N,1,,96835,18950,C5L
2,,SING,O5',P,no,N,2,,96835,18950,C5L
3,,SING,P,OP3,no,N,3,,96835,18950,C5L
4,,SING,P,OP1,no,N,4,,96835,18950,C5L
5,,SING,C2,N1,no,N,5,,96835,18950,C5L
6,,SING,C6,N1,no,N,6,,96835,18950,C5L
7,,SING,C2,H2,,,,,240371,6145,TPLi
7,,SING,N1,C1',no,N,7,,96835,18950,C5L
8,,SING,N3,C2,no,N,8,,96835,18950,C5L
9,,DOUB,C2,O2,no,N,9,,96835,18950,C5L
10,,DOUB,C4,N3,no,N,10,,96835,18950,C5L
11,,SING,N4,C4,no,N,11,,96835,18950,C5L
12,,SING,C4,C5,no,N,12,,96835,18950,C5L
13,,SING,HN4,N4,no,N,13,,96835,18950,C5L
14,,SING,HN4A,N4,no,N,14,,96835,18950,C5L
15,,SING,C7,C5,no,N,15,,96835,18950,C5L
16,,DOUB,C5,C6,no,N,16,,96835,18950,C5L
17,,SING,C6,H6,no,N,17,,96835,18950,C5L
18,,SING,H7A,C7,no,N,18,,96835,18950,C5L
19,,SING,H7B,C7,no,N,19,,96835,18950,C5L
20,,SING,C7,H7,no,N,20,,96835,18950,C5L
21,,SING,H1',C1',no,N,21,,96835,18950,C5L
22,,SING,C1',C2',no,N,22,,96835,18950,C5L
23,,SING,C1',O4',no,N,23,,96835,18950,C5L
24,,SING,H2',C2',no,N,24,,96835,18950,C5L
25,,SING,C2',O2',no,N,25,,96835,18950,C5L
26,,SING,C2',C3',no,N,26,,96835,18950,C5L
27,,SING,CA',O2',no,N,27,,96835,18950,C5L
28,,SING,H3',C3',no,N,28,,96835,18950,C5L
29,,SING,C3',C4',no,N,29,,96835,18950,C5L
30,,SING,C3',O3',no,N,30,,96835,18950,C5L
31,,SING,O3',HO3',no,N,31,,96835,18950,C5L
32,,SING,O4',C4',no,N,32,,96835,18950,C5L
33,,SING,C4',C5',no,N,33,,96835,18950,C5L
34,,SING,C4',H4',no,N,34,,96835,18950,C5L
35,,SING,O5',C5',no,N,35,,96835,18950,C5L
36,,SING,C5',H5',no,N,36,,96835,18950,C5L
37,,SING,C5',H5'A,no,N,37,,96835,18950,C5L
38,,SING,HA',CA',no,N,38,,96835,18950,C5L
39,,SING,HA'A,CA',no,N,39,,96835,18950,C5L
40,,SING,CA',CB',no,N,40,,96835,18950,C5L
41,,SING,OC',CB',no,N,41,,96835,18950,C5L
42,,SING,CB',HB'A,no,N,42,,96835,18950,C5L
43,,SING,CB',HB',no,N,43,,96835,18950,C5L
44,,SING,CD',OC',no,N,44,,96835,18950,C5L
45,,SING,HD',CD',no,N,45,,96835,18950,C5L
46,,SING,HD'A,CD',no,N,46,,96835,18950,C5L
47,,SING,CD',HD'B,no,N,47,,96835,18950,C5L
48,,SING,OP1,HOP1,no,N,48,,96835,18950,C5L
49,,SING,OP3,HOP3,no,N,49,,96835,18950,C5L
1,,DOUB,OP1,P,no,N,1,,96836,18950,G48
2,,SING,P,O5',no,N,2,,96836,18950,G48
3,,SING,P,OP3,no,N,3,,96836,18950,G48
4,,SING,C5',O5',no,N,4,,96836,18950,G48
5,,SING,C5',C4',no,N,5,,96836,18950,G48
6,,SING,C4',O4',no,N,6,,96836,18950,G48
7,,SING,C4',C3',no,N,7,,96836,18950,G48
8,,SING,O4',C1',no,N,8,,96836,18950,G48
9,,SING,O3',C3',no,N,9,,96836,18950,G48
10,,SING,C3',C2',no,N,10,,96836,18950,G48
11,,SING,C1',C2',no,N,11,,96836,18950,G48
12,,SING,C1',N9,no,N,12,,96836,18950,G48
13,,SING,O2',C2',no,N,13,,96836,18950,G48
14,,SING,O2',CA',no,N,14,,96836,18950,G48
15,,SING,CD',OC',no,N,15,,96836,18950,G48
16,,SING,C8,N9,yes,N,16,,96836,18950,G48
17,,DOUB,C8,N7,yes,N,17,,96836,18950,G48
18,,SING,CB',OC',no,N,18,,96836,18950,G48
19,,SING,CB',CA',no,N,19,,96836,18950,G48
20,,SING,N9,C4,yes,N,20,,96836,18950,G48
21,,SING,N7,C5,yes,N,21,,96836,18950,G48
22,,DOUB,C4,C5,yes,N,22,,96836,18950,G48
23,,SING,C4,N3,no,N,23,,96836,18950,G48
24,,SING,C5,C6,no,N,24,,96836,18950,G48
25,,DOUB,N3,C2,no,N,25,,96836,18950,G48
26,,DOUB,C6,O6,no,N,26,,96836,18950,G48
27,,SING,C6,N1,no,N,27,,96836,18950,G48
28,,SING,C2,N1,no,N,28,,96836,18950,G48
29,,SING,C2,N2,no,N,29,,96836,18950,G48
30,,SING,P,OP2,no,N,30,,96836,18950,G48
31,,SING,OP3,HOP3,no,N,31,,96836,18950,G48
32,,SING,C5',H5',no,N,32,,96836,18950,G48
33,,SING,C5',H5'',no,N,33,,96836,18950,G48
34,,SING,C4',H4',no,N,34,,96836,18950,G48
35,,SING,C3',H3',no,N,35,,96836,18950,G48
36,,SING,O3',HO3',no,N,36,,96836,18950,G48
37,,SING,C2',H2',no,N,37,,96836,18950,G48
38,,SING,C1',H1',no,N,38,,96836,18950,G48
39,,SING,C8,H8,no,N,39,,96836,18950,G48
40,,SING,N1,H1,no,N,40,,96836,18950,G48
41,,SING,N2,H21,no,N,41,,96836,18950,G48
42,,SING,N2,H22,no,N,42,,96836,18950,G48
43,,SING,CA',HCA2,no,N,43,,96836,18950,G48
44,,SING,CA',HCA1,no,N,44,,96836,18950,G48
45,,SING,CB',HCB1,no,N,45,,96836,18950,G48
46,,SING,CB',HCB2,no,N,46,,96836,18950,G48
47,,SING,CD',HCD1,no,N,47,,96836,18950,G48
48,,SING,CD',HCD2,no,N,48,,96836,18950,G48
49,,SING,CD',HCD3,no,N,49,,96836,18950,G48
50,,SING,OP2,HOP2,no,N,50,,96836,18950,G48
1,,DOUB,C2,N1,yes,N,1,,96837,18950,A44
2,,SING,C2,N3,yes,N,2,,96837,18950,A44
3,,SING,N1,C6,yes,N,3,,96837,18950,A44
4,,SING,CB',CA',no,N,4,,96837,18950,A44
5,,SING,CB',OC',no,N,5,,96837,18950,A44
6,,DOUB,N3,C4,yes,N,6,,96837,18950,A44
7,,SING,C6,N6,no,N,7,,96837,18950,A44
8,,DOUB,C6,C5,yes,N,8,,96837,18950,A44
9,,SING,CD',OC',no,N,9,,96837,18950,A44
10,,SING,CA',O2',no,N,10,,96837,18950,A44
11,,SING,C4,C5,yes,N,11,,96837,18950,A44
12,,SING,C4,N9,yes,N,12,,96837,18950,A44
13,,SING,C5,N7,yes,N,13,,96837,18950,A44
14,,SING,O2',C2',no,N,14,,96837,18950,A44
15,,SING,C2',C1',no,N,15,,96837,18950,A44
16,,SING,C2',C3',no,N,16,,96837,18950,A44
17,,SING,N9,C1',no,N,17,,96837,18950,A44
18,,SING,N9,C8,yes,N,18,,96837,18950,A44
19,,DOUB,N7,C8,yes,N,19,,96837,18950,A44
20,,SING,C1',O4',no,N,20,,96837,18950,A44
21,,SING,O3',C3',no,N,21,,96837,18950,A44
22,,SING,C3',C4',no,N,22,,96837,18950,A44
23,,SING,O4',C4',no,N,23,,96837,18950,A44
24,,SING,C4',C5',no,N,24,,96837,18950,A44
25,,SING,O5',C5',no,N,25,,96837,18950,A44
26,,SING,O5',P,no,N,26,,96837,18950,A44
27,,DOUB,OP1,P,no,N,27,,96837,18950,A44
28,,SING,P,OP2,no,N,28,,96837,18950,A44
29,,SING,P,OP3,no,N,29,,96837,18950,A44
30,,SING,OP2,HOP2,no,N,30,,96837,18950,A44
31,,SING,C5',H5',no,N,31,,96837,18950,A44
32,,SING,C5',H5'',no,N,32,,96837,18950,A44
33,,SING,C4',H4',no,N,33,,96837,18950,A44
34,,SING,C3',H3',no,N,34,,96837,18950,A44
35,,SING,O3',HO3',no,N,35,,96837,18950,A44
36,,SING,C2',H2',no,N,36,,96837,18950,A44
37,,SING,C1',H1',no,N,37,,96837,18950,A44
38,,SING,C8,H8,no,N,38,,96837,18950,A44
39,,SING,N6,H61,no,N,39,,96837,18950,A44
40,,SING,N6,H62,no,N,40,,96837,18950,A44
41,,SING,C2,H2,no,N,41,,96837,18950,A44
42,,SING,CA',HCA2,no,N,42,,96837,18950,A44
43,,SING,CA',HCA1,no,N,43,,96837,18950,A44
44,,SING,CD',HCD1,no,N,44,,96837,18950,A44
45,,SING,CD',HCD2,no,N,45,,96837,18950,A44
46,,SING,CD',HCD3,no,N,46,,96837,18950,A44
47,,SING,CB',HCB1,no,N,47,,96837,18950,A44
48,,SING,CB',HCB2,no,N,48,,96837,18950,A44
49,,SING,OP3,HOP3,no,N,49,,96837,18950,A44
1,,SING,CD',OC',no,N,1,,96838,18950,T39
2,,SING,OC',CB',no,N,2,,96838,18950,T39
3,,SING,CB',CA',no,N,3,,96838,18950,T39
4,,SING,CA',O2',no,N,4,,96838,18950,T39
5,,SING,O2',C2',no,N,5,,96838,18950,T39
6,,SING,O3',C3',no,N,6,,96838,18950,T39
7,,SING,C2',C3',no,N,7,,96838,18950,T39
8,,SING,C2',C1',no,N,8,,96838,18950,T39
9,,SING,C3',C4',no,N,9,,96838,18950,T39
10,,DOUB,O2,C2,no,N,10,,96838,18950,T39
11,,SING,C4',O4',no,N,11,,96838,18950,T39
12,,SING,C4',C5',no,N,12,,96838,18950,T39
13,,SING,C1',O4',no,N,13,,96838,18950,T39
14,,SING,C1',N1,no,N,14,,96838,18950,T39
15,,SING,C2,N1,no,N,15,,96838,18950,T39
16,,SING,C2,N3,no,N,16,,96838,18950,T39
17,,SING,N1,C6,no,N,17,,96838,18950,T39
18,,SING,C5',O5',no,N,18,,96838,18950,T39
19,,SING,N3,C4,no,N,19,,96838,18950,T39
20,,SING,O5',P,no,N,20,,96838,18950,T39
21,,DOUB,C6,C5,no,N,21,,96838,18950,T39
22,,SING,C4,C5,no,N,22,,96838,18950,T39
23,,DOUB,C4,O4,no,N,23,,96838,18950,T39
24,,SING,C5,C7,no,N,24,,96838,18950,T39
25,,DOUB,OP1,P,no,N,25,,96838,18950,T39
26,,SING,P,OP2,no,N,26,,96838,18950,T39
27,,SING,P,OP3,no,N,27,,96838,18950,T39
28,,SING,OP2,HOP2,no,N,28,,96838,18950,T39
29,,SING,C5',H5',no,N,29,,96838,18950,T39
30,,SING,C5',H5'',no,N,30,,96838,18950,T39
31,,SING,C4',H4',no,N,31,,96838,18950,T39
32,,SING,C3',H3',no,N,32,,96838,18950,T39
33,,SING,O3',HO3',no,N,33,,96838,18950,T39
34,,SING,C2',H7,no,N,34,,96838,18950,T39
35,,SING,C1',H1',no,N,35,,96838,18950,T39
36,,SING,N3,H3,no,N,36,,96838,18950,T39
37,,SING,C7,H71,no,N,37,,96838,18950,T39
38,,SING,C7,H72,no,N,38,,96838,18950,T39
39,,SING,C7,H73,no,N,39,,96838,18950,T39
40,,SING,C6,H6,no,N,40,,96838,18950,T39
41,,SING,CA',HCA2,no,N,41,,96838,18950,T39
42,,SING,CA',HCA1,no,N,42,,96838,18950,T39
43,,SING,CD',HCD1,no,N,43,,96838,18950,T39
44,,SING,CD',HCD2,no,N,44,,96838,18950,T39
45,,SING,CD',HCD3,no,N,45,,96838,18950,T39
46,,SING,CB',HCB1,no,N,46,,96838,18950,T39
47,,SING,CB',HCB2,no,N,47,,96838,18950,T39
48,,SING,OP3,HOP3,no,N,48,,96838,18950,T39
1,,SING,N,CA,no,N,1,,96876,18952,SEP
2,,SING,N,H,no,N,2,,96876,18952,SEP
3,,SING,N,H2,no,N,3,,96876,18952,SEP
4,,SING,CA,CB,no,N,4,,96876,18952,SEP
5,,SING,CA,C,no,N,5,,96876,18952,SEP
6,,SING,CA,HA,no,N,6,,96876,18952,SEP
7,,SING,CB,OG,no,N,7,,96876,18952,SEP
8,,SING,CB,HB2,no,N,8,,96876,18952,SEP
9,,SING,CB,HB3,no,N,9,,96876,18952,SEP
10,,SING,OG,P,no,N,10,,96876,18952,SEP
11,,DOUB,C,O,no,N,11,,96876,18952,SEP
12,,SING,C,OXT,no,N,12,,96876,18952,SEP
13,,SING,OXT,HXT,no,N,13,,96876,18952,SEP
14,,DOUB,P,O1P,no,N,14,,96876,18952,SEP
15,,SING,P,O2P,no,N,15,,96876,18952,SEP
16,,SING,P,O3P,no,N,16,,96876,18952,SEP
17,,SING,O2P,HOP2,no,N,17,,96876,18952,SEP
18,,SING,O3P,HOP3,no,N,18,,96876,18952,SEP
1,,SING,C22,C20,no,N,1,,96995,18958,LL5
8,,SING,C3,C4,,,,,240371,6145,TPLi
2,,SING,C22,H22,no,N,2,,96995,18958,LL5
3,,SING,C22,H22A,no,N,3,,96995,18958,LL5
4,,SING,C22,H22B,no,N,4,,96995,18958,LL5
5,,SING,C20,C19,no,N,5,,96995,18958,LL5
6,,SING,C20,C21,no,N,6,,96995,18958,LL5
7,,SING,C20,H20,no,N,7,,96995,18958,LL5
8,,SING,C21,H21,no,N,8,,96995,18958,LL5
9,,SING,C21,H21A,no,N,9,,96995,18958,LL5
10,,SING,C21,H21B,no,N,10,,96995,18958,LL5
11,,SING,C7,C19,no,N,11,,96995,18958,LL5
12,,SING,N33,C19,no,N,12,,96995,18958,LL5
13,,SING,C19,H19,no,N,13,,96995,18958,LL5
14,,SING,N33,HN33,no,N,14,,96995,18958,LL5
15,,SING,N33,HN3A,no,N,15,,96995,18958,LL5
16,,DOUB,O32,C7,no,N,16,,96995,18958,LL5
17,,SING,C7,N1,no,N,17,,96995,18958,LL5
18,,SING,C6,N1,no,N,18,,96995,18958,LL5
19,,SING,N1,C2,no,N,19,,96995,18958,LL5
20,,SING,C3,C2,no,N,20,,96995,18958,LL5
21,,SING,C2,H2,no,N,21,,96995,18958,LL5
22,,SING,C2,H2A,no,N,22,,96995,18958,LL5
23,,SING,C4,C3,no,N,23,,96995,18958,LL5
24,,SING,C3,H3,no,N,24,,96995,18958,LL5
25,,SING,C3,H3A,no,N,25,,96995,18958,LL5
26,,SING,C5,C6,no,N,26,,96995,18958,LL5
27,,SING,C6,H6,no,N,27,,96995,18958,LL5
28,,SING,C6,H6A,no,N,28,,96995,18958,LL5
29,,SING,C5,C4,no,N,29,,96995,18958,LL5
30,,SING,C5,H5,no,N,30,,96995,18958,LL5
31,,SING,C5,H5A,no,N,31,,96995,18958,LL5
32,,SING,C14,C4,no,N,32,,96995,18958,LL5
33,,SING,C4,H4,no,N,33,,96995,18958,LL5
34,,SING,O26,C14,yes,N,34,,96995,18958,LL5
35,,DOUB,C14,N23,yes,N,35,,96995,18958,LL5
36,,SING,C24,N23,yes,N,36,,96995,18958,LL5
37,,SING,N25,O26,yes,N,37,,96995,18958,LL5
38,,DOUB,N25,C24,yes,N,38,,96995,18958,LL5
39,,SING,C24,C27,yes,N,39,,96995,18958,LL5
40,,SING,S28,C27,yes,N,40,,96995,18958,LL5
41,,DOUB,C27,C31,yes,N,41,,96995,18958,LL5
42,,SING,C30,C31,yes,N,42,,96995,18958,LL5
43,,SING,C31,H31,no,N,43,,96995,18958,LL5
44,,DOUB,C29,C30,yes,N,44,,96995,18958,LL5
45,,SING,C30,H30,no,N,45,,96995,18958,LL5
46,,SING,S28,C29,yes,N,46,,96995,18958,LL5
47,,SING,C29,H29,no,N,47,,96995,18958,LL5
1,,SING,OA1,C4,no,N,1,,96996,18958,ORI
2,,DOUB,C6,C7,yes,N,2,,96996,18958,ORI
3,,SING,C6,C5,yes,N,3,,96996,18958,ORI
4,,DOUB,C4,C5,yes,N,4,,96996,18958,ORI
5,,SING,C4,C3,yes,N,5,,96996,18958,ORI
6,,SING,C7,C8,yes,N,6,,96996,18958,ORI
7,,SING,C5,C10,yes,N,7,,96996,18958,ORI
8,,DOUB,C3,C2,yes,N,8,,96996,18958,ORI
9,,DOUB,C8,C9,yes,N,9,,96996,18958,ORI
10,,SING,C10,C9,yes,N,10,,96996,18958,ORI
11,,DOUB,C10,C1,yes,N,11,,96996,18958,ORI
12,,SING,C2,C1,yes,N,12,,96996,18958,ORI
13,,SING,C1,N1,no,N,13,,96996,18958,ORI
14,,DOUB,N1,N2,no,N,14,,96996,18958,ORI
15,,SING,N2,CB1,no,N,15,,96996,18958,ORI
16,,DOUB,CB1,CB2,yes,N,16,,96996,18958,ORI
17,,SING,CB1,CB6,yes,N,17,,96996,18958,ORI
18,,SING,CB2,CB3,yes,N,18,,96996,18958,ORI
19,,DOUB,CB6,CB5,yes,N,19,,96996,18958,ORI
20,,DOUB,CB3,CB4,yes,N,20,,96996,18958,ORI
21,,SING,CB5,CB4,yes,N,21,,96996,18958,ORI
22,,SING,CB4,SB,no,N,22,,96996,18958,ORI
23,,DOUB,OB4,SB,no,N,23,,96996,18958,ORI
24,,DOUB,SB,OB2,no,N,24,,96996,18958,ORI
25,,SING,SB,OB3,no,N,25,,96996,18958,ORI
26,,SING,CB5,H1,no,N,26,,96996,18958,ORI
27,,SING,CB6,H2,no,N,27,,96996,18958,ORI
28,,SING,CB3,H3,no,N,28,,96996,18958,ORI
29,,SING,CB2,H4,no,N,29,,96996,18958,ORI
30,,SING,C2,H5,no,N,30,,96996,18958,ORI
31,,SING,C3,H6,no,N,31,,96996,18958,ORI
32,,SING,OA1,H7,no,N,32,,96996,18958,ORI
33,,SING,C6,H8,no,N,33,,96996,18958,ORI
34,,SING,C7,H9,no,N,34,,96996,18958,ORI
35,,SING,C8,H10,no,N,35,,96996,18958,ORI
36,,SING,C9,H11,no,N,36,,96996,18958,ORI
37,,SING,OB3,H12,no,N,37,,96996,18958,ORI
1,,SING,N,HN1,no,N,1,,97073,18964,NH2
2,,SING,N,HN2,no,N,2,,97073,18964,NH2
1,,SING,N,HN1,no,N,1,,97231,18972,NH2
2,,SING,N,HN2,no,N,2,,97231,18972,NH2
1,,SING,OP3,P,no,N,1,,97250,18973,8OG
2,,SING,OP3,HOP3,no,N,2,,97250,18973,8OG
3,,DOUB,P,OP1,no,N,3,,97250,18973,8OG
4,,SING,P,OP2,no,N,4,,97250,18973,8OG
5,,SING,P,O5',no,N,5,,97250,18973,8OG
6,,SING,OP2,HOP2,no,N,6,,97250,18973,8OG
7,,SING,O5',C5',no,N,7,,97250,18973,8OG
8,,SING,C5',C4',no,N,8,,97250,18973,8OG
9,,SING,C5',H5',no,N,9,,97250,18973,8OG
10,,SING,C5',H5'',no,N,10,,97250,18973,8OG
11,,SING,C4',O4',no,N,11,,97250,18973,8OG
12,,SING,C4',C3',no,N,12,,97250,18973,8OG
13,,SING,C4',H4',no,N,13,,97250,18973,8OG
14,,SING,O4',C1',no,N,14,,97250,18973,8OG
15,,SING,C3',O3',no,N,15,,97250,18973,8OG
16,,SING,C3',C2',no,N,16,,97250,18973,8OG
17,,SING,C3',H3',no,N,17,,97250,18973,8OG
18,,SING,O3',HO3',no,N,18,,97250,18973,8OG
19,,SING,C2',C1',no,N,19,,97250,18973,8OG
20,,SING,C2',H2',no,N,20,,97250,18973,8OG
21,,SING,C2',H2'',no,N,21,,97250,18973,8OG
22,,SING,C1',N9,no,N,22,,97250,18973,8OG
23,,SING,C1',H1',no,N,23,,97250,18973,8OG
24,,SING,N9,C8,no,N,24,,97250,18973,8OG
25,,SING,N9,C4,no,N,25,,97250,18973,8OG
26,,SING,C8,N7,no,N,26,,97250,18973,8OG
27,,DOUB,C8,O8,no,N,27,,97250,18973,8OG
28,,SING,N7,C5,no,N,28,,97250,18973,8OG
29,,SING,N7,H7,no,N,29,,97250,18973,8OG
30,,SING,C5,C6,no,N,30,,97250,18973,8OG
31,,DOUB,C5,C4,no,N,31,,97250,18973,8OG
32,,DOUB,C6,O6,no,N,32,,97250,18973,8OG
33,,SING,C6,N1,no,N,33,,97250,18973,8OG
34,,SING,N1,C2,no,N,34,,97250,18973,8OG
35,,SING,N1,H1,no,N,35,,97250,18973,8OG
36,,SING,C2,N2,no,N,36,,97250,18973,8OG
37,,DOUB,C2,N3,no,N,37,,97250,18973,8OG
38,,SING,N2,H21,no,N,38,,97250,18973,8OG
39,,SING,N2,H22,no,N,39,,97250,18973,8OG
40,,SING,N3,C4,no,N,40,,97250,18973,8OG
1,,SING,C1,O1,no,N,1,,97251,18973,ORP
2,,SING,C1,C2,no,N,2,,97251,18973,ORP
3,,SING,C1,O4,no,N,3,,97251,18973,ORP
4,,SING,C1,H1,no,N,4,,97251,18973,ORP
5,,SING,O1,HO1,no,N,5,,97251,18973,ORP
6,,SING,C2,C3,no,N,6,,97251,18973,ORP
7,,SING,C2,H21,no,N,7,,97251,18973,ORP
8,,SING,C2,H22,no,N,8,,97251,18973,ORP
9,,SING,C3,O3,no,N,9,,97251,18973,ORP
10,,SING,C3,C4,no,N,10,,97251,18973,ORP
11,,SING,C3,H3,no,N,11,,97251,18973,ORP
12,,SING,O3,HO3,no,N,12,,97251,18973,ORP
13,,SING,C4,O4,no,N,13,,97251,18973,ORP
14,,SING,C4,C5,no,N,14,,97251,18973,ORP
15,,SING,C4,H4,no,N,15,,97251,18973,ORP
16,,SING,C5,O5,no,N,16,,97251,18973,ORP
17,,SING,C5,H51,no,N,17,,97251,18973,ORP
18,,SING,C5,H52,no,N,18,,97251,18973,ORP
19,,SING,O5,P,no,N,19,,97251,18973,ORP
20,,DOUB,P,O1P,no,N,20,,97251,18973,ORP
21,,SING,P,O2P,no,N,21,,97251,18973,ORP
22,,SING,P,O3P,no,N,22,,97251,18973,ORP
23,,SING,O2P,HOP2,no,N,23,,97251,18973,ORP
24,,SING,O3P,HOP3,no,N,24,,97251,18973,ORP
1,,SING,N1,C2,no,N,1,,97267,18974,PSU
2,,SING,N1,C6,no,N,2,,97267,18974,PSU
3,,SING,N1,HN1,no,N,3,,97267,18974,PSU
4,,SING,C2,N3,no,N,4,,97267,18974,PSU
5,,DOUB,C2,O2,no,N,5,,97267,18974,PSU
6,,SING,N3,C4,no,N,6,,97267,18974,PSU
7,,SING,N3,HN3,no,N,7,,97267,18974,PSU
8,,SING,C4,C5,no,N,8,,97267,18974,PSU
9,,DOUB,C4,O4,no,N,9,,97267,18974,PSU
10,,DOUB,C5,C6,no,N,10,,97267,18974,PSU
11,,SING,C5,C1',no,N,11,,97267,18974,PSU
12,,SING,C6,H6,no,N,12,,97267,18974,PSU
13,,SING,C1',C2',no,N,13,,97267,18974,PSU
14,,SING,C1',O4',no,N,14,,97267,18974,PSU
15,,SING,C1',H1',no,N,15,,97267,18974,PSU
16,,SING,C2',O2',no,N,16,,97267,18974,PSU
17,,SING,C2',C3',no,N,17,,97267,18974,PSU
18,,SING,C2',H2',no,N,18,,97267,18974,PSU
19,,SING,O2',HO2',no,N,19,,97267,18974,PSU
20,,SING,C3',C4',no,N,20,,97267,18974,PSU
21,,SING,C3',O3',no,N,21,,97267,18974,PSU
22,,SING,C3',H3',no,N,22,,97267,18974,PSU
23,,SING,C4',O4',no,N,23,,97267,18974,PSU
24,,SING,C4',C5',no,N,24,,97267,18974,PSU
25,,SING,C4',H4',no,N,25,,97267,18974,PSU
26,,SING,O3',HO3',no,N,26,,97267,18974,PSU
27,,SING,C5',O5',no,N,27,,97267,18974,PSU
28,,SING,C5',H5',no,N,28,,97267,18974,PSU
29,,SING,C5',H5'',no,N,29,,97267,18974,PSU
30,,SING,O5',P,no,N,30,,97267,18974,PSU
31,,DOUB,P,OP1,no,N,31,,97267,18974,PSU
32,,SING,P,OP2,no,N,32,,97267,18974,PSU
33,,SING,P,OP3,no,N,33,,97267,18974,PSU
34,,SING,OP2,HOP2,no,N,34,,97267,18974,PSU
35,,SING,OP3,HOP3,no,N,35,,97267,18974,PSU
1,,DOUB,P,O1,no,N,1,,97334,18977,PO4
2,,SING,P,O2,no,N,2,,97334,18977,PO4
3,,SING,P,O3,no,N,3,,97334,18977,PO4
4,,SING,P,O4,no,N,4,,97334,18977,PO4
1,,SING,C1,O1,no,N,1,,97380,18979,ORP
2,,SING,C1,C2,no,N,2,,97380,18979,ORP
3,,SING,C1,O4,no,N,3,,97380,18979,ORP
4,,SING,C1,H1,no,N,4,,97380,18979,ORP
5,,SING,O1,HO1,no,N,5,,97380,18979,ORP
6,,SING,C2,C3,no,N,6,,97380,18979,ORP
7,,SING,C2,H21,no,N,7,,97380,18979,ORP
8,,SING,C2,H22,no,N,8,,97380,18979,ORP
9,,SING,C3,O3,no,N,9,,97380,18979,ORP
10,,SING,C3,C4,no,N,10,,97380,18979,ORP
11,,SING,C3,H3,no,N,11,,97380,18979,ORP
12,,SING,O3,HO3,no,N,12,,97380,18979,ORP
13,,SING,C4,O4,no,N,13,,97380,18979,ORP
14,,SING,C4,C5,no,N,14,,97380,18979,ORP
15,,SING,C4,H4,no,N,15,,97380,18979,ORP
16,,SING,C5,O5,no,N,16,,97380,18979,ORP
17,,SING,C5,H51,no,N,17,,97380,18979,ORP
18,,SING,C5,H52,no,N,18,,97380,18979,ORP
19,,SING,O5,P,no,N,19,,97380,18979,ORP
20,,DOUB,P,O1P,no,N,20,,97380,18979,ORP
21,,SING,P,O2P,no,N,21,,97380,18979,ORP
22,,SING,P,O3P,no,N,22,,97380,18979,ORP
23,,SING,O2P,HOP2,no,N,23,,97380,18979,ORP
24,,SING,O3P,HOP3,no,N,24,,97380,18979,ORP
1,,SING,OP3,P,no,N,1,,97381,18979,8OG
2,,SING,OP3,HOP3,no,N,2,,97381,18979,8OG
3,,DOUB,P,OP1,no,N,3,,97381,18979,8OG
4,,SING,P,OP2,no,N,4,,97381,18979,8OG
5,,SING,P,O5',no,N,5,,97381,18979,8OG
6,,SING,OP2,HOP2,no,N,6,,97381,18979,8OG
7,,SING,O5',C5',no,N,7,,97381,18979,8OG
8,,SING,C5',C4',no,N,8,,97381,18979,8OG
9,,SING,C5',H5',no,N,9,,97381,18979,8OG
10,,SING,C5',H5'',no,N,10,,97381,18979,8OG
11,,SING,C4',O4',no,N,11,,97381,18979,8OG
12,,SING,C4',C3',no,N,12,,97381,18979,8OG
13,,SING,C4',H4',no,N,13,,97381,18979,8OG
14,,SING,O4',C1',no,N,14,,97381,18979,8OG
15,,SING,C3',O3',no,N,15,,97381,18979,8OG
16,,SING,C3',C2',no,N,16,,97381,18979,8OG
17,,SING,C3',H3',no,N,17,,97381,18979,8OG
18,,SING,O3',HO3',no,N,18,,97381,18979,8OG
19,,SING,C2',C1',no,N,19,,97381,18979,8OG
20,,SING,C2',H2',no,N,20,,97381,18979,8OG
21,,SING,C2',H2'',no,N,21,,97381,18979,8OG
22,,SING,C1',N9,no,N,22,,97381,18979,8OG
23,,SING,C1',H1',no,N,23,,97381,18979,8OG
24,,SING,N9,C8,no,N,24,,97381,18979,8OG
25,,SING,N9,C4,no,N,25,,97381,18979,8OG
26,,SING,C8,N7,no,N,26,,97381,18979,8OG
27,,DOUB,C8,O8,no,N,27,,97381,18979,8OG
28,,SING,N7,C5,no,N,28,,97381,18979,8OG
29,,SING,N7,H7,no,N,29,,97381,18979,8OG
30,,SING,C5,C6,no,N,30,,97381,18979,8OG
31,,DOUB,C5,C4,no,N,31,,97381,18979,8OG
32,,DOUB,C6,O6,no,N,32,,97381,18979,8OG
33,,SING,C6,N1,no,N,33,,97381,18979,8OG
34,,SING,N1,C2,no,N,34,,97381,18979,8OG
35,,SING,N1,H1,no,N,35,,97381,18979,8OG
36,,SING,C2,N2,no,N,36,,97381,18979,8OG
37,,DOUB,C2,N3,no,N,37,,97381,18979,8OG
38,,SING,N2,H21,no,N,38,,97381,18979,8OG
39,,SING,N2,H22,no,N,39,,97381,18979,8OG
40,,SING,N3,C4,no,N,40,,97381,18979,8OG
1,,DOUB,C1,C2,yes,N,1,,97399,18980,1HF
2,,SING,C1,C,yes,N,2,,97399,18980,1HF
3,,SING,N2,C,no,N,3,,97399,18980,1HF
4,,SING,N2,C8,no,N,4,,97399,18980,1HF
5,,SING,C2,C3,yes,N,5,,97399,18980,1HF
6,,DOUB,C,C5,yes,N,6,,97399,18980,1HF
7,,DOUB,O,C8,no,N,7,,97399,18980,1HF
8,,SING,C8,C6,no,N,8,,97399,18980,1HF
9,,DOUB,O3,S1,no,N,9,,97399,18980,1HF
10,,SING,C3,S1,no,N,10,,97399,18980,1HF
11,,DOUB,C3,C4,yes,N,11,,97399,18980,1HF
12,,SING,C5,C6,no,N,12,,97399,18980,1HF
13,,SING,C5,C4,yes,N,13,,97399,18980,1HF
14,,DOUB,C6,N,no,E,14,,97399,18980,1HF
15,,DOUB,S1,O5,no,N,15,,97399,18980,1HF
16,,SING,S1,O4,no,N,16,,97399,18980,1HF
17,,SING,N,N1,no,N,17,,97399,18980,1HF
18,,DOUB,N1,C7,no,Z,18,,97399,18980,1HF
19,,SING,C7,S,no,N,19,,97399,18980,1HF
20,,SING,C7,N3,no,N,20,,97399,18980,1HF
21,,SING,S,C9,no,N,21,,97399,18980,1HF
22,,SING,N3,C12,no,N,22,,97399,18980,1HF
23,,SING,O2,C13,yes,N,23,,97399,18980,1HF
24,,SING,O2,C11,yes,N,24,,97399,18980,1HF
25,,DOUB,C13,C14,yes,N,25,,97399,18980,1HF
26,,SING,C9,C12,no,N,26,,97399,18980,1HF
27,,DOUB,C9,C10,no,Z,27,,97399,18980,1HF
28,,DOUB,C12,O1,no,N,28,,97399,18980,1HF
29,,SING,C11,C10,no,N,29,,97399,18980,1HF
30,,DOUB,C11,C15,yes,N,30,,97399,18980,1HF
31,,SING,C14,C15,yes,N,31,,97399,18980,1HF
32,,SING,C10,H9,no,N,32,,97399,18980,1HF
33,,SING,C13,H12,no,N,33,,97399,18980,1HF
34,,SING,C4,H4,no,N,34,,97399,18980,1HF
35,,SING,C2,H6,no,N,35,,97399,18980,1HF
36,,SING,C1,H7,no,N,36,,97399,18980,1HF
37,,SING,N2,H1,no,N,37,,97399,18980,1HF
38,,SING,N3,H8,no,N,38,,97399,18980,1HF
39,,SING,C14,H11,no,N,39,,97399,18980,1HF
40,,SING,C15,H10,no,N,40,,97399,18980,1HF
41,,SING,O4,H2,no,N,41,,97399,18980,1HF
1,,SING,O5',P,no,N,1,,97416,18981,3DR
2,,SING,O5',C5',no,N,2,,97416,18981,3DR
3,,DOUB,P,OP1,no,N,3,,97416,18981,3DR
4,,SING,P,OP2,no,N,4,,97416,18981,3DR
5,,SING,P,OP3,no,N,5,,97416,18981,3DR
6,,SING,OP2,HOP2,no,N,6,,97416,18981,3DR
7,,SING,OP3,HOP3,no,N,7,,97416,18981,3DR
8,,SING,C2',C1',no,N,8,,97416,18981,3DR
9,,SING,C2',C3',no,N,9,,97416,18981,3DR
10,,SING,C2',H2',no,N,10,,97416,18981,3DR
11,,SING,C2',H2'',no,N,11,,97416,18981,3DR
12,,SING,C5',C4',no,N,12,,97416,18981,3DR
13,,SING,C5',H5',no,N,13,,97416,18981,3DR
14,,SING,C5',H5'',no,N,14,,97416,18981,3DR
15,,SING,C4',O4',no,N,15,,97416,18981,3DR
16,,SING,C4',C3',no,N,16,,97416,18981,3DR
17,,SING,C4',H4'1,no,N,17,,97416,18981,3DR
18,,SING,O4',C1',no,N,18,,97416,18981,3DR
19,,SING,C1',H1'1,no,N,19,,97416,18981,3DR
20,,SING,C1',H1'2,no,N,20,,97416,18981,3DR
21,,SING,C3',O3',no,N,21,,97416,18981,3DR
22,,SING,C3',H3',no,N,22,,97416,18981,3DR
23,,SING,O3',HO3',no,N,23,,97416,18981,3DR
1,,SING,OP3,P,no,N,1,,97417,18981,8OG
2,,SING,OP3,HOP3,no,N,2,,97417,18981,8OG
3,,DOUB,P,OP1,no,N,3,,97417,18981,8OG
4,,SING,P,OP2,no,N,4,,97417,18981,8OG
5,,SING,P,O5',no,N,5,,97417,18981,8OG
6,,SING,OP2,HOP2,no,N,6,,97417,18981,8OG
7,,SING,O5',C5',no,N,7,,97417,18981,8OG
8,,SING,C5',C4',no,N,8,,97417,18981,8OG
9,,SING,C5',H5',no,N,9,,97417,18981,8OG
10,,SING,C5',H5'',no,N,10,,97417,18981,8OG
11,,SING,C4',O4',no,N,11,,97417,18981,8OG
12,,SING,C4',C3',no,N,12,,97417,18981,8OG
13,,SING,C4',H4',no,N,13,,97417,18981,8OG
14,,SING,O4',C1',no,N,14,,97417,18981,8OG
15,,SING,C3',O3',no,N,15,,97417,18981,8OG
16,,SING,C3',C2',no,N,16,,97417,18981,8OG
17,,SING,C3',H3',no,N,17,,97417,18981,8OG
18,,SING,O3',HO3',no,N,18,,97417,18981,8OG
19,,SING,C2',C1',no,N,19,,97417,18981,8OG
20,,SING,C2',H2',no,N,20,,97417,18981,8OG
21,,SING,C2',H2'',no,N,21,,97417,18981,8OG
22,,SING,C1',N9,no,N,22,,97417,18981,8OG
23,,SING,C1',H1',no,N,23,,97417,18981,8OG
24,,SING,N9,C8,no,N,24,,97417,18981,8OG
25,,SING,N9,C4,no,N,25,,97417,18981,8OG
26,,SING,C8,N7,no,N,26,,97417,18981,8OG
27,,DOUB,C8,O8,no,N,27,,97417,18981,8OG
28,,SING,N7,C5,no,N,28,,97417,18981,8OG
29,,SING,N7,H7,no,N,29,,97417,18981,8OG
30,,SING,C5,C6,no,N,30,,97417,18981,8OG
31,,DOUB,C5,C4,no,N,31,,97417,18981,8OG
32,,DOUB,C6,O6,no,N,32,,97417,18981,8OG
33,,SING,C6,N1,no,N,33,,97417,18981,8OG
34,,SING,N1,C2,no,N,34,,97417,18981,8OG
35,,SING,N1,H1,no,N,35,,97417,18981,8OG
36,,SING,C2,N2,no,N,36,,97417,18981,8OG
37,,DOUB,C2,N3,no,N,37,,97417,18981,8OG
38,,SING,N2,H21,no,N,38,,97417,18981,8OG
39,,SING,N2,H22,no,N,39,,97417,18981,8OG
40,,SING,N3,C4,no,N,40,,97417,18981,8OG
1,,SING,C1,O1,no,N,1,,97456,18984,ORP
2,,SING,C1,C2,no,N,2,,97456,18984,ORP
3,,SING,C1,O4,no,N,3,,97456,18984,ORP
4,,SING,C1,H1,no,N,4,,97456,18984,ORP
5,,SING,O1,HO1,no,N,5,,97456,18984,ORP
6,,SING,C2,C3,no,N,6,,97456,18984,ORP
7,,SING,C2,H21,no,N,7,,97456,18984,ORP
8,,SING,C2,H22,no,N,8,,97456,18984,ORP
9,,SING,C3,O3,no,N,9,,97456,18984,ORP
10,,SING,C3,C4,no,N,10,,97456,18984,ORP
11,,SING,C3,H3,no,N,11,,97456,18984,ORP
12,,SING,O3,HO3,no,N,12,,97456,18984,ORP
13,,SING,C4,O4,no,N,13,,97456,18984,ORP
14,,SING,C4,C5,no,N,14,,97456,18984,ORP
15,,SING,C4,H4,no,N,15,,97456,18984,ORP
16,,SING,C5,O5,no,N,16,,97456,18984,ORP
17,,SING,C5,H51,no,N,17,,97456,18984,ORP
18,,SING,C5,H52,no,N,18,,97456,18984,ORP
19,,SING,O5,P,no,N,19,,97456,18984,ORP
20,,DOUB,P,O1P,no,N,20,,97456,18984,ORP
21,,SING,P,O2P,no,N,21,,97456,18984,ORP
22,,SING,P,O3P,no,N,22,,97456,18984,ORP
23,,SING,O2P,HOP2,no,N,23,,97456,18984,ORP
24,,SING,O3P,HOP3,no,N,24,,97456,18984,ORP
1,,SING,OP3,P,no,N,1,,97457,18984,8OG
2,,SING,OP3,HOP3,no,N,2,,97457,18984,8OG
3,,DOUB,P,OP1,no,N,3,,97457,18984,8OG
4,,SING,P,OP2,no,N,4,,97457,18984,8OG
5,,SING,P,O5',no,N,5,,97457,18984,8OG
6,,SING,OP2,HOP2,no,N,6,,97457,18984,8OG
7,,SING,O5',C5',no,N,7,,97457,18984,8OG
8,,SING,C5',C4',no,N,8,,97457,18984,8OG
9,,SING,C5',H5',no,N,9,,97457,18984,8OG
10,,SING,C5',H5'',no,N,10,,97457,18984,8OG
11,,SING,C4',O4',no,N,11,,97457,18984,8OG
12,,SING,C4',C3',no,N,12,,97457,18984,8OG
13,,SING,C4',H4',no,N,13,,97457,18984,8OG
14,,SING,O4',C1',no,N,14,,97457,18984,8OG
15,,SING,C3',O3',no,N,15,,97457,18984,8OG
16,,SING,C3',C2',no,N,16,,97457,18984,8OG
17,,SING,C3',H3',no,N,17,,97457,18984,8OG
18,,SING,O3',HO3',no,N,18,,97457,18984,8OG
19,,SING,C2',C1',no,N,19,,97457,18984,8OG
20,,SING,C2',H2',no,N,20,,97457,18984,8OG
21,,SING,C2',H2'',no,N,21,,97457,18984,8OG
22,,SING,C1',N9,no,N,22,,97457,18984,8OG
23,,SING,C1',H1',no,N,23,,97457,18984,8OG
24,,SING,N9,C8,no,N,24,,97457,18984,8OG
25,,SING,N9,C4,no,N,25,,97457,18984,8OG
26,,SING,C8,N7,no,N,26,,97457,18984,8OG
27,,DOUB,C8,O8,no,N,27,,97457,18984,8OG
28,,SING,N7,C5,no,N,28,,97457,18984,8OG
29,,SING,N7,H7,no,N,29,,97457,18984,8OG
30,,SING,C5,C6,no,N,30,,97457,18984,8OG
31,,DOUB,C5,C4,no,N,31,,97457,18984,8OG
32,,DOUB,C6,O6,no,N,32,,97457,18984,8OG
33,,SING,C6,N1,no,N,33,,97457,18984,8OG
34,,SING,N1,C2,no,N,34,,97457,18984,8OG
35,,SING,N1,H1,no,N,35,,97457,18984,8OG
36,,SING,C2,N2,no,N,36,,97457,18984,8OG
37,,DOUB,C2,N3,no,N,37,,97457,18984,8OG
38,,SING,N2,H21,no,N,38,,97457,18984,8OG
39,,SING,N2,H22,no,N,39,,97457,18984,8OG
40,,SING,N3,C4,no,N,40,,97457,18984,8OG
1,,SING,C1,O1,no,N,1,,97473,18985,ORP
2,,SING,C1,C2,no,N,2,,97473,18985,ORP
3,,SING,C1,O4,no,N,3,,97473,18985,ORP
4,,SING,C1,H1,no,N,4,,97473,18985,ORP
5,,SING,O1,HO1,no,N,5,,97473,18985,ORP
6,,SING,C2,C3,no,N,6,,97473,18985,ORP
7,,SING,C2,H21,no,N,7,,97473,18985,ORP
8,,SING,C2,H22,no,N,8,,97473,18985,ORP
9,,SING,C3,O3,no,N,9,,97473,18985,ORP
10,,SING,C3,C4,no,N,10,,97473,18985,ORP
11,,SING,C3,H3,no,N,11,,97473,18985,ORP
12,,SING,O3,HO3,no,N,12,,97473,18985,ORP
13,,SING,C4,O4,no,N,13,,97473,18985,ORP
14,,SING,C4,C5,no,N,14,,97473,18985,ORP
15,,SING,C4,H4,no,N,15,,97473,18985,ORP
16,,SING,C5,O5,no,N,16,,97473,18985,ORP
17,,SING,C5,H51,no,N,17,,97473,18985,ORP
18,,SING,C5,H52,no,N,18,,97473,18985,ORP
19,,SING,O5,P,no,N,19,,97473,18985,ORP
20,,DOUB,P,O1P,no,N,20,,97473,18985,ORP
21,,SING,P,O2P,no,N,21,,97473,18985,ORP
22,,SING,P,O3P,no,N,22,,97473,18985,ORP
23,,SING,O2P,HOP2,no,N,23,,97473,18985,ORP
24,,SING,O3P,HOP3,no,N,24,,97473,18985,ORP
1,,SING,OP3,P,no,N,1,,97474,18985,8OG
2,,SING,OP3,HOP3,no,N,2,,97474,18985,8OG
3,,DOUB,P,OP1,no,N,3,,97474,18985,8OG
4,,SING,P,OP2,no,N,4,,97474,18985,8OG
5,,SING,P,O5',no,N,5,,97474,18985,8OG
6,,SING,OP2,HOP2,no,N,6,,97474,18985,8OG
7,,SING,O5',C5',no,N,7,,97474,18985,8OG
8,,SING,C5',C4',no,N,8,,97474,18985,8OG
9,,SING,C5',H5',no,N,9,,97474,18985,8OG
10,,SING,C5',H5'',no,N,10,,97474,18985,8OG
11,,SING,C4',O4',no,N,11,,97474,18985,8OG
12,,SING,C4',C3',no,N,12,,97474,18985,8OG
13,,SING,C4',H4',no,N,13,,97474,18985,8OG
14,,SING,O4',C1',no,N,14,,97474,18985,8OG
15,,SING,C3',O3',no,N,15,,97474,18985,8OG
16,,SING,C3',C2',no,N,16,,97474,18985,8OG
17,,SING,C3',H3',no,N,17,,97474,18985,8OG
18,,SING,O3',HO3',no,N,18,,97474,18985,8OG
19,,SING,C2',C1',no,N,19,,97474,18985,8OG
20,,SING,C2',H2',no,N,20,,97474,18985,8OG
21,,SING,C2',H2'',no,N,21,,97474,18985,8OG
22,,SING,C1',N9,no,N,22,,97474,18985,8OG
23,,SING,C1',H1',no,N,23,,97474,18985,8OG
24,,SING,N9,C8,no,N,24,,97474,18985,8OG
25,,SING,N9,C4,no,N,25,,97474,18985,8OG
26,,SING,C8,N7,no,N,26,,97474,18985,8OG
27,,DOUB,C8,O8,no,N,27,,97474,18985,8OG
28,,SING,N7,C5,no,N,28,,97474,18985,8OG
29,,SING,N7,H7,no,N,29,,97474,18985,8OG
30,,SING,C5,C6,no,N,30,,97474,18985,8OG
31,,DOUB,C5,C4,no,N,31,,97474,18985,8OG
32,,DOUB,C6,O6,no,N,32,,97474,18985,8OG
33,,SING,C6,N1,no,N,33,,97474,18985,8OG
34,,SING,N1,C2,no,N,34,,97474,18985,8OG
35,,SING,N1,H1,no,N,35,,97474,18985,8OG
36,,SING,C2,N2,no,N,36,,97474,18985,8OG
37,,DOUB,C2,N3,no,N,37,,97474,18985,8OG
38,,SING,N2,H21,no,N,38,,97474,18985,8OG
39,,SING,N2,H22,no,N,39,,97474,18985,8OG
40,,SING,N3,C4,no,N,40,,97474,18985,8OG
1,,SING,FE1,S1,no,N,1,,97606,18991,FES
2,,SING,FE1,S2,no,N,2,,97606,18991,FES
3,,SING,FE2,S1,no,N,3,,97606,18991,FES
4,,SING,FE2,S2,no,N,4,,97606,18991,FES
1,,SING,FE1,S1,no,N,1,,97625,18992,FES
2,,SING,FE1,S2,no,N,2,,97625,18992,FES
3,,SING,FE2,S1,no,N,3,,97625,18992,FES
4,,SING,FE2,S2,no,N,4,,97625,18992,FES
1,,SING,FE,NA,no,N,1,,97736,190,HEC
2,,SING,FE,NB,no,N,2,,97736,190,HEC
3,,SING,FE,NC,no,N,3,,97736,190,HEC
4,,SING,FE,ND,no,N,4,,97736,190,HEC
5,,DOUB,CHA,C1A,no,N,5,,97736,190,HEC
6,,SING,CHA,C4D,no,N,6,,97736,190,HEC
7,,SING,CHA,HHA,no,N,7,,97736,190,HEC
8,,DOUB,CHB,C4A,no,N,8,,97736,190,HEC
9,,SING,CHB,C1B,no,N,9,,97736,190,HEC
10,,SING,CHB,HHB,no,N,10,,97736,190,HEC
11,,DOUB,CHC,C4B,no,N,11,,97736,190,HEC
12,,SING,CHC,C1C,no,N,12,,97736,190,HEC
13,,SING,CHC,HHC,no,N,13,,97736,190,HEC
14,,DOUB,CHD,C4C,no,N,14,,97736,190,HEC
15,,SING,CHD,C1D,no,N,15,,97736,190,HEC
16,,SING,CHD,HHD,no,N,16,,97736,190,HEC
17,,SING,NA,C1A,yes,N,17,,97736,190,HEC
18,,SING,NA,C4A,yes,N,18,,97736,190,HEC
19,,SING,C1A,C2A,yes,N,19,,97736,190,HEC
20,,DOUB,C2A,C3A,yes,N,20,,97736,190,HEC
21,,SING,C2A,CAA,no,N,21,,97736,190,HEC
22,,SING,C3A,C4A,yes,N,22,,97736,190,HEC
23,,SING,C3A,CMA,no,N,23,,97736,190,HEC
24,,SING,CMA,HMA1,no,N,24,,97736,190,HEC
25,,SING,CMA,HMA2,no,N,25,,97736,190,HEC
26,,SING,CMA,HMA3,no,N,26,,97736,190,HEC
27,,SING,CAA,CBA,no,N,27,,97736,190,HEC
28,,SING,CAA,HAA1,no,N,28,,97736,190,HEC
29,,SING,CAA,HAA2,no,N,29,,97736,190,HEC
30,,SING,CBA,CGA,no,N,30,,97736,190,HEC
31,,SING,CBA,HBA1,no,N,31,,97736,190,HEC
32,,SING,CBA,HBA2,no,N,32,,97736,190,HEC
33,,DOUB,CGA,O1A,no,N,33,,97736,190,HEC
34,,SING,CGA,O2A,no,N,34,,97736,190,HEC
35,,SING,O2A,H2A,no,N,35,,97736,190,HEC
9,,SING,C3,C5,,,,,240371,6145,TPLi
36,,SING,NB,C1B,yes,N,36,,97736,190,HEC
37,,SING,NB,C4B,yes,N,37,,97736,190,HEC
38,,DOUB,C1B,C2B,yes,N,38,,97736,190,HEC
39,,SING,C2B,C3B,yes,N,39,,97736,190,HEC
40,,SING,C2B,CMB,no,N,40,,97736,190,HEC
41,,SING,C3B,C4B,yes,N,41,,97736,190,HEC
42,,DOUB,C3B,CAB,no,E,42,,97736,190,HEC
43,,SING,CMB,HMB1,no,N,43,,97736,190,HEC
44,,SING,CMB,HMB2,no,N,44,,97736,190,HEC
45,,SING,CMB,HMB3,no,N,45,,97736,190,HEC
46,,SING,CAB,CBB,no,N,46,,97736,190,HEC
47,,SING,CAB,HAB,no,N,47,,97736,190,HEC
48,,SING,CBB,HBB1,no,N,48,,97736,190,HEC
49,,SING,CBB,HBB2,no,N,49,,97736,190,HEC
50,,SING,CBB,HBB3,no,N,50,,97736,190,HEC
51,,SING,NC,C1C,yes,N,51,,97736,190,HEC
52,,SING,NC,C4C,yes,N,52,,97736,190,HEC
53,,DOUB,C1C,C2C,yes,N,53,,97736,190,HEC
54,,SING,C2C,C3C,yes,N,54,,97736,190,HEC
55,,SING,C2C,CMC,no,N,55,,97736,190,HEC
56,,SING,C3C,C4C,yes,N,56,,97736,190,HEC
57,,DOUB,C3C,CAC,no,E,57,,97736,190,HEC
58,,SING,CMC,HMC1,no,N,58,,97736,190,HEC
59,,SING,CMC,HMC2,no,N,59,,97736,190,HEC
60,,SING,CMC,HMC3,no,N,60,,97736,190,HEC
61,,SING,CAC,CBC,no,N,61,,97736,190,HEC
62,,SING,CAC,HAC,no,N,62,,97736,190,HEC
63,,SING,CBC,HBC1,no,N,63,,97736,190,HEC
64,,SING,CBC,HBC2,no,N,64,,97736,190,HEC
65,,SING,CBC,HBC3,no,N,65,,97736,190,HEC
66,,SING,ND,C1D,yes,N,66,,97736,190,HEC
67,,SING,ND,C4D,yes,N,67,,97736,190,HEC
68,,DOUB,C1D,C2D,yes,N,68,,97736,190,HEC
69,,SING,C2D,C3D,yes,N,69,,97736,190,HEC
70,,SING,C2D,CMD,no,N,70,,97736,190,HEC
71,,DOUB,C3D,C4D,yes,N,71,,97736,190,HEC
72,,SING,C3D,CAD,no,N,72,,97736,190,HEC
73,,SING,CMD,HMD1,no,N,73,,97736,190,HEC
74,,SING,CMD,HMD2,no,N,74,,97736,190,HEC
75,,SING,CMD,HMD3,no,N,75,,97736,190,HEC
76,,SING,CAD,CBD,no,N,76,,97736,190,HEC
77,,SING,CAD,HAD1,no,N,77,,97736,190,HEC
78,,SING,CAD,HAD2,no,N,78,,97736,190,HEC
79,,SING,CBD,CGD,no,N,79,,97736,190,HEC
80,,SING,CBD,HBD1,no,N,80,,97736,190,HEC
81,,SING,CBD,HBD2,no,N,81,,97736,190,HEC
82,,DOUB,CGD,O1D,no,N,82,,97736,190,HEC
83,,SING,CGD,O2D,no,N,83,,97736,190,HEC
84,,SING,O2D,H2D,no,N,84,,97736,190,HEC
1,,SING,N,CA,no,N,1,,97737,190,M3L
2,,SING,N,H,no,N,2,,97737,190,M3L
3,,SING,N,H2,no,N,3,,97737,190,M3L
4,,SING,CA,CB,no,N,4,,97737,190,M3L
5,,SING,CA,C,no,N,5,,97737,190,M3L
6,,SING,CA,HA,no,N,6,,97737,190,M3L
7,,SING,CB,CG,no,N,7,,97737,190,M3L
8,,SING,CB,HB2,no,N,8,,97737,190,M3L
9,,SING,CB,HB3,no,N,9,,97737,190,M3L
10,,SING,CG,CD,no,N,10,,97737,190,M3L
11,,SING,CG,HG2,no,N,11,,97737,190,M3L
12,,SING,CG,HG3,no,N,12,,97737,190,M3L
13,,SING,CD,CE,no,N,13,,97737,190,M3L
14,,SING,CD,HD2,no,N,14,,97737,190,M3L
15,,SING,CD,HD3,no,N,15,,97737,190,M3L
16,,SING,CE,NZ,no,N,16,,97737,190,M3L
17,,SING,CE,HE2,no,N,17,,97737,190,M3L
18,,SING,CE,HE3,no,N,18,,97737,190,M3L
19,,SING,NZ,CM1,no,N,19,,97737,190,M3L
20,,SING,NZ,CM2,no,N,20,,97737,190,M3L
21,,SING,NZ,CM3,no,N,21,,97737,190,M3L
22,,DOUB,C,O,no,N,22,,97737,190,M3L
23,,SING,C,OXT,no,N,23,,97737,190,M3L
24,,SING,OXT,HXT,no,N,24,,97737,190,M3L
25,,SING,CM1,HM11,no,N,25,,97737,190,M3L
26,,SING,CM1,HM12,no,N,26,,97737,190,M3L
27,,SING,CM1,HM13,no,N,27,,97737,190,M3L
28,,SING,CM2,HM21,no,N,28,,97737,190,M3L
29,,SING,CM2,HM22,no,N,29,,97737,190,M3L
30,,SING,CM2,HM23,no,N,30,,97737,190,M3L
31,,SING,CM3,HM31,no,N,31,,97737,190,M3L
32,,SING,CM3,HM32,no,N,32,,97737,190,M3L
33,,SING,CM3,HM33,no,N,33,,97737,190,M3L
1,,SING,CHA,C1A,yes,N,1,,97846,19004,HEM
2,,DOUB,CHA,C4D,yes,N,2,,97846,19004,HEM
3,,SING,CHA,HHA,no,N,3,,97846,19004,HEM
4,,SING,CHB,C4A,yes,N,4,,97846,19004,HEM
5,,DOUB,CHB,C1B,yes,N,5,,97846,19004,HEM
6,,SING,CHB,HHB,no,N,6,,97846,19004,HEM
7,,SING,CHC,C4B,yes,N,7,,97846,19004,HEM
8,,DOUB,CHC,C1C,yes,N,8,,97846,19004,HEM
9,,SING,CHC,HHC,no,N,9,,97846,19004,HEM
10,,DOUB,CHD,C4C,yes,N,10,,97846,19004,HEM
11,,SING,CHD,C1D,yes,N,11,,97846,19004,HEM
12,,SING,CHD,HHD,no,N,12,,97846,19004,HEM
13,,DOUB,C1A,C2A,yes,N,13,,97846,19004,HEM
14,,SING,C1A,NA,yes,N,14,,97846,19004,HEM
15,,SING,C2A,C3A,yes,N,15,,97846,19004,HEM
16,,SING,C2A,CAA,no,N,16,,97846,19004,HEM
17,,DOUB,C3A,C4A,yes,N,17,,97846,19004,HEM
18,,SING,C3A,CMA,no,N,18,,97846,19004,HEM
19,,SING,C4A,NA,yes,N,19,,97846,19004,HEM
20,,SING,CMA,HMA,no,N,20,,97846,19004,HEM
21,,SING,CMA,HMAA,no,N,21,,97846,19004,HEM
22,,SING,CMA,HMAB,no,N,22,,97846,19004,HEM
23,,SING,CAA,CBA,no,N,23,,97846,19004,HEM
24,,SING,CAA,HAA,no,N,24,,97846,19004,HEM
25,,SING,CAA,HAAA,no,N,25,,97846,19004,HEM
26,,SING,CBA,CGA,no,N,26,,97846,19004,HEM
27,,SING,CBA,HBA,no,N,27,,97846,19004,HEM
28,,SING,CBA,HBAA,no,N,28,,97846,19004,HEM
29,,DOUB,CGA,O1A,no,N,29,,97846,19004,HEM
30,,SING,CGA,O2A,no,N,30,,97846,19004,HEM
31,,SING,C1B,C2B,no,N,31,,97846,19004,HEM
32,,SING,C1B,NB,yes,N,32,,97846,19004,HEM
33,,DOUB,C2B,C3B,yes,N,33,,97846,19004,HEM
34,,SING,C2B,CMB,yes,N,34,,97846,19004,HEM
35,,SING,C3B,C4B,no,N,35,,97846,19004,HEM
36,,SING,C3B,CAB,yes,N,36,,97846,19004,HEM
37,,DOUB,C4B,NB,no,N,37,,97846,19004,HEM
38,,SING,CMB,HMB,yes,N,38,,97846,19004,HEM
39,,SING,CMB,HMBA,no,N,39,,97846,19004,HEM
40,,SING,CMB,HMBB,no,N,40,,97846,19004,HEM
41,,DOUB,CAB,CBB,no,N,41,,97846,19004,HEM
42,,SING,CAB,HAB,no,N,42,,97846,19004,HEM
43,,SING,CBB,HBB,no,N,43,,97846,19004,HEM
44,,SING,CBB,HBBA,no,N,44,,97846,19004,HEM
45,,SING,C1C,C2C,no,N,45,,97846,19004,HEM
46,,SING,C1C,NC,yes,N,46,,97846,19004,HEM
47,,DOUB,C2C,C3C,yes,N,47,,97846,19004,HEM
48,,SING,C2C,CMC,yes,N,48,,97846,19004,HEM
49,,SING,C3C,C4C,no,N,49,,97846,19004,HEM
50,,SING,C3C,CAC,yes,N,50,,97846,19004,HEM
51,,SING,C4C,NC,no,N,51,,97846,19004,HEM
52,,SING,CMC,HMC,yes,N,52,,97846,19004,HEM
53,,SING,CMC,HMCA,no,N,53,,97846,19004,HEM
54,,SING,CMC,HMCB,no,N,54,,97846,19004,HEM
55,,DOUB,CAC,CBC,no,N,55,,97846,19004,HEM
56,,SING,CAC,HAC,no,N,56,,97846,19004,HEM
57,,SING,CBC,HBC,no,N,57,,97846,19004,HEM
58,,SING,CBC,HBCA,no,N,58,,97846,19004,HEM
59,,SING,C1D,C2D,no,N,59,,97846,19004,HEM
60,,DOUB,C1D,ND,yes,N,60,,97846,19004,HEM
61,,DOUB,C2D,C3D,yes,N,61,,97846,19004,HEM
62,,SING,C2D,CMD,yes,N,62,,97846,19004,HEM
63,,SING,C3D,C4D,no,N,63,,97846,19004,HEM
64,,SING,C3D,CAD,yes,N,64,,97846,19004,HEM
65,,SING,C4D,ND,no,N,65,,97846,19004,HEM
66,,SING,CMD,HMD,yes,N,66,,97846,19004,HEM
67,,SING,CMD,HMDA,no,N,67,,97846,19004,HEM
68,,SING,CMD,HMDB,no,N,68,,97846,19004,HEM
69,,SING,CAD,CBD,no,N,69,,97846,19004,HEM
70,,SING,CAD,HAD,no,N,70,,97846,19004,HEM
71,,SING,CAD,HADA,no,N,71,,97846,19004,HEM
72,,SING,CBD,CGD,no,N,72,,97846,19004,HEM
73,,SING,CBD,HBD,no,N,73,,97846,19004,HEM
74,,SING,CBD,HBDA,no,N,74,,97846,19004,HEM
75,,DOUB,CGD,O1D,no,N,75,,97846,19004,HEM
76,,SING,CGD,O2D,no,N,76,,97846,19004,HEM
77,,SING,O2A,H2A,no,N,77,,97846,19004,HEM
78,,SING,O2D,H2D,no,N,78,,97846,19004,HEM
79,,SING,FE,NA,no,N,79,,97846,19004,HEM
80,,SING,FE,NB,no,N,80,,97846,19004,HEM
81,,SING,FE,NC,no,N,81,,97846,19004,HEM
82,,SING,FE,ND,no,N,82,,97846,19004,HEM
1,,TRIP,C,N,no,N,1,,97847,19004,CYN
1,,SING,CHA,C1A,yes,N,1,,97866,19005,HEM
2,,DOUB,CHA,C4D,yes,N,2,,97866,19005,HEM
3,,SING,CHA,HHA,no,N,3,,97866,19005,HEM
4,,SING,CHB,C4A,yes,N,4,,97866,19005,HEM
5,,DOUB,CHB,C1B,yes,N,5,,97866,19005,HEM
6,,SING,CHB,HHB,no,N,6,,97866,19005,HEM
7,,SING,CHC,C4B,yes,N,7,,97866,19005,HEM
8,,DOUB,CHC,C1C,yes,N,8,,97866,19005,HEM
9,,SING,CHC,HHC,no,N,9,,97866,19005,HEM
10,,DOUB,CHD,C4C,yes,N,10,,97866,19005,HEM
11,,SING,CHD,C1D,yes,N,11,,97866,19005,HEM
12,,SING,CHD,HHD,no,N,12,,97866,19005,HEM
13,,DOUB,C1A,C2A,yes,N,13,,97866,19005,HEM
14,,SING,C1A,NA,yes,N,14,,97866,19005,HEM
15,,SING,C2A,C3A,yes,N,15,,97866,19005,HEM
16,,SING,C2A,CAA,no,N,16,,97866,19005,HEM
17,,DOUB,C3A,C4A,yes,N,17,,97866,19005,HEM
18,,SING,C3A,CMA,no,N,18,,97866,19005,HEM
19,,SING,C4A,NA,yes,N,19,,97866,19005,HEM
20,,SING,CMA,HMA,no,N,20,,97866,19005,HEM
21,,SING,CMA,HMAA,no,N,21,,97866,19005,HEM
22,,SING,CMA,HMAB,no,N,22,,97866,19005,HEM
23,,SING,CAA,CBA,no,N,23,,97866,19005,HEM
24,,SING,CAA,HAA,no,N,24,,97866,19005,HEM
25,,SING,CAA,HAAA,no,N,25,,97866,19005,HEM
26,,SING,CBA,CGA,no,N,26,,97866,19005,HEM
27,,SING,CBA,HBA,no,N,27,,97866,19005,HEM
28,,SING,CBA,HBAA,no,N,28,,97866,19005,HEM
29,,DOUB,CGA,O1A,no,N,29,,97866,19005,HEM
30,,SING,CGA,O2A,no,N,30,,97866,19005,HEM
31,,SING,C1B,C2B,no,N,31,,97866,19005,HEM
32,,SING,C1B,NB,yes,N,32,,97866,19005,HEM
33,,DOUB,C2B,C3B,yes,N,33,,97866,19005,HEM
34,,SING,C2B,CMB,yes,N,34,,97866,19005,HEM
35,,SING,C3B,C4B,no,N,35,,97866,19005,HEM
36,,SING,C3B,CAB,yes,N,36,,97866,19005,HEM
37,,DOUB,C4B,NB,no,N,37,,97866,19005,HEM
38,,SING,CMB,HMB,yes,N,38,,97866,19005,HEM
39,,SING,CMB,HMBA,no,N,39,,97866,19005,HEM
40,,SING,CMB,HMBB,no,N,40,,97866,19005,HEM
41,,DOUB,CAB,CBB,no,N,41,,97866,19005,HEM
42,,SING,CAB,HAB,no,N,42,,97866,19005,HEM
43,,SING,CBB,HBB,no,N,43,,97866,19005,HEM
44,,SING,CBB,HBBA,no,N,44,,97866,19005,HEM
45,,SING,C1C,C2C,no,N,45,,97866,19005,HEM
46,,SING,C1C,NC,yes,N,46,,97866,19005,HEM
47,,DOUB,C2C,C3C,yes,N,47,,97866,19005,HEM
48,,SING,C2C,CMC,yes,N,48,,97866,19005,HEM
49,,SING,C3C,C4C,no,N,49,,97866,19005,HEM
50,,SING,C3C,CAC,yes,N,50,,97866,19005,HEM
51,,SING,C4C,NC,no,N,51,,97866,19005,HEM
52,,SING,CMC,HMC,yes,N,52,,97866,19005,HEM
53,,SING,CMC,HMCA,no,N,53,,97866,19005,HEM
54,,SING,CMC,HMCB,no,N,54,,97866,19005,HEM
55,,DOUB,CAC,CBC,no,N,55,,97866,19005,HEM
56,,SING,CAC,HAC,no,N,56,,97866,19005,HEM
57,,SING,CBC,HBC,no,N,57,,97866,19005,HEM
58,,SING,CBC,HBCA,no,N,58,,97866,19005,HEM
59,,SING,C1D,C2D,no,N,59,,97866,19005,HEM
60,,DOUB,C1D,ND,yes,N,60,,97866,19005,HEM
61,,DOUB,C2D,C3D,yes,N,61,,97866,19005,HEM
62,,SING,C2D,CMD,yes,N,62,,97866,19005,HEM
63,,SING,C3D,C4D,no,N,63,,97866,19005,HEM
64,,SING,C3D,CAD,yes,N,64,,97866,19005,HEM
65,,SING,C4D,ND,no,N,65,,97866,19005,HEM
66,,SING,CMD,HMD,yes,N,66,,97866,19005,HEM
67,,SING,CMD,HMDA,no,N,67,,97866,19005,HEM
68,,SING,CMD,HMDB,no,N,68,,97866,19005,HEM
69,,SING,CAD,CBD,no,N,69,,97866,19005,HEM
70,,SING,CAD,HAD,no,N,70,,97866,19005,HEM
71,,SING,CAD,HADA,no,N,71,,97866,19005,HEM
72,,SING,CBD,CGD,no,N,72,,97866,19005,HEM
73,,SING,CBD,HBD,no,N,73,,97866,19005,HEM
74,,SING,CBD,HBDA,no,N,74,,97866,19005,HEM
75,,DOUB,CGD,O1D,no,N,75,,97866,19005,HEM
76,,SING,CGD,O2D,no,N,76,,97866,19005,HEM
77,,SING,O2A,H2A,no,N,77,,97866,19005,HEM
78,,SING,O2D,H2D,no,N,78,,97866,19005,HEM
79,,SING,FE,NA,no,N,79,,97866,19005,HEM
80,,SING,FE,NB,no,N,80,,97866,19005,HEM
81,,SING,FE,NC,no,N,81,,97866,19005,HEM
82,,SING,FE,ND,no,N,82,,97866,19005,HEM
1,,TRIP,C,N,no,N,1,,97867,19005,CYN
1,,DOUB,PB,O1B,no,N,1,,98071,19015,GDP
2,,SING,PB,O2B,no,N,2,,98071,19015,GDP
3,,SING,PB,O3B,no,N,3,,98071,19015,GDP
4,,SING,PB,O3A,no,N,4,,98071,19015,GDP
5,,SING,O2B,HOB2,no,N,5,,98071,19015,GDP
6,,SING,O3B,HOB3,no,N,6,,98071,19015,GDP
7,,SING,O3A,PA,no,N,7,,98071,19015,GDP
8,,DOUB,PA,O1A,no,N,8,,98071,19015,GDP
9,,SING,PA,O2A,no,N,9,,98071,19015,GDP
10,,SING,PA,O5',no,N,10,,98071,19015,GDP
11,,SING,O2A,HOA2,no,N,11,,98071,19015,GDP
12,,SING,O5',C5',no,N,12,,98071,19015,GDP
13,,SING,C5',C4',no,N,13,,98071,19015,GDP
14,,SING,C5',H5',no,N,14,,98071,19015,GDP
15,,SING,C5',H5'',no,N,15,,98071,19015,GDP
16,,SING,C4',O4',no,N,16,,98071,19015,GDP
17,,SING,C4',C3',no,N,17,,98071,19015,GDP
18,,SING,C4',H4',no,N,18,,98071,19015,GDP
19,,SING,O4',C1',no,N,19,,98071,19015,GDP
20,,SING,C3',O3',no,N,20,,98071,19015,GDP
21,,SING,C3',C2',no,N,21,,98071,19015,GDP
22,,SING,C3',H3',no,N,22,,98071,19015,GDP
23,,SING,O3',HO3',no,N,23,,98071,19015,GDP
24,,SING,C2',O2',no,N,24,,98071,19015,GDP
25,,SING,C2',C1',no,N,25,,98071,19015,GDP
26,,SING,C2',H2',no,N,26,,98071,19015,GDP
27,,SING,O2',HO2',no,N,27,,98071,19015,GDP
28,,SING,C1',N9,no,N,28,,98071,19015,GDP
29,,SING,C1',H1',no,N,29,,98071,19015,GDP
30,,SING,N9,C8,yes,N,30,,98071,19015,GDP
31,,SING,N9,C4,yes,N,31,,98071,19015,GDP
32,,DOUB,C8,N7,yes,N,32,,98071,19015,GDP
33,,SING,C8,H8,no,N,33,,98071,19015,GDP
34,,SING,N7,C5,yes,N,34,,98071,19015,GDP
35,,SING,C5,C6,no,N,35,,98071,19015,GDP
36,,DOUB,C5,C4,yes,N,36,,98071,19015,GDP
37,,DOUB,C6,O6,no,N,37,,98071,19015,GDP
38,,SING,C6,N1,no,N,38,,98071,19015,GDP
39,,SING,N1,C2,no,N,39,,98071,19015,GDP
40,,SING,N1,HN1,no,N,40,,98071,19015,GDP
41,,SING,C2,N2,no,N,41,,98071,19015,GDP
42,,DOUB,C2,N3,no,N,42,,98071,19015,GDP
43,,SING,N2,HN21,no,N,43,,98071,19015,GDP
44,,SING,N2,HN22,no,N,44,,98071,19015,GDP
45,,SING,N3,C4,no,N,45,,98071,19015,GDP
1,,SING,CA1,CA2,no,N,1,,98105,19018,AM2
2,,SING,CA1,OA4,no,N,2,,98105,19018,AM2
3,,SING,CA1,OA1,no,N,3,,98105,19018,AM2
4,,SING,CA1,HA1,no,N,4,,98105,19018,AM2
5,,SING,CA2,CA3,no,N,5,,98105,19018,AM2
6,,SING,CA2,NA2,no,N,6,,98105,19018,AM2
7,,SING,CA2,HA2,no,N,7,,98105,19018,AM2
8,,SING,CA3,CA4,no,N,8,,98105,19018,AM2
9,,SING,CA3,HA31,no,N,9,,98105,19018,AM2
10,,SING,CA3,HA32,no,N,10,,98105,19018,AM2
11,,SING,CA4,CA5,no,N,11,,98105,19018,AM2
12,,SING,CA4,OA5,no,N,12,,98105,19018,AM2
13,,SING,CA4,HA4,no,N,13,,98105,19018,AM2
14,,SING,CA5,CA6,no,N,14,,98105,19018,AM2
15,,SING,CA5,OA4,no,N,15,,98105,19018,AM2
16,,SING,CA5,HA5,no,N,16,,98105,19018,AM2
17,,SING,CA6,CA7,no,N,17,,98105,19018,AM2
18,,SING,CA6,OA6,no,N,18,,98105,19018,AM2
19,,SING,CA6,HA6,no,N,19,,98105,19018,AM2
20,,SING,CA7,CA8,no,N,20,,98105,19018,AM2
21,,SING,CA7,NA7,no,N,21,,98105,19018,AM2
22,,SING,CA7,HA7,no,N,22,,98105,19018,AM2
23,,SING,CA8,OA5,no,N,23,,98105,19018,AM2
24,,SING,CA8,OA8,no,N,24,,98105,19018,AM2
25,,SING,CA8,HA8,no,N,25,,98105,19018,AM2
26,,SING,CA9,NA7,no,N,26,,98105,19018,AM2
27,,SING,CA9,HA91,no,N,27,,98105,19018,AM2
28,,SING,CA9,HA92,no,N,28,,98105,19018,AM2
29,,SING,CA9,HA93,no,N,29,,98105,19018,AM2
30,,SING,NA2,HA21,no,N,30,,98105,19018,AM2
31,,SING,NA2,HA22,no,N,31,,98105,19018,AM2
32,,SING,NA7,H2,no,N,32,,98105,19018,AM2
33,,SING,OA6,H1,no,N,33,,98105,19018,AM2
34,,SING,OA8,CB1,no,N,34,,98105,19018,AM2
35,,SING,OA1,CC1,no,N,35,,98105,19018,AM2
36,,SING,CB1,CB2,no,N,36,,98105,19018,AM2
37,,SING,CB1,OB1,no,N,37,,98105,19018,AM2
38,,SING,CB1,HB1,no,N,38,,98105,19018,AM2
39,,SING,CB2,CB3,no,N,39,,98105,19018,AM2
40,,SING,CB2,OB2,no,N,40,,98105,19018,AM2
41,,SING,CB2,HB2,no,N,41,,98105,19018,AM2
42,,SING,CB3,CB4,no,N,42,,98105,19018,AM2
43,,SING,CB3,OB3,no,N,43,,98105,19018,AM2
44,,SING,CB3,HB3,no,N,44,,98105,19018,AM2
45,,SING,CB4,CB5,no,N,45,,98105,19018,AM2
46,,SING,CB4,NB4,no,N,46,,98105,19018,AM2
47,,SING,CB4,HB4,no,N,47,,98105,19018,AM2
48,,SING,CB5,CB6,no,N,48,,98105,19018,AM2
49,,SING,CB5,OB1,no,N,49,,98105,19018,AM2
50,,SING,CB5,HB5,no,N,50,,98105,19018,AM2
51,,SING,CB6,OB6,no,N,51,,98105,19018,AM2
52,,SING,CB6,HB61,no,N,52,,98105,19018,AM2
53,,SING,CB6,HB62,no,N,53,,98105,19018,AM2
54,,SING,NB4,HB41,no,N,54,,98105,19018,AM2
55,,SING,NB4,HB42,no,N,55,,98105,19018,AM2
56,,SING,OB2,H5,no,N,56,,98105,19018,AM2
57,,SING,OB3,H6,no,N,57,,98105,19018,AM2
58,,SING,OB6,HB6,no,N,58,,98105,19018,AM2
59,,SING,CC1,CC2,no,N,59,,98105,19018,AM2
60,,SING,CC1,CC6,no,N,60,,98105,19018,AM2
61,,SING,CC1,HC1,no,N,61,,98105,19018,AM2
62,,SING,CC2,CC3,no,N,62,,98105,19018,AM2
63,,SING,CC2,OC2,no,N,63,,98105,19018,AM2
64,,SING,CC2,HC2,no,N,64,,98105,19018,AM2
65,,SING,CC3,CC4,no,N,65,,98105,19018,AM2
66,,SING,CC3,OC3,no,N,66,,98105,19018,AM2
67,,SING,CC3,HC3,no,N,67,,98105,19018,AM2
68,,SING,CC4,CC5,no,N,68,,98105,19018,AM2
69,,SING,CC4,NC4,no,N,69,,98105,19018,AM2
70,,SING,CC4,HC4,no,N,70,,98105,19018,AM2
71,,SING,CC5,CC6,no,N,71,,98105,19018,AM2
72,,SING,CC5,HC51,no,N,72,,98105,19018,AM2
73,,SING,CC5,HC52,no,N,73,,98105,19018,AM2
74,,SING,CC6,NC6,no,N,74,,98105,19018,AM2
75,,SING,CC6,HC6,no,N,75,,98105,19018,AM2
76,,SING,NC4,HC41,no,N,76,,98105,19018,AM2
77,,SING,NC4,HC42,no,N,77,,98105,19018,AM2
78,,SING,NC6,HC61,no,N,78,,98105,19018,AM2
79,,SING,NC6,HC62,no,N,79,,98105,19018,AM2
80,,SING,OC2,H3,no,N,80,,98105,19018,AM2
81,,SING,OC3,H4,no,N,81,,98105,19018,AM2
1,,DOUB,P,OP1,no,N,1,,98320,19035,LCG
2,,SING,P,O5',no,N,2,,98320,19035,LCG
3,,SING,P,OP2,no,N,3,,98320,19035,LCG
4,,SING,P,OP3,no,N,4,,98320,19035,LCG
5,,SING,O5',C5',no,N,5,,98320,19035,LCG
6,,SING,C5',C4',no,N,6,,98320,19035,LCG
7,,SING,C5',H5',no,N,7,,98320,19035,LCG
8,,SING,C5',H5'',no,N,8,,98320,19035,LCG
9,,SING,C3',C2',no,N,9,,98320,19035,LCG
10,,SING,C3',C4',no,N,10,,98320,19035,LCG
11,,SING,C3',O3',no,N,11,,98320,19035,LCG
12,,SING,C3',H3',no,N,12,,98320,19035,LCG
13,,SING,C6',C4',no,N,13,,98320,19035,LCG
14,,SING,C6',O2',no,N,14,,98320,19035,LCG
15,,SING,C6',H6'1,no,N,15,,98320,19035,LCG
16,,SING,C6',H6'2,no,N,16,,98320,19035,LCG
17,,SING,N9,C8,yes,N,17,,98320,19035,LCG
18,,SING,N9,C4,yes,N,18,,98320,19035,LCG
19,,SING,N9,C1',no,N,19,,98320,19035,LCG
20,,DOUB,C8,N7,yes,N,20,,98320,19035,LCG
21,,SING,C8,H8,no,N,21,,98320,19035,LCG
22,,DOUB,C4,C5,yes,N,22,,98320,19035,LCG
23,,SING,C4,N3,no,N,23,,98320,19035,LCG
24,,SING,N7,C5,yes,N,24,,98320,19035,LCG
25,,SING,C5,C6,no,N,25,,98320,19035,LCG
26,,DOUB,C6,O6,no,N,26,,98320,19035,LCG
27,,SING,C6,N1,no,N,27,,98320,19035,LCG
28,,SING,C2',C1',no,N,28,,98320,19035,LCG
29,,SING,C2',O2',no,N,29,,98320,19035,LCG
30,,SING,C2',H2',no,N,30,,98320,19035,LCG
31,,SING,C4',O4',no,N,31,,98320,19035,LCG
32,,SING,C1',O4',no,N,32,,98320,19035,LCG
33,,SING,C1',H1',no,N,33,,98320,19035,LCG
34,,SING,C2,N1,no,N,34,,98320,19035,LCG
35,,SING,C2,N2,no,N,35,,98320,19035,LCG
36,,DOUB,C2,N3,no,N,36,,98320,19035,LCG
37,,SING,N1,H1,no,N,37,,98320,19035,LCG
38,,SING,OP2,HOP2,no,N,38,,98320,19035,LCG
39,,SING,N2,H21,no,N,39,,98320,19035,LCG
40,,SING,N2,H22,no,N,40,,98320,19035,LCG
41,,SING,O3',HO3',no,N,41,,98320,19035,LCG
42,,SING,OP3,HOP3,no,N,42,,98320,19035,LCG
1,,SING,N,HN1,no,N,1,,98346,19036,NH2
2,,SING,N,HN2,no,N,2,,98346,19036,NH2
1,,DOUB,C,O,no,N,1,,98347,19036,ACE
2,,SING,C,CH3,no,N,2,,98347,19036,ACE
3,,SING,C,H,no,N,3,,98347,19036,ACE
4,,SING,CH3,H1,no,N,4,,98347,19036,ACE
5,,SING,CH3,H2,no,N,5,,98347,19036,ACE
6,,SING,CH3,H3,no,N,6,,98347,19036,ACE
1,,SING,CHA,C1A,yes,N,1,,98386,19038,HEM
2,,DOUB,CHA,C4D,yes,N,2,,98386,19038,HEM
3,,SING,CHA,HHA,no,N,3,,98386,19038,HEM
4,,SING,CHB,C4A,yes,N,4,,98386,19038,HEM
5,,DOUB,CHB,C1B,yes,N,5,,98386,19038,HEM
6,,SING,CHB,HHB,no,N,6,,98386,19038,HEM
7,,SING,CHC,C4B,yes,N,7,,98386,19038,HEM
8,,DOUB,CHC,C1C,yes,N,8,,98386,19038,HEM
9,,SING,CHC,HHC,no,N,9,,98386,19038,HEM
10,,DOUB,CHD,C4C,yes,N,10,,98386,19038,HEM
11,,SING,CHD,C1D,yes,N,11,,98386,19038,HEM
12,,SING,CHD,HHD,no,N,12,,98386,19038,HEM
13,,DOUB,C1A,C2A,yes,N,13,,98386,19038,HEM
14,,SING,C1A,NA,yes,N,14,,98386,19038,HEM
15,,SING,C2A,C3A,yes,N,15,,98386,19038,HEM
16,,SING,C2A,CAA,no,N,16,,98386,19038,HEM
17,,DOUB,C3A,C4A,yes,N,17,,98386,19038,HEM
18,,SING,C3A,CMA,no,N,18,,98386,19038,HEM
19,,SING,C4A,NA,yes,N,19,,98386,19038,HEM
20,,SING,CMA,HMA,no,N,20,,98386,19038,HEM
21,,SING,CMA,HMAA,no,N,21,,98386,19038,HEM
22,,SING,CMA,HMAB,no,N,22,,98386,19038,HEM
23,,SING,CAA,CBA,no,N,23,,98386,19038,HEM
24,,SING,CAA,HAA,no,N,24,,98386,19038,HEM
25,,SING,CAA,HAAA,no,N,25,,98386,19038,HEM
26,,SING,CBA,CGA,no,N,26,,98386,19038,HEM
27,,SING,CBA,HBA,no,N,27,,98386,19038,HEM
28,,SING,CBA,HBAA,no,N,28,,98386,19038,HEM
29,,DOUB,CGA,O1A,no,N,29,,98386,19038,HEM
30,,SING,CGA,O2A,no,N,30,,98386,19038,HEM
31,,SING,C1B,C2B,no,N,31,,98386,19038,HEM
32,,SING,C1B,NB,yes,N,32,,98386,19038,HEM
33,,DOUB,C2B,C3B,yes,N,33,,98386,19038,HEM
34,,SING,C2B,CMB,yes,N,34,,98386,19038,HEM
35,,SING,C3B,C4B,no,N,35,,98386,19038,HEM
36,,SING,C3B,CAB,yes,N,36,,98386,19038,HEM
37,,DOUB,C4B,NB,no,N,37,,98386,19038,HEM
38,,SING,CMB,HMB,yes,N,38,,98386,19038,HEM
39,,SING,CMB,HMBA,no,N,39,,98386,19038,HEM
40,,SING,CMB,HMBB,no,N,40,,98386,19038,HEM
41,,DOUB,CAB,CBB,no,N,41,,98386,19038,HEM
42,,SING,CAB,HAB,no,N,42,,98386,19038,HEM
43,,SING,CBB,HBB,no,N,43,,98386,19038,HEM
44,,SING,CBB,HBBA,no,N,44,,98386,19038,HEM
45,,SING,C1C,C2C,no,N,45,,98386,19038,HEM
46,,SING,C1C,NC,yes,N,46,,98386,19038,HEM
47,,DOUB,C2C,C3C,yes,N,47,,98386,19038,HEM
48,,SING,C2C,CMC,yes,N,48,,98386,19038,HEM
49,,SING,C3C,C4C,no,N,49,,98386,19038,HEM
50,,SING,C3C,CAC,yes,N,50,,98386,19038,HEM
51,,SING,C4C,NC,no,N,51,,98386,19038,HEM
52,,SING,CMC,HMC,yes,N,52,,98386,19038,HEM
53,,SING,CMC,HMCA,no,N,53,,98386,19038,HEM
54,,SING,CMC,HMCB,no,N,54,,98386,19038,HEM
55,,DOUB,CAC,CBC,no,N,55,,98386,19038,HEM
56,,SING,CAC,HAC,no,N,56,,98386,19038,HEM
57,,SING,CBC,HBC,no,N,57,,98386,19038,HEM
58,,SING,CBC,HBCA,no,N,58,,98386,19038,HEM
59,,SING,C1D,C2D,no,N,59,,98386,19038,HEM
60,,DOUB,C1D,ND,yes,N,60,,98386,19038,HEM
61,,DOUB,C2D,C3D,yes,N,61,,98386,19038,HEM
62,,SING,C2D,CMD,yes,N,62,,98386,19038,HEM
63,,SING,C3D,C4D,no,N,63,,98386,19038,HEM
64,,SING,C3D,CAD,yes,N,64,,98386,19038,HEM
65,,SING,C4D,ND,no,N,65,,98386,19038,HEM
66,,SING,CMD,HMD,yes,N,66,,98386,19038,HEM
67,,SING,CMD,HMDA,no,N,67,,98386,19038,HEM
68,,SING,CMD,HMDB,no,N,68,,98386,19038,HEM
69,,SING,CAD,CBD,no,N,69,,98386,19038,HEM
70,,SING,CAD,HAD,no,N,70,,98386,19038,HEM
71,,SING,CAD,HADA,no,N,71,,98386,19038,HEM
72,,SING,CBD,CGD,no,N,72,,98386,19038,HEM
73,,SING,CBD,HBD,no,N,73,,98386,19038,HEM
74,,SING,CBD,HBDA,no,N,74,,98386,19038,HEM
75,,DOUB,CGD,O1D,no,N,75,,98386,19038,HEM
76,,SING,CGD,O2D,no,N,76,,98386,19038,HEM
77,,SING,O2A,H2A,no,N,77,,98386,19038,HEM
78,,SING,O2D,H2D,no,N,78,,98386,19038,HEM
79,,SING,FE,NA,no,N,79,,98386,19038,HEM
80,,SING,FE,NB,no,N,80,,98386,19038,HEM
81,,SING,FE,NC,no,N,81,,98386,19038,HEM
82,,SING,FE,ND,no,N,82,,98386,19038,HEM
1,,SING,C1,C2,no,N,1,,98387,19038,CAM
2,,SING,C1,C6,no,N,2,,98387,19038,CAM
3,,SING,C1,C7,no,N,3,,98387,19038,CAM
4,,SING,C1,C10,no,N,4,,98387,19038,CAM
5,,DOUB,C2,O,no,N,5,,98387,19038,CAM
6,,SING,C2,C3,no,N,6,,98387,19038,CAM
7,,SING,C3,C4,no,N,7,,98387,19038,CAM
8,,SING,C3,H31,no,N,8,,98387,19038,CAM
9,,SING,C3,H32,no,N,9,,98387,19038,CAM
10,,SING,C4,C5,no,N,10,,98387,19038,CAM
11,,SING,C4,C7,no,N,11,,98387,19038,CAM
12,,SING,C4,H4,no,N,12,,98387,19038,CAM
13,,SING,C5,C6,no,N,13,,98387,19038,CAM
14,,SING,C5,H51,no,N,14,,98387,19038,CAM
15,,SING,C5,H52,no,N,15,,98387,19038,CAM
16,,SING,C6,H61,no,N,16,,98387,19038,CAM
17,,SING,C6,H62,no,N,17,,98387,19038,CAM
18,,SING,C7,C8,no,N,18,,98387,19038,CAM
19,,SING,C7,C9,no,N,19,,98387,19038,CAM
20,,SING,C8,H81,no,N,20,,98387,19038,CAM
21,,SING,C8,H82,no,N,21,,98387,19038,CAM
22,,SING,C8,H83,no,N,22,,98387,19038,CAM
23,,SING,C9,H91,no,N,23,,98387,19038,CAM
24,,SING,C9,H92,no,N,24,,98387,19038,CAM
25,,SING,C9,H93,no,N,25,,98387,19038,CAM
26,,SING,C10,H101,no,N,26,,98387,19038,CAM
27,,SING,C10,H102,no,N,27,,98387,19038,CAM
28,,SING,C10,H103,no,N,28,,98387,19038,CAM
1,,SING,FE1,S1,no,N,1,,98388,19038,FES
2,,SING,FE1,S2,no,N,2,,98388,19038,FES
3,,SING,FE2,S1,no,N,3,,98388,19038,FES
4,,SING,FE2,S2,no,N,4,,98388,19038,FES
1,,DOUB,PG,O1G,no,N,1,,98441,19040,GTP
2,,SING,PG,O2G,no,N,2,,98441,19040,GTP
3,,SING,PG,O3G,no,N,3,,98441,19040,GTP
4,,SING,PG,O3B,no,N,4,,98441,19040,GTP
5,,SING,O2G,HOG2,no,N,5,,98441,19040,GTP
6,,SING,O3G,HOG3,no,N,6,,98441,19040,GTP
7,,SING,O3B,PB,no,N,7,,98441,19040,GTP
8,,DOUB,PB,O1B,no,N,8,,98441,19040,GTP
9,,SING,PB,O2B,no,N,9,,98441,19040,GTP
10,,SING,PB,O3A,no,N,10,,98441,19040,GTP
11,,SING,O2B,HOB2,no,N,11,,98441,19040,GTP
12,,SING,O3A,PA,no,N,12,,98441,19040,GTP
13,,DOUB,PA,O1A,no,N,13,,98441,19040,GTP
14,,SING,PA,O2A,no,N,14,,98441,19040,GTP
15,,SING,PA,O5',no,N,15,,98441,19040,GTP
16,,SING,O2A,HOA2,no,N,16,,98441,19040,GTP
17,,SING,O5',C5',no,N,17,,98441,19040,GTP
18,,SING,C5',C4',no,N,18,,98441,19040,GTP
19,,SING,C5',H5',no,N,19,,98441,19040,GTP
20,,SING,C5',H5'',no,N,20,,98441,19040,GTP
21,,SING,C4',O4',no,N,21,,98441,19040,GTP
22,,SING,C4',C3',no,N,22,,98441,19040,GTP
23,,SING,C4',H4',no,N,23,,98441,19040,GTP
24,,SING,O4',C1',no,N,24,,98441,19040,GTP
25,,SING,C3',O3',no,N,25,,98441,19040,GTP
26,,SING,C3',C2',no,N,26,,98441,19040,GTP
27,,SING,C3',H3',no,N,27,,98441,19040,GTP
28,,SING,O3',HO3',no,N,28,,98441,19040,GTP
29,,SING,C2',O2',no,N,29,,98441,19040,GTP
30,,SING,C2',C1',no,N,30,,98441,19040,GTP
31,,SING,C2',H2',no,N,31,,98441,19040,GTP
32,,SING,O2',HO2',no,N,32,,98441,19040,GTP
33,,SING,C1',N9,no,N,33,,98441,19040,GTP
34,,SING,C1',H1',no,N,34,,98441,19040,GTP
35,,SING,N9,C8,yes,N,35,,98441,19040,GTP
36,,SING,N9,C4,yes,N,36,,98441,19040,GTP
37,,DOUB,C8,N7,yes,N,37,,98441,19040,GTP
38,,SING,C8,H8,no,N,38,,98441,19040,GTP
39,,SING,N7,C5,yes,N,39,,98441,19040,GTP
40,,SING,C5,C6,no,N,40,,98441,19040,GTP
41,,DOUB,C5,C4,yes,N,41,,98441,19040,GTP
42,,DOUB,C6,O6,no,N,42,,98441,19040,GTP
43,,SING,C6,N1,no,N,43,,98441,19040,GTP
44,,SING,N1,C2,no,N,44,,98441,19040,GTP
45,,SING,N1,HN1,no,N,45,,98441,19040,GTP
46,,SING,C2,N2,no,N,46,,98441,19040,GTP
47,,DOUB,C2,N3,no,N,47,,98441,19040,GTP
48,,SING,N2,HN21,no,N,48,,98441,19040,GTP
49,,SING,N2,HN22,no,N,49,,98441,19040,GTP
50,,SING,N3,C4,no,N,50,,98441,19040,GTP
1,,SING,C,CA,no,N,1,,98540,19045,MK8
2,,SING,C,O2,no,N,2,,98540,19045,MK8
3,,SING,N,HN,no,N,3,,98540,19045,MK8
4,,SING,N,HNA,no,N,4,,98540,19045,MK8
5,,DOUB,O,C,no,N,5,,98540,19045,MK8
6,,SING,CA,N,no,N,6,,98540,19045,MK8
7,,SING,CA,CB,no,N,7,,98540,19045,MK8
8,,SING,CB,HB,no,N,8,,98540,19045,MK8
9,,SING,CB,HBA,no,N,9,,98540,19045,MK8
10,,SING,CD,CG,no,N,10,,98540,19045,MK8
11,,SING,CD,HD,no,N,11,,98540,19045,MK8
12,,SING,CD,HDA,no,N,12,,98540,19045,MK8
13,,SING,CE,CD,no,N,13,,98540,19045,MK8
14,,SING,CE,HE,no,N,14,,98540,19045,MK8
15,,SING,CE,HEA,no,N,15,,98540,19045,MK8
16,,SING,CE,HEB,no,N,16,,98540,19045,MK8
17,,SING,CG,CB,no,N,17,,98540,19045,MK8
18,,SING,CG,HG,no,N,18,,98540,19045,MK8
19,,SING,CG,HGA,no,N,19,,98540,19045,MK8
20,,SING,CB1,CA,no,N,20,,98540,19045,MK8
21,,SING,CB1,HB1,no,N,21,,98540,19045,MK8
22,,SING,CB1,HB1A,no,N,22,,98540,19045,MK8
23,,SING,CB1,HB1B,no,N,23,,98540,19045,MK8
24,,SING,O2,H15,no,N,24,,98540,19045,MK8
1,,SING,N,CA,no,N,1,,98541,19045,NLE
2,,SING,N,H,no,N,2,,98541,19045,NLE
3,,SING,N,HN2,no,N,3,,98541,19045,NLE
4,,SING,CA,C,no,N,4,,98541,19045,NLE
5,,SING,CA,CB,no,N,5,,98541,19045,NLE
6,,SING,CA,HA,no,N,6,,98541,19045,NLE
7,,DOUB,C,O,no,N,7,,98541,19045,NLE
8,,SING,C,OXT,no,N,8,,98541,19045,NLE
9,,SING,OXT,HXT,no,N,9,,98541,19045,NLE
10,,SING,CB,CG,no,N,10,,98541,19045,NLE
11,,SING,CB,HB2,no,N,11,,98541,19045,NLE
12,,SING,CB,HB3,no,N,12,,98541,19045,NLE
13,,SING,CG,CD,no,N,13,,98541,19045,NLE
14,,SING,CG,HG2,no,N,14,,98541,19045,NLE
15,,SING,CG,HG3,no,N,15,,98541,19045,NLE
16,,SING,CD,CE,no,N,16,,98541,19045,NLE
17,,SING,CD,HD2,no,N,17,,98541,19045,NLE
18,,SING,CD,HD3,no,N,18,,98541,19045,NLE
19,,SING,CE,HE1,no,N,19,,98541,19045,NLE
20,,SING,CE,HE2,no,N,20,,98541,19045,NLE
21,,SING,CE,HE3,no,N,21,,98541,19045,NLE
1,,SING,N,HN1,no,N,1,,98542,19045,NH2
2,,SING,N,HN2,no,N,2,,98542,19045,NH2
1,,DOUB,C7,N1,yes,N,1,,98614,19048,RTM
2,,SING,N1,C6,yes,N,2,,98614,19048,RTM
3,,SING,C12,N3,no,N,3,,98614,19048,RTM
4,,SING,C14,N3,no,N,4,,98614,19048,RTM
5,,SING,N3,C13,no,N,5,,98614,19048,RTM
6,,SING,C5,C4,yes,N,6,,98614,19048,RTM
7,,DOUB,C4,C1,yes,N,7,,98614,19048,RTM
8,,SING,C4,H4,no,N,8,,98614,19048,RTM
9,,DOUB,C6,C5,yes,N,9,,98614,19048,RTM
10,,SING,C9,C5,yes,N,10,,98614,19048,RTM
11,,SING,C6,C3,yes,N,11,,98614,19048,RTM
12,,SING,N2,C7,no,N,12,,98614,19048,RTM
13,,SING,C7,C8,yes,N,13,,98614,19048,RTM
14,,SING,C10,C8,no,N,14,,98614,19048,RTM
15,,DOUB,C8,C9,yes,N,15,,98614,19048,RTM
16,,SING,C11,C10,no,N,16,,98614,19048,RTM
17,,SING,C10,H10,no,N,17,,98614,19048,RTM
18,,SING,C10,H10A,no,N,18,,98614,19048,RTM
19,,SING,C13,H13,no,N,19,,98614,19048,RTM
20,,SING,C13,H13A,no,N,20,,98614,19048,RTM
21,,SING,C13,H13B,no,N,21,,98614,19048,RTM
22,,SING,C14,C15,no,N,22,,98614,19048,RTM
23,,SING,C16,C15,no,N,23,,98614,19048,RTM
24,,SING,C15,H15,no,N,24,,98614,19048,RTM
25,,SING,C15,H15A,no,N,25,,98614,19048,RTM
26,,SING,C18,C17,no,N,26,,98614,19048,RTM
27,,SING,C17,C16,no,N,27,,98614,19048,RTM
28,,SING,C17,H17,no,N,28,,98614,19048,RTM
29,,SING,C17,H17A,no,N,29,,98614,19048,RTM
30,,SING,C16,H16,no,N,30,,98614,19048,RTM
31,,SING,C16,H16A,no,N,31,,98614,19048,RTM
32,,SING,C18,C19,no,N,32,,98614,19048,RTM
33,,SING,C18,H18,no,N,33,,98614,19048,RTM
34,,SING,C18,H18A,no,N,34,,98614,19048,RTM
35,,SING,C19,C14,no,N,35,,98614,19048,RTM
36,,SING,C19,H19,no,N,36,,98614,19048,RTM
37,,SING,C19,H19A,no,N,37,,98614,19048,RTM
38,,SING,C14,H14,no,N,38,,98614,19048,RTM
39,,DOUB,O1,C12,no,N,39,,98614,19048,RTM
40,,SING,C12,C11,no,N,40,,98614,19048,RTM
41,,SING,C11,H11,no,N,41,,98614,19048,RTM
42,,SING,C11,H11A,no,N,42,,98614,19048,RTM
43,,SING,C9,H9,no,N,43,,98614,19048,RTM
44,,SING,C2,C1,yes,N,44,,98614,19048,RTM
45,,SING,C1,H1,no,N,45,,98614,19048,RTM
46,,DOUB,C3,C2,yes,N,46,,98614,19048,RTM
47,,SING,C2,H2,no,N,47,,98614,19048,RTM
48,,SING,C3,H3,no,N,48,,98614,19048,RTM
49,,SING,N2,HN2,no,N,49,,98614,19048,RTM
50,,SING,N2,HN2A,no,N,50,,98614,19048,RTM
1,,SING,CG1,CB1,no,N,1,,99018,19069,CRO
2,,SING,OG1,CB1,no,N,2,,99018,19069,CRO
3,,SING,CB1,CA1,no,N,3,,99018,19069,CRO
4,,SING,N1,CA1,no,N,4,,99018,19069,CRO
5,,SING,OH,CZ,no,N,5,,99018,19069,CRO
6,,DOUB,CE1,CZ,yes,N,6,,99018,19069,CRO
7,,SING,CE1,CD1,yes,N,7,,99018,19069,CRO
8,,SING,CA1,C1,no,N,8,,99018,19069,CRO
9,,SING,CZ,CE2,yes,N,9,,99018,19069,CRO
10,,DOUB,CD1,CG2,yes,N,10,,99018,19069,CRO
11,,DOUB,N2,C1,no,N,11,,99018,19069,CRO
12,,SING,N2,CA2,no,N,12,,99018,19069,CRO
13,,SING,C1,N3,no,N,13,,99018,19069,CRO
14,,DOUB,CE2,CD2,yes,N,14,,99018,19069,CRO
15,,SING,CG2,CD2,yes,N,15,,99018,19069,CRO
16,,SING,CG2,CB2,no,N,16,,99018,19069,CRO
17,,SING,N3,CA3,no,N,17,,99018,19069,CRO
18,,SING,N3,C2,no,N,18,,99018,19069,CRO
19,,DOUB,CA2,CB2,no,N,19,,99018,19069,CRO
20,,SING,CA2,C2,no,Z,20,,99018,19069,CRO
21,,SING,CA3,C3,no,N,21,,99018,19069,CRO
22,,SING,OXT,C3,no,N,22,,99018,19069,CRO
23,,DOUB,C3,O3,no,N,23,,99018,19069,CRO
24,,DOUB,C2,O2,no,N,24,,99018,19069,CRO
25,,SING,N1,HN11,no,N,25,,99018,19069,CRO
26,,SING,N1,H2,no,N,26,,99018,19069,CRO
27,,SING,CA1,HA1,no,N,27,,99018,19069,CRO
28,,SING,CB1,HB1,no,N,28,,99018,19069,CRO
29,,SING,CG1,HG11,no,N,29,,99018,19069,CRO
30,,SING,CG1,HG12,no,N,30,,99018,19069,CRO
31,,SING,CG1,HG13,no,N,31,,99018,19069,CRO
32,,SING,OG1,HOG1,no,N,32,,99018,19069,CRO
33,,SING,CA3,HA31,no,N,33,,99018,19069,CRO
34,,SING,CA3,HA32,no,N,34,,99018,19069,CRO
35,,SING,OXT,HXT,no,N,35,,99018,19069,CRO
36,,SING,CB2,HB2,no,N,36,,99018,19069,CRO
37,,SING,CD1,HD1,no,N,37,,99018,19069,CRO
38,,SING,CD2,HD2,no,N,38,,99018,19069,CRO
39,,SING,CE1,HE1,no,N,39,,99018,19069,CRO
40,,SING,CE2,HE2,no,N,40,,99018,19069,CRO
41,,SING,OH,HOH,no,N,41,,99018,19069,CRO
1,,SING,N,CA,no,N,1,,99038,19070,AIB
2,,SING,N,H,no,N,2,,99038,19070,AIB
3,,SING,N,H2,no,N,3,,99038,19070,AIB
4,,SING,CA,C,no,N,4,,99038,19070,AIB
5,,SING,CA,CB1,no,N,5,,99038,19070,AIB
6,,SING,CA,CB2,no,N,6,,99038,19070,AIB
7,,DOUB,C,O,no,N,7,,99038,19070,AIB
8,,SING,C,OXT,no,N,8,,99038,19070,AIB
9,,SING,OXT,HO2,no,N,9,,99038,19070,AIB
10,,SING,CB1,HB11,no,N,10,,99038,19070,AIB
11,,SING,CB1,HB12,no,N,11,,99038,19070,AIB
12,,SING,CB1,HB13,no,N,12,,99038,19070,AIB
13,,SING,CB2,HB21,no,N,13,,99038,19070,AIB
14,,SING,CB2,HB22,no,N,14,,99038,19070,AIB
15,,SING,CB2,HB23,no,N,15,,99038,19070,AIB
1,,SING,N,CA,no,N,1,,99039,19070,GGL
2,,SING,N,H,no,N,2,,99039,19070,GGL
3,,SING,N,H2,no,N,3,,99039,19070,GGL
4,,SING,CA,C,no,N,4,,99039,19070,GGL
5,,SING,CA,CB,no,N,5,,99039,19070,GGL
6,,SING,CA,HA,no,N,6,,99039,19070,GGL
7,,DOUB,C,O,no,N,7,,99039,19070,GGL
8,,SING,C,OXT,no,N,8,,99039,19070,GGL
9,,SING,CB,CG,no,N,9,,99039,19070,GGL
10,,SING,CB,HB2,no,N,10,,99039,19070,GGL
11,,SING,CB,HB3,no,N,11,,99039,19070,GGL
12,,SING,CG,CD,no,N,12,,99039,19070,GGL
13,,SING,CG,HG2,no,N,13,,99039,19070,GGL
14,,SING,CG,HG3,no,N,14,,99039,19070,GGL
15,,DOUB,CD,OE1,no,N,15,,99039,19070,GGL
16,,SING,CD,OE2,no,N,16,,99039,19070,GGL
17,,SING,OE2,HE2,no,N,17,,99039,19070,GGL
18,,SING,OXT,HXT,no,N,18,,99039,19070,GGL
1,,SING,C1,O1,no,N,1,,99040,19070,PLM
2,,DOUB,C1,O2,no,N,2,,99040,19070,PLM
3,,SING,C1,C2,no,N,3,,99040,19070,PLM
4,,SING,O1,H,no,N,4,,99040,19070,PLM
5,,SING,C2,C3,no,N,5,,99040,19070,PLM
6,,SING,C2,H21,no,N,6,,99040,19070,PLM
7,,SING,C2,H22,no,N,7,,99040,19070,PLM
8,,SING,C3,C4,no,N,8,,99040,19070,PLM
9,,SING,C3,H31,no,N,9,,99040,19070,PLM
10,,SING,C3,H32,no,N,10,,99040,19070,PLM
11,,SING,C4,C5,no,N,11,,99040,19070,PLM
12,,SING,C4,H41,no,N,12,,99040,19070,PLM
13,,SING,C4,H42,no,N,13,,99040,19070,PLM
14,,SING,C5,C6,no,N,14,,99040,19070,PLM
15,,SING,C5,H51,no,N,15,,99040,19070,PLM
16,,SING,C5,H52,no,N,16,,99040,19070,PLM
17,,SING,C6,C7,no,N,17,,99040,19070,PLM
18,,SING,C6,H61,no,N,18,,99040,19070,PLM
19,,SING,C6,H62,no,N,19,,99040,19070,PLM
20,,SING,C7,C8,no,N,20,,99040,19070,PLM
21,,SING,C7,H71,no,N,21,,99040,19070,PLM
22,,SING,C7,H72,no,N,22,,99040,19070,PLM
23,,SING,C8,C9,no,N,23,,99040,19070,PLM
24,,SING,C8,H81,no,N,24,,99040,19070,PLM
25,,SING,C8,H82,no,N,25,,99040,19070,PLM
26,,SING,C9,CA,no,N,26,,99040,19070,PLM
27,,SING,C9,H91,no,N,27,,99040,19070,PLM
28,,SING,C9,H92,no,N,28,,99040,19070,PLM
29,,SING,CA,CB,no,N,29,,99040,19070,PLM
30,,SING,CA,HA1,no,N,30,,99040,19070,PLM
31,,SING,CA,HA2,no,N,31,,99040,19070,PLM
32,,SING,CB,CC,no,N,32,,99040,19070,PLM
33,,SING,CB,HB1,no,N,33,,99040,19070,PLM
34,,SING,CB,HB2,no,N,34,,99040,19070,PLM
35,,SING,CC,CD,no,N,35,,99040,19070,PLM
36,,SING,CC,HC1,no,N,36,,99040,19070,PLM
37,,SING,CC,HC2,no,N,37,,99040,19070,PLM
38,,SING,CD,CE,no,N,38,,99040,19070,PLM
39,,SING,CD,HD1,no,N,39,,99040,19070,PLM
40,,SING,CD,HD2,no,N,40,,99040,19070,PLM
41,,SING,CE,CF,no,N,41,,99040,19070,PLM
42,,SING,CE,HE1,no,N,42,,99040,19070,PLM
43,,SING,CE,HE2,no,N,43,,99040,19070,PLM
44,,SING,CF,CG,no,N,44,,99040,19070,PLM
45,,SING,CF,HF1,no,N,45,,99040,19070,PLM
46,,SING,CF,HF2,no,N,46,,99040,19070,PLM
47,,SING,CG,HG1,no,N,47,,99040,19070,PLM
48,,SING,CG,HG2,no,N,48,,99040,19070,PLM
49,,SING,CG,HG3,no,N,49,,99040,19070,PLM
1,,SING,N,HN1,no,N,1,,99041,19070,NH2
2,,SING,N,HN2,no,N,2,,99041,19070,NH2
1,,SING,N,CA,no,N,1,,99059,19071,AIB
2,,SING,N,H,no,N,2,,99059,19071,AIB
3,,SING,N,H2,no,N,3,,99059,19071,AIB
4,,SING,CA,C,no,N,4,,99059,19071,AIB
5,,SING,CA,CB1,no,N,5,,99059,19071,AIB
6,,SING,CA,CB2,no,N,6,,99059,19071,AIB
7,,DOUB,C,O,no,N,7,,99059,19071,AIB
8,,SING,C,OXT,no,N,8,,99059,19071,AIB
9,,SING,OXT,HO2,no,N,9,,99059,19071,AIB
10,,SING,CB1,HB11,no,N,10,,99059,19071,AIB
11,,SING,CB1,HB12,no,N,11,,99059,19071,AIB
12,,SING,CB1,HB13,no,N,12,,99059,19071,AIB
13,,SING,CB2,HB21,no,N,13,,99059,19071,AIB
14,,SING,CB2,HB22,no,N,14,,99059,19071,AIB
15,,SING,CB2,HB23,no,N,15,,99059,19071,AIB
1,,SING,N,CA,no,N,1,,99060,19071,GGL
2,,SING,N,H,no,N,2,,99060,19071,GGL
3,,SING,N,H2,no,N,3,,99060,19071,GGL
4,,SING,CA,C,no,N,4,,99060,19071,GGL
5,,SING,CA,CB,no,N,5,,99060,19071,GGL
6,,SING,CA,HA,no,N,6,,99060,19071,GGL
7,,DOUB,C,O,no,N,7,,99060,19071,GGL
8,,SING,C,OXT,no,N,8,,99060,19071,GGL
9,,SING,CB,CG,no,N,9,,99060,19071,GGL
10,,SING,CB,HB2,no,N,10,,99060,19071,GGL
11,,SING,CB,HB3,no,N,11,,99060,19071,GGL
12,,SING,CG,CD,no,N,12,,99060,19071,GGL
13,,SING,CG,HG2,no,N,13,,99060,19071,GGL
14,,SING,CG,HG3,no,N,14,,99060,19071,GGL
15,,DOUB,CD,OE1,no,N,15,,99060,19071,GGL
16,,SING,CD,OE2,no,N,16,,99060,19071,GGL
17,,SING,OE2,HE2,no,N,17,,99060,19071,GGL
18,,SING,OXT,HXT,no,N,18,,99060,19071,GGL
1,,SING,C1,O1,no,N,1,,99061,19071,PLM
2,,DOUB,C1,O2,no,N,2,,99061,19071,PLM
3,,SING,C1,C2,no,N,3,,99061,19071,PLM
4,,SING,O1,H,no,N,4,,99061,19071,PLM
5,,SING,C2,C3,no,N,5,,99061,19071,PLM
6,,SING,C2,H21,no,N,6,,99061,19071,PLM
7,,SING,C2,H22,no,N,7,,99061,19071,PLM
8,,SING,C3,C4,no,N,8,,99061,19071,PLM
9,,SING,C3,H31,no,N,9,,99061,19071,PLM
10,,SING,C3,H32,no,N,10,,99061,19071,PLM
11,,SING,C4,C5,no,N,11,,99061,19071,PLM
12,,SING,C4,H41,no,N,12,,99061,19071,PLM
13,,SING,C4,H42,no,N,13,,99061,19071,PLM
14,,SING,C5,C6,no,N,14,,99061,19071,PLM
15,,SING,C5,H51,no,N,15,,99061,19071,PLM
16,,SING,C5,H52,no,N,16,,99061,19071,PLM
17,,SING,C6,C7,no,N,17,,99061,19071,PLM
18,,SING,C6,H61,no,N,18,,99061,19071,PLM
19,,SING,C6,H62,no,N,19,,99061,19071,PLM
20,,SING,C7,C8,no,N,20,,99061,19071,PLM
21,,SING,C7,H71,no,N,21,,99061,19071,PLM
22,,SING,C7,H72,no,N,22,,99061,19071,PLM
23,,SING,C8,C9,no,N,23,,99061,19071,PLM
24,,SING,C8,H81,no,N,24,,99061,19071,PLM
25,,SING,C8,H82,no,N,25,,99061,19071,PLM
26,,SING,C9,CA,no,N,26,,99061,19071,PLM
27,,SING,C9,H91,no,N,27,,99061,19071,PLM
28,,SING,C9,H92,no,N,28,,99061,19071,PLM
29,,SING,CA,CB,no,N,29,,99061,19071,PLM
30,,SING,CA,HA1,no,N,30,,99061,19071,PLM
31,,SING,CA,HA2,no,N,31,,99061,19071,PLM
32,,SING,CB,CC,no,N,32,,99061,19071,PLM
33,,SING,CB,HB1,no,N,33,,99061,19071,PLM
34,,SING,CB,HB2,no,N,34,,99061,19071,PLM
35,,SING,CC,CD,no,N,35,,99061,19071,PLM
36,,SING,CC,HC1,no,N,36,,99061,19071,PLM
37,,SING,CC,HC2,no,N,37,,99061,19071,PLM
38,,SING,CD,CE,no,N,38,,99061,19071,PLM
39,,SING,CD,HD1,no,N,39,,99061,19071,PLM
40,,SING,CD,HD2,no,N,40,,99061,19071,PLM
41,,SING,CE,CF,no,N,41,,99061,19071,PLM
42,,SING,CE,HE1,no,N,42,,99061,19071,PLM
43,,SING,CE,HE2,no,N,43,,99061,19071,PLM
44,,SING,CF,CG,no,N,44,,99061,19071,PLM
45,,SING,CF,HF1,no,N,45,,99061,19071,PLM
46,,SING,CF,HF2,no,N,46,,99061,19071,PLM
47,,SING,CG,HG1,no,N,47,,99061,19071,PLM
48,,SING,CG,HG2,no,N,48,,99061,19071,PLM
49,,SING,CG,HG3,no,N,49,,99061,19071,PLM
1,,SING,N,HN1,no,N,1,,99062,19071,NH2
2,,SING,N,HN2,no,N,2,,99062,19071,NH2
1,,SING,CHA,C1A,yes,N,1,,99113,19075,PP9
2,,DOUB,CHA,C4D,yes,Z,2,,99113,19075,PP9
3,,SING,CHA,HHA,no,N,3,,99113,19075,PP9
4,,SING,CHB,C4A,yes,N,4,,99113,19075,PP9
5,,DOUB,CHB,C1B,yes,Z,5,,99113,19075,PP9
6,,SING,CHB,HHB,no,N,6,,99113,19075,PP9
7,,SING,CHC,C4B,yes,N,7,,99113,19075,PP9
8,,DOUB,CHC,C1C,yes,Z,8,,99113,19075,PP9
9,,SING,CHC,HHC,no,N,9,,99113,19075,PP9
10,,DOUB,CHD,C4C,yes,Z,10,,99113,19075,PP9
11,,SING,CHD,C1D,yes,N,11,,99113,19075,PP9
12,,SING,CHD,HHD,no,N,12,,99113,19075,PP9
13,,SING,NA,C1A,yes,N,13,,99113,19075,PP9
14,,SING,NA,C4A,yes,N,14,,99113,19075,PP9
15,,SING,NA,HNA,no,N,15,,99113,19075,PP9
16,,DOUB,C1A,C2A,yes,N,16,,99113,19075,PP9
17,,SING,C2A,C3A,yes,N,17,,99113,19075,PP9
18,,SING,C2A,CAA,no,N,18,,99113,19075,PP9
19,,DOUB,C3A,C4A,yes,N,19,,99113,19075,PP9
20,,SING,C3A,CMA,no,N,20,,99113,19075,PP9
21,,SING,CMA,HMA1,no,N,21,,99113,19075,PP9
22,,SING,CMA,HMA2,no,N,22,,99113,19075,PP9
23,,SING,CMA,HMA3,no,N,23,,99113,19075,PP9
24,,SING,CAA,CBA,no,N,24,,99113,19075,PP9
25,,SING,CAA,HAA1,no,N,25,,99113,19075,PP9
26,,SING,CAA,HAA2,no,N,26,,99113,19075,PP9
27,,SING,CBA,CGA,no,N,27,,99113,19075,PP9
28,,SING,CBA,HBA1,no,N,28,,99113,19075,PP9
29,,SING,CBA,HBA2,no,N,29,,99113,19075,PP9
30,,DOUB,CGA,O1A,no,N,30,,99113,19075,PP9
31,,SING,CGA,O2A,no,N,31,,99113,19075,PP9
32,,SING,O2A,H2A,no,N,32,,99113,19075,PP9
33,,SING,NB,C1B,yes,N,33,,99113,19075,PP9
34,,DOUB,NB,C4B,yes,N,34,,99113,19075,PP9
35,,SING,C1B,C2B,no,N,35,,99113,19075,PP9
36,,DOUB,C2B,C3B,no,N,36,,99113,19075,PP9
37,,SING,C2B,CMB,no,N,37,,99113,19075,PP9
38,,SING,C3B,C4B,no,N,38,,99113,19075,PP9
39,,SING,C3B,CAB,no,N,39,,99113,19075,PP9
40,,SING,CMB,HMB1,no,N,40,,99113,19075,PP9
41,,SING,CMB,HMB2,no,N,41,,99113,19075,PP9
42,,SING,CMB,HMB3,no,N,42,,99113,19075,PP9
43,,DOUB,CAB,CBB,no,N,43,,99113,19075,PP9
44,,SING,CAB,HAB,no,N,44,,99113,19075,PP9
45,,SING,CBB,HBB1,no,N,45,,99113,19075,PP9
46,,SING,CBB,HBB2,no,N,46,,99113,19075,PP9
47,,SING,NC,C1C,yes,N,47,,99113,19075,PP9
48,,SING,NC,C4C,yes,N,48,,99113,19075,PP9
49,,SING,NC,HNC,no,N,49,,99113,19075,PP9
50,,SING,C1C,C2C,yes,N,50,,99113,19075,PP9
51,,DOUB,C2C,C3C,yes,N,51,,99113,19075,PP9
52,,SING,C2C,CMC,no,N,52,,99113,19075,PP9
53,,SING,C3C,C4C,yes,N,53,,99113,19075,PP9
54,,SING,C3C,CAC,no,N,54,,99113,19075,PP9
55,,SING,CMC,HMC1,no,N,55,,99113,19075,PP9
56,,SING,CMC,HMC2,no,N,56,,99113,19075,PP9
57,,SING,CMC,HMC3,no,N,57,,99113,19075,PP9
58,,DOUB,CAC,CBC,no,N,58,,99113,19075,PP9
59,,SING,CAC,HAC,no,N,59,,99113,19075,PP9
60,,SING,CBC,HBC1,no,N,60,,99113,19075,PP9
61,,SING,CBC,HBC2,no,N,61,,99113,19075,PP9
62,,DOUB,ND,C1D,yes,N,62,,99113,19075,PP9
63,,SING,ND,C4D,yes,N,63,,99113,19075,PP9
64,,SING,C1D,C2D,no,N,64,,99113,19075,PP9
65,,DOUB,C2D,C3D,no,N,65,,99113,19075,PP9
66,,SING,C2D,CMD,no,N,66,,99113,19075,PP9
67,,SING,C3D,C4D,no,N,67,,99113,19075,PP9
68,,SING,C3D,CAD,no,N,68,,99113,19075,PP9
69,,SING,CMD,HMD1,no,N,69,,99113,19075,PP9
70,,SING,CMD,HMD2,no,N,70,,99113,19075,PP9
71,,SING,CMD,HMD3,no,N,71,,99113,19075,PP9
72,,SING,CAD,CBD,no,N,72,,99113,19075,PP9
73,,SING,CAD,HAD1,no,N,73,,99113,19075,PP9
74,,SING,CAD,HAD2,no,N,74,,99113,19075,PP9
75,,SING,CBD,CGD,no,N,75,,99113,19075,PP9
76,,SING,CBD,HBD1,no,N,76,,99113,19075,PP9
77,,SING,CBD,HBD2,no,N,77,,99113,19075,PP9
78,,DOUB,CGD,O1D,no,N,78,,99113,19075,PP9
79,,SING,CGD,O2D,no,N,79,,99113,19075,PP9
80,,SING,O2D,H2D,no,N,80,,99113,19075,PP9
1,,SING,FE,NA,no,N,1,,99129,19076,HEB
2,,SING,FE,NB,no,N,2,,99129,19076,HEB
3,,SING,FE,NC,no,N,3,,99129,19076,HEB
4,,SING,FE,ND,no,N,4,,99129,19076,HEB
5,,DOUB,CHA,C1A,yes,N,5,,99129,19076,HEB
6,,SING,CHA,C4D,yes,N,6,,99129,19076,HEB
7,,SING,CHA,HHA,no,N,7,,99129,19076,HEB
8,,DOUB,CHB,C4A,yes,N,8,,99129,19076,HEB
9,,SING,CHB,C1B,yes,N,9,,99129,19076,HEB
10,,SING,CHB,HHB,no,N,10,,99129,19076,HEB
11,,DOUB,CHC,C4B,yes,N,11,,99129,19076,HEB
12,,SING,CHC,C1C,yes,N,12,,99129,19076,HEB
13,,SING,CHC,HHC,no,N,13,,99129,19076,HEB
14,,SING,CHD,C4C,yes,N,14,,99129,19076,HEB
15,,DOUB,CHD,C1D,yes,N,15,,99129,19076,HEB
16,,SING,CHD,HHD,no,N,16,,99129,19076,HEB
17,,SING,NA,C1A,yes,N,17,,99129,19076,HEB
18,,SING,NA,C4A,yes,N,18,,99129,19076,HEB
19,,SING,C1A,C2A,yes,N,19,,99129,19076,HEB
20,,DOUB,C2A,C3A,yes,N,20,,99129,19076,HEB
21,,SING,C2A,CAA,no,N,21,,99129,19076,HEB
22,,SING,C3A,C4A,yes,N,22,,99129,19076,HEB
23,,SING,C3A,CMA,no,N,23,,99129,19076,HEB
24,,SING,CMA,HMA1,no,N,24,,99129,19076,HEB
25,,SING,CMA,HMA2,no,N,25,,99129,19076,HEB
26,,SING,CMA,HMA3,no,N,26,,99129,19076,HEB
27,,SING,CAA,CBA,no,N,27,,99129,19076,HEB
28,,SING,CAA,HAA1,no,N,28,,99129,19076,HEB
29,,SING,CAA,HAA2,no,N,29,,99129,19076,HEB
30,,SING,CBA,CGA,no,N,30,,99129,19076,HEB
31,,SING,CBA,HBA1,no,N,31,,99129,19076,HEB
32,,SING,CBA,HBA2,no,N,32,,99129,19076,HEB
33,,DOUB,CGA,O1A,no,N,33,,99129,19076,HEB
34,,SING,CGA,O2A,no,N,34,,99129,19076,HEB
35,,SING,O2A,H2A,no,N,35,,99129,19076,HEB
36,,DOUB,NB,C1B,yes,N,36,,99129,19076,HEB
37,,SING,NB,C4B,yes,N,37,,99129,19076,HEB
38,,SING,C1B,C2B,no,N,38,,99129,19076,HEB
39,,DOUB,C2B,C3B,no,N,39,,99129,19076,HEB
40,,SING,C2B,CMB,no,N,40,,99129,19076,HEB
41,,SING,C3B,C4B,no,N,41,,99129,19076,HEB
42,,SING,C3B,CAB,no,N,42,,99129,19076,HEB
43,,SING,CMB,HMB1,no,N,43,,99129,19076,HEB
44,,SING,CMB,HMB2,no,N,44,,99129,19076,HEB
45,,SING,CMB,HMB3,no,N,45,,99129,19076,HEB
46,,SING,CAB,CBB,no,N,46,,99129,19076,HEB
47,,SING,CAB,HAB,no,N,47,,99129,19076,HEB
48,,SING,CAB,HAB2,no,N,48,,99129,19076,HEB
49,,SING,CBB,HBB1,no,N,49,,99129,19076,HEB
50,,SING,CBB,HBB2,no,N,50,,99129,19076,HEB
51,,SING,CBB,HBB3,no,N,51,,99129,19076,HEB
52,,SING,NC,C1C,yes,N,52,,99129,19076,HEB
53,,SING,NC,C4C,yes,N,53,,99129,19076,HEB
54,,DOUB,C1C,C2C,yes,N,54,,99129,19076,HEB
55,,SING,C2C,C3C,yes,N,55,,99129,19076,HEB
56,,SING,C2C,CMC,no,N,56,,99129,19076,HEB
57,,DOUB,C3C,C4C,yes,N,57,,99129,19076,HEB
58,,SING,C3C,CAC,no,N,58,,99129,19076,HEB
59,,SING,CMC,HMC1,no,N,59,,99129,19076,HEB
60,,SING,CMC,HMC2,no,N,60,,99129,19076,HEB
61,,SING,CMC,HMC3,no,N,61,,99129,19076,HEB
62,,DOUB,CAC,CBC,no,N,62,,99129,19076,HEB
63,,SING,CAC,HAC,no,N,63,,99129,19076,HEB
64,,SING,CBC,HBC1,no,N,64,,99129,19076,HEB
65,,SING,CBC,HBC2,no,N,65,,99129,19076,HEB
66,,SING,ND,C1D,yes,N,66,,99129,19076,HEB
67,,DOUB,ND,C4D,yes,N,67,,99129,19076,HEB
68,,SING,C1D,C2D,no,N,68,,99129,19076,HEB
69,,DOUB,C2D,C3D,no,N,69,,99129,19076,HEB
70,,SING,C2D,CMD,no,N,70,,99129,19076,HEB
71,,SING,C3D,C4D,no,N,71,,99129,19076,HEB
72,,SING,C3D,CAD,no,N,72,,99129,19076,HEB
73,,SING,CMD,HMD1,no,N,73,,99129,19076,HEB
10,,SING,C4,H41,,,,,240371,6145,TPLi
74,,SING,CMD,HMD2,no,N,74,,99129,19076,HEB
75,,SING,CMD,HMD3,no,N,75,,99129,19076,HEB
76,,SING,CAD,CBD,no,N,76,,99129,19076,HEB
77,,SING,CAD,HAD1,no,N,77,,99129,19076,HEB
78,,SING,CAD,HAD2,no,N,78,,99129,19076,HEB
79,,SING,CBD,CGD,no,N,79,,99129,19076,HEB
80,,SING,CBD,HBD1,no,N,80,,99129,19076,HEB
81,,SING,CBD,HBD2,no,N,81,,99129,19076,HEB
82,,DOUB,CGD,O1D,no,N,82,,99129,19076,HEB
83,,SING,CGD,O2D,no,N,83,,99129,19076,HEB
84,,SING,O2D,H2D,no,N,84,,99129,19076,HEB
1,,SING,C22,C20,no,N,1,,99180,19079,LL5
2,,SING,C22,H22,no,N,2,,99180,19079,LL5
3,,SING,C22,H22A,no,N,3,,99180,19079,LL5
4,,SING,C22,H22B,no,N,4,,99180,19079,LL5
5,,SING,C20,C19,no,N,5,,99180,19079,LL5
6,,SING,C20,C21,no,N,6,,99180,19079,LL5
7,,SING,C20,H20,no,N,7,,99180,19079,LL5
8,,SING,C21,H21,no,N,8,,99180,19079,LL5
9,,SING,C21,H21A,no,N,9,,99180,19079,LL5
10,,SING,C21,H21B,no,N,10,,99180,19079,LL5
11,,SING,C7,C19,no,N,11,,99180,19079,LL5
12,,SING,N33,C19,no,N,12,,99180,19079,LL5
13,,SING,C19,H19,no,N,13,,99180,19079,LL5
14,,SING,N33,HN33,no,N,14,,99180,19079,LL5
15,,SING,N33,HN3A,no,N,15,,99180,19079,LL5
16,,DOUB,O32,C7,no,N,16,,99180,19079,LL5
17,,SING,C7,N1,no,N,17,,99180,19079,LL5
18,,SING,C6,N1,no,N,18,,99180,19079,LL5
19,,SING,N1,C2,no,N,19,,99180,19079,LL5
20,,SING,C3,C2,no,N,20,,99180,19079,LL5
21,,SING,C2,H2,no,N,21,,99180,19079,LL5
22,,SING,C2,H2A,no,N,22,,99180,19079,LL5
23,,SING,C4,C3,no,N,23,,99180,19079,LL5
24,,SING,C3,H3,no,N,24,,99180,19079,LL5
25,,SING,C3,H3A,no,N,25,,99180,19079,LL5
26,,SING,C5,C6,no,N,26,,99180,19079,LL5
27,,SING,C6,H6,no,N,27,,99180,19079,LL5
28,,SING,C6,H6A,no,N,28,,99180,19079,LL5
29,,SING,C5,C4,no,N,29,,99180,19079,LL5
30,,SING,C5,H5,no,N,30,,99180,19079,LL5
31,,SING,C5,H5A,no,N,31,,99180,19079,LL5
32,,SING,C14,C4,no,N,32,,99180,19079,LL5
33,,SING,C4,H4,no,N,33,,99180,19079,LL5
34,,SING,O26,C14,yes,N,34,,99180,19079,LL5
35,,DOUB,C14,N23,yes,N,35,,99180,19079,LL5
36,,SING,C24,N23,yes,N,36,,99180,19079,LL5
37,,SING,N25,O26,yes,N,37,,99180,19079,LL5
38,,DOUB,N25,C24,yes,N,38,,99180,19079,LL5
39,,SING,C24,C27,yes,N,39,,99180,19079,LL5
40,,SING,S28,C27,yes,N,40,,99180,19079,LL5
41,,DOUB,C27,C31,yes,N,41,,99180,19079,LL5
42,,SING,C30,C31,yes,N,42,,99180,19079,LL5
43,,SING,C31,H31,no,N,43,,99180,19079,LL5
44,,DOUB,C29,C30,yes,N,44,,99180,19079,LL5
45,,SING,C30,H30,no,N,45,,99180,19079,LL5
46,,SING,S28,C29,yes,N,46,,99180,19079,LL5
47,,SING,C29,H29,no,N,47,,99180,19079,LL5
1,,DOUB,C8,C11,yes,N,1,,99181,19079,LL2
2,,SING,C8,C5,yes,N,2,,99181,19079,LL2
3,,SING,C11,C13,yes,N,3,,99181,19079,LL2
4,,DOUB,C13,C12,yes,N,4,,99181,19079,LL2
5,,SING,C12,C9,yes,N,5,,99181,19079,LL2
6,,DOUB,C9,C5,yes,N,6,,99181,19079,LL2
7,,SING,C5,C2,no,N,7,,99181,19079,LL2
8,,SING,C2,C1,no,N,8,,99181,19079,LL2
9,,SING,C1,S4,yes,N,9,,99181,19079,LL2
10,,DOUB,C1,C3,yes,N,10,,99181,19079,LL2
11,,SING,S4,C7,yes,N,11,,99181,19079,LL2
12,,SING,C3,N6,yes,N,12,,99181,19079,LL2
13,,DOUB,N6,C7,yes,N,13,,99181,19079,LL2
14,,SING,C7,N10,no,N,14,,99181,19079,LL2
15,,SING,C8,H8,no,N,15,,99181,19079,LL2
16,,SING,C11,H11,no,N,16,,99181,19079,LL2
17,,SING,C13,H13,no,N,17,,99181,19079,LL2
18,,SING,C12,H12,no,N,18,,99181,19079,LL2
19,,SING,C9,H9,no,N,19,,99181,19079,LL2
20,,SING,C2,H2,no,N,20,,99181,19079,LL2
21,,SING,C2,H2A,no,N,21,,99181,19079,LL2
22,,SING,C3,H3,no,N,22,,99181,19079,LL2
23,,SING,N10,HN10,no,N,23,,99181,19079,LL2
24,,SING,N10,HN1A,no,N,24,,99181,19079,LL2
1,,DOUB,N1,C2,yes,N,1,,99237,19082,C2F
2,,SING,N1,C8A,yes,N,2,,99237,19082,C2F
3,,SING,C2,NA2,no,N,3,,99237,19082,C2F
4,,SING,C2,N3,yes,N,4,,99237,19082,C2F
5,,SING,NA2,HN21,no,N,5,,99237,19082,C2F
6,,SING,NA2,HN22,no,N,6,,99237,19082,C2F
7,,SING,N3,C4,yes,N,7,,99237,19082,C2F
8,,SING,N3,HN3,no,N,8,,99237,19082,C2F
9,,DOUB,C4,O4,no,N,9,,99237,19082,C2F
10,,SING,C4,C4A,yes,N,10,,99237,19082,C2F
11,,SING,C4A,N5,no,N,11,,99237,19082,C2F
12,,DOUB,C4A,C8A,yes,N,12,,99237,19082,C2F
13,,SING,N5,C6,no,N,13,,99237,19082,C2F
14,,SING,N5,C11,no,N,14,,99237,19082,C2F
15,,SING,C6,C7,no,N,15,,99237,19082,C2F
16,,SING,C6,C9,no,N,16,,99237,19082,C2F
17,,SING,C6,H6,no,N,17,,99237,19082,C2F
18,,SING,C7,N8,no,N,18,,99237,19082,C2F
19,,SING,C7,H71,no,N,19,,99237,19082,C2F
20,,SING,C7,H72,no,N,20,,99237,19082,C2F
21,,SING,N8,C8A,no,N,21,,99237,19082,C2F
22,,SING,N8,HN8,no,N,22,,99237,19082,C2F
23,,SING,C9,N10,no,N,23,,99237,19082,C2F
24,,SING,C9,H91,no,N,24,,99237,19082,C2F
25,,SING,C9,H92,no,N,25,,99237,19082,C2F
26,,SING,N10,C15,no,N,26,,99237,19082,C2F
27,,SING,N10,HN1,no,N,27,,99237,19082,C2F
28,,SING,C11,H111,no,N,28,,99237,19082,C2F
29,,SING,C11,H112,no,N,29,,99237,19082,C2F
30,,SING,C11,H113,no,N,30,,99237,19082,C2F
31,,DOUB,C12,C13,yes,N,31,,99237,19082,C2F
32,,SING,C12,C17,yes,N,32,,99237,19082,C2F
33,,SING,C12,C,no,N,33,,99237,19082,C2F
34,,SING,C13,C14,yes,N,34,,99237,19082,C2F
35,,SING,C13,H13,no,N,35,,99237,19082,C2F
36,,DOUB,C14,C15,yes,N,36,,99237,19082,C2F
37,,SING,C14,H14,no,N,37,,99237,19082,C2F
38,,SING,C15,C16,yes,N,38,,99237,19082,C2F
39,,DOUB,C16,C17,yes,N,39,,99237,19082,C2F
40,,SING,C16,H16,no,N,40,,99237,19082,C2F
41,,SING,C17,H17,no,N,41,,99237,19082,C2F
42,,DOUB,C,O,no,N,42,,99237,19082,C2F
43,,SING,C,N,no,N,43,,99237,19082,C2F
44,,SING,N,CA,no,N,44,,99237,19082,C2F
45,,SING,N,HN,no,N,45,,99237,19082,C2F
46,,SING,CA,CB,no,N,46,,99237,19082,C2F
47,,SING,CA,CT,no,N,47,,99237,19082,C2F
48,,SING,CA,HA,no,N,48,,99237,19082,C2F
49,,SING,CB,CG,no,N,49,,99237,19082,C2F
50,,SING,CB,HB1,no,N,50,,99237,19082,C2F
51,,SING,CB,HB2,no,N,51,,99237,19082,C2F
52,,SING,CG,CD,no,N,52,,99237,19082,C2F
53,,SING,CG,HG1,no,N,53,,99237,19082,C2F
54,,SING,CG,HG2,no,N,54,,99237,19082,C2F
55,,DOUB,CD,OE1,no,N,55,,99237,19082,C2F
56,,SING,CD,OE2,no,N,56,,99237,19082,C2F
57,,SING,OE2,HOE2,no,N,57,,99237,19082,C2F
58,,DOUB,CT,O1,no,N,58,,99237,19082,C2F
59,,SING,CT,O2,no,N,59,,99237,19082,C2F
60,,SING,O2,HO2,no,N,60,,99237,19082,C2F
1,,SING,N1,C2,no,N,1,,99238,19082,UFP
2,,SING,N1,C6,no,N,2,,99238,19082,UFP
3,,SING,N1,C1',no,N,3,,99238,19082,UFP
4,,SING,C2,N3,no,N,4,,99238,19082,UFP
5,,DOUB,C2,O2,no,N,5,,99238,19082,UFP
6,,SING,N3,C4,no,N,6,,99238,19082,UFP
7,,SING,N3,HN3,no,N,7,,99238,19082,UFP
8,,SING,C4,C5,no,N,8,,99238,19082,UFP
9,,DOUB,C4,O4,no,N,9,,99238,19082,UFP
10,,DOUB,C5,C6,no,N,10,,99238,19082,UFP
11,,SING,C5,F5,no,N,11,,99238,19082,UFP
12,,SING,C6,H6,no,N,12,,99238,19082,UFP
13,,SING,C1',C2',no,N,13,,99238,19082,UFP
14,,SING,C1',O4',no,N,14,,99238,19082,UFP
15,,SING,C1',H1',no,N,15,,99238,19082,UFP
16,,SING,C2',C3',no,N,16,,99238,19082,UFP
17,,SING,C2',H2'1,no,N,17,,99238,19082,UFP
18,,SING,C2',H2'2,no,N,18,,99238,19082,UFP
19,,SING,C3',C4',no,N,19,,99238,19082,UFP
20,,SING,C3',O3',no,N,20,,99238,19082,UFP
21,,SING,C3',H3',no,N,21,,99238,19082,UFP
22,,SING,C4',O4',no,N,22,,99238,19082,UFP
23,,SING,C4',C5',no,N,23,,99238,19082,UFP
24,,SING,C4',H4',no,N,24,,99238,19082,UFP
25,,SING,O3',HO3',no,N,25,,99238,19082,UFP
26,,SING,C5',O5',no,N,26,,99238,19082,UFP
27,,SING,C5',H5'1,no,N,27,,99238,19082,UFP
28,,SING,C5',H5'2,no,N,28,,99238,19082,UFP
29,,SING,O5',P,no,N,29,,99238,19082,UFP
30,,DOUB,P,O1P,no,N,30,,99238,19082,UFP
31,,SING,P,O2P,no,N,31,,99238,19082,UFP
32,,SING,P,O3P,no,N,32,,99238,19082,UFP
33,,SING,O2P,HOP2,no,N,33,,99238,19082,UFP
34,,SING,O3P,HOP3,no,N,34,,99238,19082,UFP
1,,DOUB,PB,O1B,no,N,1,,99349,19089,ADP
2,,SING,PB,O2B,no,N,2,,99349,19089,ADP
3,,SING,PB,O3B,no,N,3,,99349,19089,ADP
4,,SING,PB,O3A,no,N,4,,99349,19089,ADP
5,,SING,O2B,HOB2,no,N,5,,99349,19089,ADP
6,,SING,O3B,HOB3,no,N,6,,99349,19089,ADP
7,,DOUB,PA,O1A,no,N,7,,99349,19089,ADP
8,,SING,PA,O2A,no,N,8,,99349,19089,ADP
9,,SING,PA,O3A,no,N,9,,99349,19089,ADP
10,,SING,PA,O5',no,N,10,,99349,19089,ADP
11,,SING,O2A,HOA2,no,N,11,,99349,19089,ADP
12,,SING,O5',C5',no,N,12,,99349,19089,ADP
13,,SING,C5',C4',no,N,13,,99349,19089,ADP
14,,SING,C5',H5'1,no,N,14,,99349,19089,ADP
15,,SING,C5',H5'2,no,N,15,,99349,19089,ADP
16,,SING,C4',O4',no,N,16,,99349,19089,ADP
17,,SING,C4',C3',no,N,17,,99349,19089,ADP
18,,SING,C4',H4',no,N,18,,99349,19089,ADP
19,,SING,O4',C1',no,N,19,,99349,19089,ADP
20,,SING,C3',O3',no,N,20,,99349,19089,ADP
21,,SING,C3',C2',no,N,21,,99349,19089,ADP
22,,SING,C3',H3',no,N,22,,99349,19089,ADP
23,,SING,O3',HO3',no,N,23,,99349,19089,ADP
24,,SING,C2',O2',no,N,24,,99349,19089,ADP
25,,SING,C2',C1',no,N,25,,99349,19089,ADP
26,,SING,C2',H2',no,N,26,,99349,19089,ADP
27,,SING,O2',HO2',no,N,27,,99349,19089,ADP
28,,SING,C1',N9,no,N,28,,99349,19089,ADP
29,,SING,C1',H1',no,N,29,,99349,19089,ADP
30,,SING,N9,C8,yes,N,30,,99349,19089,ADP
31,,SING,N9,C4,yes,N,31,,99349,19089,ADP
32,,DOUB,C8,N7,yes,N,32,,99349,19089,ADP
33,,SING,C8,H8,no,N,33,,99349,19089,ADP
34,,SING,N7,C5,yes,N,34,,99349,19089,ADP
35,,SING,C5,C6,yes,N,35,,99349,19089,ADP
36,,DOUB,C5,C4,yes,N,36,,99349,19089,ADP
37,,SING,C6,N6,no,N,37,,99349,19089,ADP
38,,DOUB,C6,N1,yes,N,38,,99349,19089,ADP
39,,SING,N6,HN61,no,N,39,,99349,19089,ADP
40,,SING,N6,HN62,no,N,40,,99349,19089,ADP
41,,SING,N1,C2,yes,N,41,,99349,19089,ADP
42,,DOUB,C2,N3,yes,N,42,,99349,19089,ADP
43,,SING,C2,H2,no,N,43,,99349,19089,ADP
44,,SING,N3,C4,yes,N,44,,99349,19089,ADP
1,,DOUB,PB,O1B,no,N,1,,99370,19090,ADP
2,,SING,PB,O2B,no,N,2,,99370,19090,ADP
3,,SING,PB,O3B,no,N,3,,99370,19090,ADP
4,,SING,PB,O3A,no,N,4,,99370,19090,ADP
5,,SING,O2B,HOB2,no,N,5,,99370,19090,ADP
6,,SING,O3B,HOB3,no,N,6,,99370,19090,ADP
7,,DOUB,PA,O1A,no,N,7,,99370,19090,ADP
8,,SING,PA,O2A,no,N,8,,99370,19090,ADP
9,,SING,PA,O3A,no,N,9,,99370,19090,ADP
10,,SING,PA,O5',no,N,10,,99370,19090,ADP
11,,SING,O2A,HOA2,no,N,11,,99370,19090,ADP
12,,SING,O5',C5',no,N,12,,99370,19090,ADP
13,,SING,C5',C4',no,N,13,,99370,19090,ADP
14,,SING,C5',H5'1,no,N,14,,99370,19090,ADP
15,,SING,C5',H5'2,no,N,15,,99370,19090,ADP
16,,SING,C4',O4',no,N,16,,99370,19090,ADP
17,,SING,C4',C3',no,N,17,,99370,19090,ADP
18,,SING,C4',H4',no,N,18,,99370,19090,ADP
19,,SING,O4',C1',no,N,19,,99370,19090,ADP
20,,SING,C3',O3',no,N,20,,99370,19090,ADP
21,,SING,C3',C2',no,N,21,,99370,19090,ADP
22,,SING,C3',H3',no,N,22,,99370,19090,ADP
23,,SING,O3',HO3',no,N,23,,99370,19090,ADP
24,,SING,C2',O2',no,N,24,,99370,19090,ADP
25,,SING,C2',C1',no,N,25,,99370,19090,ADP
26,,SING,C2',H2',no,N,26,,99370,19090,ADP
27,,SING,O2',HO2',no,N,27,,99370,19090,ADP
28,,SING,C1',N9,no,N,28,,99370,19090,ADP
29,,SING,C1',H1',no,N,29,,99370,19090,ADP
30,,SING,N9,C8,yes,N,30,,99370,19090,ADP
31,,SING,N9,C4,yes,N,31,,99370,19090,ADP
32,,DOUB,C8,N7,yes,N,32,,99370,19090,ADP
33,,SING,C8,H8,no,N,33,,99370,19090,ADP
34,,SING,N7,C5,yes,N,34,,99370,19090,ADP
35,,SING,C5,C6,yes,N,35,,99370,19090,ADP
36,,DOUB,C5,C4,yes,N,36,,99370,19090,ADP
37,,SING,C6,N6,no,N,37,,99370,19090,ADP
38,,DOUB,C6,N1,yes,N,38,,99370,19090,ADP
39,,SING,N6,HN61,no,N,39,,99370,19090,ADP
40,,SING,N6,HN62,no,N,40,,99370,19090,ADP
41,,SING,N1,C2,yes,N,41,,99370,19090,ADP
42,,DOUB,C2,N3,yes,N,42,,99370,19090,ADP
43,,SING,C2,H2,no,N,43,,99370,19090,ADP
44,,SING,N3,C4,yes,N,44,,99370,19090,ADP
1,,DOUB,PB,O1B,no,N,1,,99389,19091,ADP
2,,SING,PB,O2B,no,N,2,,99389,19091,ADP
3,,SING,PB,O3B,no,N,3,,99389,19091,ADP
4,,SING,PB,O3A,no,N,4,,99389,19091,ADP
5,,SING,O2B,HOB2,no,N,5,,99389,19091,ADP
6,,SING,O3B,HOB3,no,N,6,,99389,19091,ADP
7,,DOUB,PA,O1A,no,N,7,,99389,19091,ADP
8,,SING,PA,O2A,no,N,8,,99389,19091,ADP
9,,SING,PA,O3A,no,N,9,,99389,19091,ADP
10,,SING,PA,O5',no,N,10,,99389,19091,ADP
11,,SING,O2A,HOA2,no,N,11,,99389,19091,ADP
12,,SING,O5',C5',no,N,12,,99389,19091,ADP
13,,SING,C5',C4',no,N,13,,99389,19091,ADP
14,,SING,C5',H5'1,no,N,14,,99389,19091,ADP
15,,SING,C5',H5'2,no,N,15,,99389,19091,ADP
16,,SING,C4',O4',no,N,16,,99389,19091,ADP
17,,SING,C4',C3',no,N,17,,99389,19091,ADP
18,,SING,C4',H4',no,N,18,,99389,19091,ADP
19,,SING,O4',C1',no,N,19,,99389,19091,ADP
20,,SING,C3',O3',no,N,20,,99389,19091,ADP
21,,SING,C3',C2',no,N,21,,99389,19091,ADP
22,,SING,C3',H3',no,N,22,,99389,19091,ADP
23,,SING,O3',HO3',no,N,23,,99389,19091,ADP
24,,SING,C2',O2',no,N,24,,99389,19091,ADP
25,,SING,C2',C1',no,N,25,,99389,19091,ADP
26,,SING,C2',H2',no,N,26,,99389,19091,ADP
27,,SING,O2',HO2',no,N,27,,99389,19091,ADP
28,,SING,C1',N9,no,N,28,,99389,19091,ADP
29,,SING,C1',H1',no,N,29,,99389,19091,ADP
30,,SING,N9,C8,yes,N,30,,99389,19091,ADP
31,,SING,N9,C4,yes,N,31,,99389,19091,ADP
32,,DOUB,C8,N7,yes,N,32,,99389,19091,ADP
33,,SING,C8,H8,no,N,33,,99389,19091,ADP
34,,SING,N7,C5,yes,N,34,,99389,19091,ADP
35,,SING,C5,C6,yes,N,35,,99389,19091,ADP
36,,DOUB,C5,C4,yes,N,36,,99389,19091,ADP
37,,SING,C6,N6,no,N,37,,99389,19091,ADP
38,,DOUB,C6,N1,yes,N,38,,99389,19091,ADP
39,,SING,N6,HN61,no,N,39,,99389,19091,ADP
40,,SING,N6,HN62,no,N,40,,99389,19091,ADP
41,,SING,N1,C2,yes,N,41,,99389,19091,ADP
42,,DOUB,C2,N3,yes,N,42,,99389,19091,ADP
43,,SING,C2,H2,no,N,43,,99389,19091,ADP
44,,SING,N3,C4,yes,N,44,,99389,19091,ADP
1,,DOUB,PB,O1B,no,N,1,,99407,19092,ADP
2,,SING,PB,O2B,no,N,2,,99407,19092,ADP
3,,SING,PB,O3B,no,N,3,,99407,19092,ADP
4,,SING,PB,O3A,no,N,4,,99407,19092,ADP
5,,SING,O2B,HOB2,no,N,5,,99407,19092,ADP
6,,SING,O3B,HOB3,no,N,6,,99407,19092,ADP
7,,DOUB,PA,O1A,no,N,7,,99407,19092,ADP
8,,SING,PA,O2A,no,N,8,,99407,19092,ADP
9,,SING,PA,O3A,no,N,9,,99407,19092,ADP
10,,SING,PA,O5',no,N,10,,99407,19092,ADP
11,,SING,O2A,HOA2,no,N,11,,99407,19092,ADP
12,,SING,O5',C5',no,N,12,,99407,19092,ADP
13,,SING,C5',C4',no,N,13,,99407,19092,ADP
14,,SING,C5',H5'1,no,N,14,,99407,19092,ADP
15,,SING,C5',H5'2,no,N,15,,99407,19092,ADP
16,,SING,C4',O4',no,N,16,,99407,19092,ADP
17,,SING,C4',C3',no,N,17,,99407,19092,ADP
18,,SING,C4',H4',no,N,18,,99407,19092,ADP
19,,SING,O4',C1',no,N,19,,99407,19092,ADP
20,,SING,C3',O3',no,N,20,,99407,19092,ADP
21,,SING,C3',C2',no,N,21,,99407,19092,ADP
22,,SING,C3',H3',no,N,22,,99407,19092,ADP
23,,SING,O3',HO3',no,N,23,,99407,19092,ADP
24,,SING,C2',O2',no,N,24,,99407,19092,ADP
25,,SING,C2',C1',no,N,25,,99407,19092,ADP
26,,SING,C2',H2',no,N,26,,99407,19092,ADP
27,,SING,O2',HO2',no,N,27,,99407,19092,ADP
28,,SING,C1',N9,no,N,28,,99407,19092,ADP
29,,SING,C1',H1',no,N,29,,99407,19092,ADP
30,,SING,N9,C8,yes,N,30,,99407,19092,ADP
31,,SING,N9,C4,yes,N,31,,99407,19092,ADP
32,,DOUB,C8,N7,yes,N,32,,99407,19092,ADP
33,,SING,C8,H8,no,N,33,,99407,19092,ADP
34,,SING,N7,C5,yes,N,34,,99407,19092,ADP
35,,SING,C5,C6,yes,N,35,,99407,19092,ADP
36,,DOUB,C5,C4,yes,N,36,,99407,19092,ADP
37,,SING,C6,N6,no,N,37,,99407,19092,ADP
38,,DOUB,C6,N1,yes,N,38,,99407,19092,ADP
39,,SING,N6,HN61,no,N,39,,99407,19092,ADP
40,,SING,N6,HN62,no,N,40,,99407,19092,ADP
41,,SING,N1,C2,yes,N,41,,99407,19092,ADP
42,,DOUB,C2,N3,yes,N,42,,99407,19092,ADP
43,,SING,C2,H2,no,N,43,,99407,19092,ADP
44,,SING,N3,C4,yes,N,44,,99407,19092,ADP
1,,DOUB,PB,O1B,no,N,1,,99425,19093,ADP
2,,SING,PB,O2B,no,N,2,,99425,19093,ADP
3,,SING,PB,O3B,no,N,3,,99425,19093,ADP
4,,SING,PB,O3A,no,N,4,,99425,19093,ADP
5,,SING,O2B,HOB2,no,N,5,,99425,19093,ADP
6,,SING,O3B,HOB3,no,N,6,,99425,19093,ADP
7,,DOUB,PA,O1A,no,N,7,,99425,19093,ADP
8,,SING,PA,O2A,no,N,8,,99425,19093,ADP
9,,SING,PA,O3A,no,N,9,,99425,19093,ADP
10,,SING,PA,O5',no,N,10,,99425,19093,ADP
11,,SING,O2A,HOA2,no,N,11,,99425,19093,ADP
12,,SING,O5',C5',no,N,12,,99425,19093,ADP
13,,SING,C5',C4',no,N,13,,99425,19093,ADP
14,,SING,C5',H5'1,no,N,14,,99425,19093,ADP
15,,SING,C5',H5'2,no,N,15,,99425,19093,ADP
16,,SING,C4',O4',no,N,16,,99425,19093,ADP
17,,SING,C4',C3',no,N,17,,99425,19093,ADP
18,,SING,C4',H4',no,N,18,,99425,19093,ADP
19,,SING,O4',C1',no,N,19,,99425,19093,ADP
20,,SING,C3',O3',no,N,20,,99425,19093,ADP
21,,SING,C3',C2',no,N,21,,99425,19093,ADP
22,,SING,C3',H3',no,N,22,,99425,19093,ADP
23,,SING,O3',HO3',no,N,23,,99425,19093,ADP
24,,SING,C2',O2',no,N,24,,99425,19093,ADP
25,,SING,C2',C1',no,N,25,,99425,19093,ADP
26,,SING,C2',H2',no,N,26,,99425,19093,ADP
27,,SING,O2',HO2',no,N,27,,99425,19093,ADP
28,,SING,C1',N9,no,N,28,,99425,19093,ADP
29,,SING,C1',H1',no,N,29,,99425,19093,ADP
30,,SING,N9,C8,yes,N,30,,99425,19093,ADP
31,,SING,N9,C4,yes,N,31,,99425,19093,ADP
32,,DOUB,C8,N7,yes,N,32,,99425,19093,ADP
33,,SING,C8,H8,no,N,33,,99425,19093,ADP
34,,SING,N7,C5,yes,N,34,,99425,19093,ADP
35,,SING,C5,C6,yes,N,35,,99425,19093,ADP
36,,DOUB,C5,C4,yes,N,36,,99425,19093,ADP
37,,SING,C6,N6,no,N,37,,99425,19093,ADP
38,,DOUB,C6,N1,yes,N,38,,99425,19093,ADP
39,,SING,N6,HN61,no,N,39,,99425,19093,ADP
40,,SING,N6,HN62,no,N,40,,99425,19093,ADP
41,,SING,N1,C2,yes,N,41,,99425,19093,ADP
42,,DOUB,C2,N3,yes,N,42,,99425,19093,ADP
43,,SING,C2,H2,no,N,43,,99425,19093,ADP
44,,SING,N3,C4,yes,N,44,,99425,19093,ADP
1,,SING,N,CN,no,N,1,,99442,19094,FME
2,,SING,N,CA,no,N,2,,99442,19094,FME
3,,SING,N,H,no,N,3,,99442,19094,FME
4,,DOUB,CN,O1,no,N,4,,99442,19094,FME
5,,SING,CN,HCN,no,N,5,,99442,19094,FME
6,,SING,CA,CB,no,N,6,,99442,19094,FME
7,,SING,CA,C,no,N,7,,99442,19094,FME
8,,SING,CA,HA,no,N,8,,99442,19094,FME
9,,SING,CB,CG,no,N,9,,99442,19094,FME
10,,SING,CB,HB2,no,N,10,,99442,19094,FME
11,,SING,CB,HB3,no,N,11,,99442,19094,FME
12,,SING,CG,SD,no,N,12,,99442,19094,FME
13,,SING,CG,HG2,no,N,13,,99442,19094,FME
14,,SING,CG,HG3,no,N,14,,99442,19094,FME
15,,SING,SD,CE,no,N,15,,99442,19094,FME
16,,SING,CE,HE1,no,N,16,,99442,19094,FME
17,,SING,CE,HE2,no,N,17,,99442,19094,FME
18,,SING,CE,HE3,no,N,18,,99442,19094,FME
19,,DOUB,C,O,no,N,19,,99442,19094,FME
20,,SING,C,OXT,no,N,20,,99442,19094,FME
21,,SING,OXT,HXT,no,N,21,,99442,19094,FME
1,,SING,N,CN,no,N,1,,99517,19101,FME
2,,SING,N,CA,no,N,2,,99517,19101,FME
3,,SING,N,H,no,N,3,,99517,19101,FME
4,,DOUB,CN,O1,no,N,4,,99517,19101,FME
5,,SING,CN,HCN,no,N,5,,99517,19101,FME
6,,SING,CA,CB,no,N,6,,99517,19101,FME
7,,SING,CA,C,no,N,7,,99517,19101,FME
8,,SING,CA,HA,no,N,8,,99517,19101,FME
9,,SING,CB,CG,no,N,9,,99517,19101,FME
10,,SING,CB,HB2,no,N,10,,99517,19101,FME
11,,SING,CB,HB3,no,N,11,,99517,19101,FME
12,,SING,CG,SD,no,N,12,,99517,19101,FME
13,,SING,CG,HG2,no,N,13,,99517,19101,FME
14,,SING,CG,HG3,no,N,14,,99517,19101,FME
15,,SING,SD,CE,no,N,15,,99517,19101,FME
16,,SING,CE,HE1,no,N,16,,99517,19101,FME
17,,SING,CE,HE2,no,N,17,,99517,19101,FME
18,,SING,CE,HE3,no,N,18,,99517,19101,FME
19,,DOUB,C,O,no,N,19,,99517,19101,FME
20,,SING,C,OXT,no,N,20,,99517,19101,FME
21,,SING,OXT,HXT,no,N,21,,99517,19101,FME
1,,SING,N,CA,no,N,1,,99532,19102,HYP
2,,SING,N,CD,no,N,2,,99532,19102,HYP
3,,SING,N,H,no,N,3,,99532,19102,HYP
4,,SING,CA,C,no,N,4,,99532,19102,HYP
5,,SING,CA,CB,no,N,5,,99532,19102,HYP
6,,SING,CA,HA,no,N,6,,99532,19102,HYP
7,,DOUB,C,O,no,N,7,,99532,19102,HYP
8,,SING,C,OXT,no,N,8,,99532,19102,HYP
9,,SING,CB,CG,no,N,9,,99532,19102,HYP
10,,SING,CB,HB2,no,N,10,,99532,19102,HYP
11,,SING,CB,HB3,no,N,11,,99532,19102,HYP
12,,SING,CG,CD,no,N,12,,99532,19102,HYP
13,,SING,CG,OD1,no,N,13,,99532,19102,HYP
14,,SING,CG,HG,no,N,14,,99532,19102,HYP
15,,SING,CD,HD22,no,N,15,,99532,19102,HYP
16,,SING,CD,HD23,no,N,16,,99532,19102,HYP
17,,SING,OD1,HD1,no,N,17,,99532,19102,HYP
18,,SING,OXT,HXT,no,N,18,,99532,19102,HYP
1,,SING,N,HN1,no,N,1,,99533,19102,NH2
2,,SING,N,HN2,no,N,2,,99533,19102,NH2
1,,SING,N,CA,no,N,1,,99548,19103,HYP
2,,SING,N,CD,no,N,2,,99548,19103,HYP
3,,SING,N,H,no,N,3,,99548,19103,HYP
4,,SING,CA,C,no,N,4,,99548,19103,HYP
5,,SING,CA,CB,no,N,5,,99548,19103,HYP
6,,SING,CA,HA,no,N,6,,99548,19103,HYP
7,,DOUB,C,O,no,N,7,,99548,19103,HYP
8,,SING,C,OXT,no,N,8,,99548,19103,HYP
9,,SING,CB,CG,no,N,9,,99548,19103,HYP
10,,SING,CB,HB2,no,N,10,,99548,19103,HYP
11,,SING,CB,HB3,no,N,11,,99548,19103,HYP
12,,SING,CG,CD,no,N,12,,99548,19103,HYP
13,,SING,CG,OD1,no,N,13,,99548,19103,HYP
14,,SING,CG,HG,no,N,14,,99548,19103,HYP
15,,SING,CD,HD22,no,N,15,,99548,19103,HYP
16,,SING,CD,HD23,no,N,16,,99548,19103,HYP
17,,SING,OD1,HD1,no,N,17,,99548,19103,HYP
18,,SING,OXT,HXT,no,N,18,,99548,19103,HYP
1,,SING,N,CA,no,N,1,,99720,19112,TPO
2,,SING,N,H,no,N,2,,99720,19112,TPO
3,,SING,N,H2,no,N,3,,99720,19112,TPO
4,,SING,CA,CB,no,N,4,,99720,19112,TPO
5,,SING,CA,C,no,N,5,,99720,19112,TPO
6,,SING,CA,HA,no,N,6,,99720,19112,TPO
7,,SING,CB,CG2,no,N,7,,99720,19112,TPO
8,,SING,CB,OG1,no,N,8,,99720,19112,TPO
9,,SING,CB,HB,no,N,9,,99720,19112,TPO
10,,SING,CG2,HG21,no,N,10,,99720,19112,TPO
11,,SING,CG2,HG22,no,N,11,,99720,19112,TPO
12,,SING,CG2,HG23,no,N,12,,99720,19112,TPO
13,,SING,OG1,P,no,N,13,,99720,19112,TPO
14,,DOUB,P,O1P,no,N,14,,99720,19112,TPO
15,,SING,P,O2P,no,N,15,,99720,19112,TPO
16,,SING,P,O3P,no,N,16,,99720,19112,TPO
17,,SING,O2P,HOP2,no,N,17,,99720,19112,TPO
18,,SING,O3P,HOP3,no,N,18,,99720,19112,TPO
19,,DOUB,C,O,no,N,19,,99720,19112,TPO
20,,SING,C,OXT,no,N,20,,99720,19112,TPO
21,,SING,OXT,HXT,no,N,21,,99720,19112,TPO
1,,SING,N,CA,no,N,1,,99721,19112,SEP
2,,SING,N,H,no,N,2,,99721,19112,SEP
3,,SING,N,H2,no,N,3,,99721,19112,SEP
4,,SING,CA,CB,no,N,4,,99721,19112,SEP
5,,SING,CA,C,no,N,5,,99721,19112,SEP
6,,SING,CA,HA,no,N,6,,99721,19112,SEP
7,,SING,CB,OG,no,N,7,,99721,19112,SEP
8,,SING,CB,HB2,no,N,8,,99721,19112,SEP
9,,SING,CB,HB3,no,N,9,,99721,19112,SEP
10,,SING,OG,P,no,N,10,,99721,19112,SEP
11,,DOUB,C,O,no,N,11,,99721,19112,SEP
12,,SING,C,OXT,no,N,12,,99721,19112,SEP
13,,SING,OXT,HXT,no,N,13,,99721,19112,SEP
14,,DOUB,P,O1P,no,N,14,,99721,19112,SEP
15,,SING,P,O2P,no,N,15,,99721,19112,SEP
16,,SING,P,O3P,no,N,16,,99721,19112,SEP
17,,SING,O2P,HOP2,no,N,17,,99721,19112,SEP
18,,SING,O3P,HOP3,no,N,18,,99721,19112,SEP
1,,SING,C1,C2,no,N,1,,100217,19142,CAM
2,,SING,C1,C6,no,N,2,,100217,19142,CAM
3,,SING,C1,C7,no,N,3,,100217,19142,CAM
4,,SING,C1,C10,no,N,4,,100217,19142,CAM
5,,DOUB,C2,O,no,N,5,,100217,19142,CAM
6,,SING,C2,C3,no,N,6,,100217,19142,CAM
7,,SING,C3,C4,no,N,7,,100217,19142,CAM
8,,SING,C3,H31,no,N,8,,100217,19142,CAM
9,,SING,C3,H32,no,N,9,,100217,19142,CAM
10,,SING,C4,C5,no,N,10,,100217,19142,CAM
11,,SING,C4,C7,no,N,11,,100217,19142,CAM
12,,SING,C4,H4,no,N,12,,100217,19142,CAM
13,,SING,C5,C6,no,N,13,,100217,19142,CAM
14,,SING,C5,H51,no,N,14,,100217,19142,CAM
15,,SING,C5,H52,no,N,15,,100217,19142,CAM
16,,SING,C6,H61,no,N,16,,100217,19142,CAM
17,,SING,C6,H62,no,N,17,,100217,19142,CAM
18,,SING,C7,C8,no,N,18,,100217,19142,CAM
19,,SING,C7,C9,no,N,19,,100217,19142,CAM
20,,SING,C8,H81,no,N,20,,100217,19142,CAM
21,,SING,C8,H82,no,N,21,,100217,19142,CAM
22,,SING,C8,H83,no,N,22,,100217,19142,CAM
23,,SING,C9,H91,no,N,23,,100217,19142,CAM
24,,SING,C9,H92,no,N,24,,100217,19142,CAM
25,,SING,C9,H93,no,N,25,,100217,19142,CAM
26,,SING,C10,H101,no,N,26,,100217,19142,CAM
27,,SING,C10,H102,no,N,27,,100217,19142,CAM
28,,SING,C10,H103,no,N,28,,100217,19142,CAM
1,,SING,N,HN1,no,N,1,,100218,19142,NH2
2,,SING,N,HN2,no,N,2,,100218,19142,NH2
1,,SING,PA,O1A,no,N,1,,100269,19145,PCG
2,,DOUB,PA,O2A,no,N,2,,100269,19145,PCG
3,,SING,PA,O5',no,N,3,,100269,19145,PCG
4,,SING,PA,O3',no,N,4,,100269,19145,PCG
5,,SING,O1A,HO1A,no,N,5,,100269,19145,PCG
6,,SING,O5',C5',no,N,6,,100269,19145,PCG
7,,SING,C5',C4',no,N,7,,100269,19145,PCG
8,,SING,C5',H5'1,no,N,8,,100269,19145,PCG
9,,SING,C5',H5'2,no,N,9,,100269,19145,PCG
10,,SING,C4',O4',no,N,10,,100269,19145,PCG
11,,SING,C4',C3',no,N,11,,100269,19145,PCG
12,,SING,C4',H4',no,N,12,,100269,19145,PCG
13,,SING,O4',C1',no,N,13,,100269,19145,PCG
14,,SING,C3',O3',no,N,14,,100269,19145,PCG
15,,SING,C3',C2',no,N,15,,100269,19145,PCG
16,,SING,C3',H3',no,N,16,,100269,19145,PCG
17,,SING,C2',O2',no,N,17,,100269,19145,PCG
18,,SING,C2',C1',no,N,18,,100269,19145,PCG
19,,SING,C2',H2',no,N,19,,100269,19145,PCG
20,,SING,O2',HO2',no,N,20,,100269,19145,PCG
21,,SING,C1',N9,no,N,21,,100269,19145,PCG
22,,SING,C1',H1',no,N,22,,100269,19145,PCG
23,,SING,N9,C8,yes,N,23,,100269,19145,PCG
24,,SING,N9,C4,yes,N,24,,100269,19145,PCG
25,,DOUB,C8,N7,yes,N,25,,100269,19145,PCG
26,,SING,C8,H8,no,N,26,,100269,19145,PCG
27,,SING,N7,C5,yes,N,27,,100269,19145,PCG
28,,SING,C5,C6,no,N,28,,100269,19145,PCG
29,,DOUB,C5,C4,yes,N,29,,100269,19145,PCG
30,,DOUB,C6,O6,no,N,30,,100269,19145,PCG
31,,SING,C6,N1,no,N,31,,100269,19145,PCG
32,,SING,N1,C2,no,N,32,,100269,19145,PCG
33,,SING,N1,HN1,no,N,33,,100269,19145,PCG
34,,SING,C2,N2,no,N,34,,100269,19145,PCG
35,,DOUB,C2,N3,no,N,35,,100269,19145,PCG
36,,SING,N2,HN21,no,N,36,,100269,19145,PCG
37,,SING,N2,HN22,no,N,37,,100269,19145,PCG
38,,SING,N3,C4,no,N,38,,100269,19145,PCG
1,,DOUB,CHA,C1A,no,Z,1,,100358,19150,CYC
2,,SING,CHA,C4D,no,N,2,,100358,19150,CYC
3,,SING,CHA,HHA,no,N,3,,100358,19150,CYC
4,,SING,NA,C1A,no,N,4,,100358,19150,CYC
5,,DOUB,NA,C4A,no,N,5,,100358,19150,CYC
6,,SING,C1A,C2A,no,N,6,,100358,19150,CYC
7,,DOUB,C2A,C3A,no,N,7,,100358,19150,CYC
8,,SING,C2A,CAA,no,N,8,,100358,19150,CYC
9,,SING,C3A,C4A,no,N,9,,100358,19150,CYC
10,,SING,C3A,CMA,no,N,10,,100358,19150,CYC
11,,SING,C4A,CHB,no,N,11,,100358,19150,CYC
12,,SING,CMA,HMA1,no,N,12,,100358,19150,CYC
13,,SING,CMA,HMA2,no,N,13,,100358,19150,CYC
14,,SING,CMA,HMA3,no,N,14,,100358,19150,CYC
15,,SING,CAA,CBA,no,N,15,,100358,19150,CYC
16,,SING,CAA,HAA1,no,N,16,,100358,19150,CYC
17,,SING,CAA,HAA2,no,N,17,,100358,19150,CYC
18,,SING,CBA,CGA,no,N,18,,100358,19150,CYC
19,,SING,CBA,HBA1,no,N,19,,100358,19150,CYC
20,,SING,CBA,HBA2,no,N,20,,100358,19150,CYC
21,,DOUB,CGA,O1A,no,N,21,,100358,19150,CYC
22,,SING,CGA,O2A,no,N,22,,100358,19150,CYC
23,,SING,O2A,H2A,no,N,23,,100358,19150,CYC
24,,DOUB,CHB,C1B,no,Z,24,,100358,19150,CYC
25,,SING,CHB,HHB,no,N,25,,100358,19150,CYC
26,,SING,NB,C1B,no,N,26,,100358,19150,CYC
27,,SING,NB,C4B,no,N,27,,100358,19150,CYC
28,,SING,NB,HB,no,N,28,,100358,19150,CYC
29,,SING,C1B,C2B,no,N,29,,100358,19150,CYC
30,,DOUB,C2B,C3B,no,N,30,,100358,19150,CYC
31,,SING,C2B,CMB,no,N,31,,100358,19150,CYC
32,,SING,C3B,C4B,no,N,32,,100358,19150,CYC
33,,SING,C3B,CAB,no,N,33,,100358,19150,CYC
34,,DOUB,C4B,OB,no,N,34,,100358,19150,CYC
35,,SING,CMB,HMB1,no,N,35,,100358,19150,CYC
36,,SING,CMB,HMB2,no,N,36,,100358,19150,CYC
37,,SING,CMB,HMB3,no,N,37,,100358,19150,CYC
38,,SING,CAB,CBB,no,N,38,,100358,19150,CYC
39,,SING,CAB,HAB1,no,N,39,,100358,19150,CYC
40,,SING,CAB,HAB2,no,N,40,,100358,19150,CYC
41,,SING,CBB,HBB1,no,N,41,,100358,19150,CYC
42,,SING,CBB,HBB2,no,N,42,,100358,19150,CYC
43,,SING,CBB,HBB3,no,N,43,,100358,19150,CYC
44,,SING,NC,C1C,no,N,44,,100358,19150,CYC
45,,SING,NC,C4C,no,N,45,,100358,19150,CYC
46,,SING,NC,HC,no,N,46,,100358,19150,CYC
47,,SING,C1C,C2C,no,N,47,,100358,19150,CYC
48,,DOUB,C1C,OC,no,N,48,,100358,19150,CYC
49,,SING,C2C,C3C,no,N,49,,100358,19150,CYC
50,,SING,C2C,CMC,no,N,50,,100358,19150,CYC
51,,SING,C2C,H2C,no,N,51,,100358,19150,CYC
52,,SING,C3C,C4C,no,N,52,,100358,19150,CYC
53,,SING,C3C,CAC,no,N,53,,100358,19150,CYC
54,,SING,C3C,H3C,no,N,54,,100358,19150,CYC
55,,DOUB,C4C,CHD,no,Z,55,,100358,19150,CYC
56,,SING,CMC,HMC1,no,N,56,,100358,19150,CYC
57,,SING,CMC,HMC2,no,N,57,,100358,19150,CYC
58,,SING,CMC,HMC3,no,N,58,,100358,19150,CYC
59,,SING,CAC,CBC,no,N,59,,100358,19150,CYC
60,,SING,CAC,HAC1,no,N,60,,100358,19150,CYC
61,,SING,CAC,HAC2,no,N,61,,100358,19150,CYC
62,,SING,CBC,HBC1,no,N,62,,100358,19150,CYC
63,,SING,CBC,HBC2,no,N,63,,100358,19150,CYC
64,,SING,CBC,HBC3,no,N,64,,100358,19150,CYC
65,,SING,CHD,C1D,no,N,65,,100358,19150,CYC
66,,SING,CHD,HHD,no,N,66,,100358,19150,CYC
67,,SING,ND,C1D,yes,N,67,,100358,19150,CYC
68,,SING,ND,C4D,yes,N,68,,100358,19150,CYC
69,,SING,ND,HD,no,N,69,,100358,19150,CYC
70,,DOUB,C1D,C2D,yes,N,70,,100358,19150,CYC
71,,SING,C2D,C3D,yes,N,71,,100358,19150,CYC
72,,SING,C2D,CMD,no,N,72,,100358,19150,CYC
73,,DOUB,C3D,C4D,yes,N,73,,100358,19150,CYC
74,,SING,C3D,CAD,no,N,74,,100358,19150,CYC
75,,SING,CMD,HMD1,no,N,75,,100358,19150,CYC
76,,SING,CMD,HMD2,no,N,76,,100358,19150,CYC
77,,SING,CMD,HMD3,no,N,77,,100358,19150,CYC
78,,SING,CAD,CBD,no,N,78,,100358,19150,CYC
79,,SING,CAD,HAD1,no,N,79,,100358,19150,CYC
80,,SING,CAD,HAD2,no,N,80,,100358,19150,CYC
81,,SING,CBD,CGD,no,N,81,,100358,19150,CYC
82,,SING,CBD,HBD1,no,N,82,,100358,19150,CYC
83,,SING,CBD,HBD2,no,N,83,,100358,19150,CYC
84,,DOUB,CGD,O1D,no,N,84,,100358,19150,CYC
85,,SING,CGD,O2D,no,N,85,,100358,19150,CYC
86,,SING,O2D,H2D,no,N,86,,100358,19150,CYC
1,,SING,N1,C2,yes,N,1,,100393,19152,FMN
2,,DOUB,N1,C10,yes,N,2,,100393,19152,FMN
3,,DOUB,C2,O2,no,N,3,,100393,19152,FMN
4,,SING,C2,N3,yes,N,4,,100393,19152,FMN
5,,SING,N3,C4,yes,N,5,,100393,19152,FMN
6,,SING,N3,HN3,no,N,6,,100393,19152,FMN
7,,DOUB,C4,O4,no,N,7,,100393,19152,FMN
8,,SING,C4,C4A,yes,N,8,,100393,19152,FMN
9,,DOUB,C4A,N5,yes,N,9,,100393,19152,FMN
10,,SING,C4A,C10,yes,N,10,,100393,19152,FMN
11,,SING,N5,C5A,yes,N,11,,100393,19152,FMN
12,,DOUB,C5A,C6,yes,N,12,,100393,19152,FMN
13,,SING,C5A,C9A,yes,N,13,,100393,19152,FMN
14,,SING,C6,C7,yes,N,14,,100393,19152,FMN
15,,SING,C6,H6,no,N,15,,100393,19152,FMN
16,,SING,C7,C7M,no,N,16,,100393,19152,FMN
17,,DOUB,C7,C8,yes,N,17,,100393,19152,FMN
18,,SING,C7M,HM71,no,N,18,,100393,19152,FMN
19,,SING,C7M,HM72,no,N,19,,100393,19152,FMN
20,,SING,C7M,HM73,no,N,20,,100393,19152,FMN
21,,SING,C8,C8M,no,N,21,,100393,19152,FMN
22,,SING,C8,C9,yes,N,22,,100393,19152,FMN
23,,SING,C8M,HM81,no,N,23,,100393,19152,FMN
24,,SING,C8M,HM82,no,N,24,,100393,19152,FMN
25,,SING,C8M,HM83,no,N,25,,100393,19152,FMN
26,,DOUB,C9,C9A,yes,N,26,,100393,19152,FMN
27,,SING,C9,H9,no,N,27,,100393,19152,FMN
28,,SING,C9A,N10,yes,N,28,,100393,19152,FMN
29,,SING,N10,C10,yes,N,29,,100393,19152,FMN
30,,SING,N10,C1',no,N,30,,100393,19152,FMN
31,,SING,C1',C2',no,N,31,,100393,19152,FMN
32,,SING,C1',H1'1,no,N,32,,100393,19152,FMN
33,,SING,C1',H1'2,no,N,33,,100393,19152,FMN
34,,SING,C2',O2',no,N,34,,100393,19152,FMN
35,,SING,C2',C3',no,N,35,,100393,19152,FMN
36,,SING,C2',H2',no,N,36,,100393,19152,FMN
37,,SING,O2',HO2',no,N,37,,100393,19152,FMN
38,,SING,C3',O3',no,N,38,,100393,19152,FMN
39,,SING,C3',C4',no,N,39,,100393,19152,FMN
40,,SING,C3',H3',no,N,40,,100393,19152,FMN
41,,SING,O3',HO3',no,N,41,,100393,19152,FMN
42,,SING,C4',O4',no,N,42,,100393,19152,FMN
43,,SING,C4',C5',no,N,43,,100393,19152,FMN
44,,SING,C4',H4',no,N,44,,100393,19152,FMN
45,,SING,O4',HO4',no,N,45,,100393,19152,FMN
46,,SING,C5',O5',no,N,46,,100393,19152,FMN
47,,SING,C5',H5'1,no,N,47,,100393,19152,FMN
48,,SING,C5',H5'2,no,N,48,,100393,19152,FMN
49,,SING,O5',P,no,N,49,,100393,19152,FMN
50,,DOUB,P,O1P,no,N,50,,100393,19152,FMN
51,,SING,P,O2P,no,N,51,,100393,19152,FMN
52,,SING,P,O3P,no,N,52,,100393,19152,FMN
53,,SING,O2P,HOP2,no,N,53,,100393,19152,FMN
54,,SING,O3P,HOP3,no,N,54,,100393,19152,FMN
1,,SING,C,O,no,N,1,,100558,19160,GCH
2,,SING,C,C1,no,N,2,,100558,19160,GCH
3,,SING,C,C5,no,N,3,,100558,19160,GCH
4,,SING,C,H12,no,N,4,,100558,19160,GCH
5,,SING,O,H1,no,N,5,,100558,19160,GCH
6,,SING,C1,C2,no,N,6,,100558,19160,GCH
7,,SING,C1,H10,no,N,7,,100558,19160,GCH
8,,SING,C1,H11,no,N,8,,100558,19160,GCH
9,,SING,C2,C3,no,N,9,,100558,19160,GCH
10,,SING,C2,C7,no,N,10,,100558,19160,GCH
11,,SING,C2,H9,no,N,11,,100558,19160,GCH
12,,SING,C3,C4,no,N,12,,100558,19160,GCH
13,,SING,C3,C6,no,N,13,,100558,19160,GCH
14,,SING,C3,C10,no,N,14,,100558,19160,GCH
15,,SING,C4,C5,no,N,15,,100558,19160,GCH
16,,SING,C4,H4,no,N,16,,100558,19160,GCH
17,,SING,C4,H5,no,N,17,,100558,19160,GCH
18,,SING,C5,H2,no,N,18,,100558,19160,GCH
19,,SING,C5,H3,no,N,19,,100558,19160,GCH
20,,SING,C6,H6,no,N,20,,100558,19160,GCH
21,,SING,C6,H7,no,N,21,,100558,19160,GCH
22,,SING,C6,H8,no,N,22,,100558,19160,GCH
23,,SING,C7,C8,no,N,23,,100558,19160,GCH
24,,SING,C7,H17,no,N,24,,100558,19160,GCH
25,,SING,C7,H18,no,N,25,,100558,19160,GCH
26,,SING,C8,O1,no,N,26,,100558,19160,GCH
27,,SING,C8,C9,no,N,27,,100558,19160,GCH
28,,SING,C8,H16,no,N,28,,100558,19160,GCH
29,,SING,O1,H13,no,N,29,,100558,19160,GCH
30,,SING,C9,C10,no,N,30,,100558,19160,GCH
31,,SING,C9,C14,no,N,31,,100558,19160,GCH
32,,SING,C9,H15,no,N,32,,100558,19160,GCH
33,,SING,C10,C11,no,N,33,,100558,19160,GCH
34,,SING,C10,H14,no,N,34,,100558,19160,GCH
35,,SING,C11,C12,no,N,35,,100558,19160,GCH
36,,SING,C11,H41,no,N,36,,100558,19160,GCH
37,,SING,C11,H42,no,N,37,,100558,19160,GCH
38,,SING,C12,C13,no,N,38,,100558,19160,GCH
39,,SING,C12,O3,no,N,39,,100558,19160,GCH
40,,SING,C12,H40,no,N,40,,100558,19160,GCH
41,,SING,C13,C14,no,N,41,,100558,19160,GCH
42,,SING,C13,C17,no,N,42,,100558,19160,GCH
43,,SING,C13,C23,no,N,43,,100558,19160,GCH
44,,SING,C14,C15,no,N,44,,100558,19160,GCH
45,,SING,C14,H35,no,N,45,,100558,19160,GCH
46,,SING,C15,C16,no,N,46,,100558,19160,GCH
47,,SING,C15,H33,no,N,47,,100558,19160,GCH
48,,SING,C15,H34,no,N,48,,100558,19160,GCH
49,,SING,C16,C17,no,N,49,,100558,19160,GCH
50,,SING,C16,H31,no,N,50,,100558,19160,GCH
51,,SING,C16,H32,no,N,51,,100558,19160,GCH
52,,SING,C17,C18,no,N,52,,100558,19160,GCH
53,,SING,C17,H30,no,N,53,,100558,19160,GCH
54,,SING,C18,C19,no,N,54,,100558,19160,GCH
55,,SING,C18,C20,no,N,55,,100558,19160,GCH
56,,SING,C18,H29,no,N,56,,100558,19160,GCH
57,,SING,C19,H19,no,N,57,,100558,19160,GCH
58,,SING,C19,H20,no,N,58,,100558,19160,GCH
59,,SING,C19,H21,no,N,59,,100558,19160,GCH
60,,SING,C20,C21,no,N,60,,100558,19160,GCH
61,,SING,C20,H27,no,N,61,,100558,19160,GCH
62,,SING,C20,H28,no,N,62,,100558,19160,GCH
63,,SING,C21,C22,no,N,63,,100558,19160,GCH
64,,SING,C21,H25,no,N,64,,100558,19160,GCH
65,,SING,C21,H26,no,N,65,,100558,19160,GCH
66,,SING,C22,N,no,N,66,,100558,19160,GCH
67,,DOUB,C22,O2,no,N,67,,100558,19160,GCH
68,,SING,N,CA,no,N,68,,100558,19160,GCH
69,,SING,N,H24,no,N,69,,100558,19160,GCH
70,,SING,CA,C24,no,N,70,,100558,19160,GCH
71,,SING,CA,H22,no,N,71,,100558,19160,GCH
72,,SING,CA,H23,no,N,72,,100558,19160,GCH
73,,SING,C23,H36,no,N,73,,100558,19160,GCH
74,,SING,C23,H37,no,N,74,,100558,19160,GCH
75,,SING,C23,H38,no,N,75,,100558,19160,GCH
76,,SING,O3,H39,no,N,76,,100558,19160,GCH
77,,SING,C24,O4,no,N,77,,100558,19160,GCH
78,,DOUB,C24,O5,no,N,78,,100558,19160,GCH
79,,SING,O4,H43,no,N,79,,100558,19160,GCH
1,,SING,N,CA,no,N,1,,100746,1917,PCA
2,,SING,N,CD,no,N,2,,100746,1917,PCA
3,,SING,N,H,no,N,3,,100746,1917,PCA
4,,SING,CA,CB,no,N,4,,100746,1917,PCA
5,,SING,CA,C,no,N,5,,100746,1917,PCA
6,,SING,CA,HA,no,N,6,,100746,1917,PCA
7,,SING,CB,CG,no,N,7,,100746,1917,PCA
8,,SING,CB,HB2,no,N,8,,100746,1917,PCA
9,,SING,CB,HB3,no,N,9,,100746,1917,PCA
10,,SING,CG,CD,no,N,10,,100746,1917,PCA
11,,SING,CG,HG2,no,N,11,,100746,1917,PCA
12,,SING,CG,HG3,no,N,12,,100746,1917,PCA
13,,DOUB,CD,OE,no,N,13,,100746,1917,PCA
14,,DOUB,C,O,no,N,14,,100746,1917,PCA
15,,SING,C,OXT,no,N,15,,100746,1917,PCA
16,,SING,OXT,HXT,no,N,16,,100746,1917,PCA
1,,SING,N,CA,no,N,1,,100945,19180,AIB
2,,SING,N,H,no,N,2,,100945,19180,AIB
3,,SING,N,H2,no,N,3,,100945,19180,AIB
4,,SING,CA,C,no,N,4,,100945,19180,AIB
5,,SING,CA,CB1,no,N,5,,100945,19180,AIB
6,,SING,CA,CB2,no,N,6,,100945,19180,AIB
7,,DOUB,C,O,no,N,7,,100945,19180,AIB
8,,SING,C,OXT,no,N,8,,100945,19180,AIB
9,,SING,OXT,HO2,no,N,9,,100945,19180,AIB
10,,SING,CB1,HB11,no,N,10,,100945,19180,AIB
11,,SING,CB1,HB12,no,N,11,,100945,19180,AIB
12,,SING,CB1,HB13,no,N,12,,100945,19180,AIB
13,,SING,CB2,HB21,no,N,13,,100945,19180,AIB
14,,SING,CB2,HB22,no,N,14,,100945,19180,AIB
15,,SING,CB2,HB23,no,N,15,,100945,19180,AIB
1,,SING,N,CA,no,N,1,,100946,19180,DAL
2,,SING,N,H,no,N,2,,100946,19180,DAL
3,,SING,N,H2,no,N,3,,100946,19180,DAL
4,,SING,CA,CB,no,N,4,,100946,19180,DAL
5,,SING,CA,C,no,N,5,,100946,19180,DAL
6,,SING,CA,HA,no,N,6,,100946,19180,DAL
7,,SING,CB,HB1,no,N,7,,100946,19180,DAL
8,,SING,CB,HB2,no,N,8,,100946,19180,DAL
9,,SING,CB,HB3,no,N,9,,100946,19180,DAL
10,,DOUB,C,O,no,N,10,,100946,19180,DAL
11,,SING,C,OXT,no,N,11,,100946,19180,DAL
12,,SING,OXT,HXT,no,N,12,,100946,19180,DAL
1,,SING,N,CA,no,N,1,,100994,19183,DAL
2,,SING,N,H,no,N,2,,100994,19183,DAL
3,,SING,N,H2,no,N,3,,100994,19183,DAL
4,,SING,CA,CB,no,N,4,,100994,19183,DAL
5,,SING,CA,C,no,N,5,,100994,19183,DAL
6,,SING,CA,HA,no,N,6,,100994,19183,DAL
7,,SING,CB,HB1,no,N,7,,100994,19183,DAL
8,,SING,CB,HB2,no,N,8,,100994,19183,DAL
9,,SING,CB,HB3,no,N,9,,100994,19183,DAL
10,,DOUB,C,O,no,N,10,,100994,19183,DAL
11,,SING,C,OXT,no,N,11,,100994,19183,DAL
12,,SING,OXT,HXT,no,N,12,,100994,19183,DAL
1,,DOUB,C1,O1,no,N,1,,101080,19188,OLA
2,,SING,C1,O2,no,N,2,,101080,19188,OLA
3,,SING,C1,C2,no,N,3,,101080,19188,OLA
4,,SING,O2,HO2,no,N,4,,101080,19188,OLA
5,,SING,C2,C3,no,N,5,,101080,19188,OLA
6,,SING,C2,H21,no,N,6,,101080,19188,OLA
7,,SING,C2,H22,no,N,7,,101080,19188,OLA
8,,SING,C3,C4,no,N,8,,101080,19188,OLA
9,,SING,C3,H31,no,N,9,,101080,19188,OLA
10,,SING,C3,H32,no,N,10,,101080,19188,OLA
11,,SING,C4,C5,no,N,11,,101080,19188,OLA
12,,SING,C4,H41,no,N,12,,101080,19188,OLA
13,,SING,C4,H42,no,N,13,,101080,19188,OLA
14,,SING,C5,C6,no,N,14,,101080,19188,OLA
15,,SING,C5,H51,no,N,15,,101080,19188,OLA
16,,SING,C5,H52,no,N,16,,101080,19188,OLA
17,,SING,C6,C7,no,N,17,,101080,19188,OLA
18,,SING,C6,H61,no,N,18,,101080,19188,OLA
19,,SING,C6,H62,no,N,19,,101080,19188,OLA
20,,SING,C7,C8,no,N,20,,101080,19188,OLA
21,,SING,C7,H71,no,N,21,,101080,19188,OLA
22,,SING,C7,H72,no,N,22,,101080,19188,OLA
23,,SING,C8,C9,no,N,23,,101080,19188,OLA
24,,SING,C8,H81,no,N,24,,101080,19188,OLA
25,,SING,C8,H82,no,N,25,,101080,19188,OLA
26,,DOUB,C9,C10,no,Z,26,,101080,19188,OLA
27,,SING,C9,H9,no,N,27,,101080,19188,OLA
28,,SING,C10,C11,no,N,28,,101080,19188,OLA
29,,SING,C10,H10,no,N,29,,101080,19188,OLA
30,,SING,C11,C12,no,N,30,,101080,19188,OLA
31,,SING,C11,H111,no,N,31,,101080,19188,OLA
32,,SING,C11,H112,no,N,32,,101080,19188,OLA
33,,SING,C12,C13,no,N,33,,101080,19188,OLA
34,,SING,C12,H121,no,N,34,,101080,19188,OLA
35,,SING,C12,H122,no,N,35,,101080,19188,OLA
36,,SING,C13,C14,no,N,36,,101080,19188,OLA
37,,SING,C13,H131,no,N,37,,101080,19188,OLA
38,,SING,C13,H132,no,N,38,,101080,19188,OLA
39,,SING,C14,C15,no,N,39,,101080,19188,OLA
40,,SING,C14,H141,no,N,40,,101080,19188,OLA
41,,SING,C14,H142,no,N,41,,101080,19188,OLA
42,,SING,C15,C16,no,N,42,,101080,19188,OLA
43,,SING,C15,H151,no,N,43,,101080,19188,OLA
44,,SING,C15,H152,no,N,44,,101080,19188,OLA
45,,SING,C16,C17,no,N,45,,101080,19188,OLA
46,,SING,C16,H161,no,N,46,,101080,19188,OLA
47,,SING,C16,H162,no,N,47,,101080,19188,OLA
48,,SING,C17,C18,no,N,48,,101080,19188,OLA
49,,SING,C17,H171,no,N,49,,101080,19188,OLA
50,,SING,C17,H172,no,N,50,,101080,19188,OLA
51,,SING,C18,H181,no,N,51,,101080,19188,OLA
52,,SING,C18,H182,no,N,52,,101080,19188,OLA
53,,SING,C18,H183,no,N,53,,101080,19188,OLA
1,,SING,N,CA,no,N,1,,101130,19190,DAB
2,,SING,N,H,no,N,2,,101130,19190,DAB
3,,SING,N,H2,no,N,3,,101130,19190,DAB
4,,SING,CA,C,no,N,4,,101130,19190,DAB
5,,SING,CA,CB,no,N,5,,101130,19190,DAB
6,,SING,CA,HA,no,N,6,,101130,19190,DAB
7,,DOUB,C,O,no,N,7,,101130,19190,DAB
8,,SING,C,OXT,no,N,8,,101130,19190,DAB
9,,SING,CB,CG,no,N,9,,101130,19190,DAB
10,,SING,CB,HB2,no,N,10,,101130,19190,DAB
11,,SING,CB,HB3,no,N,11,,101130,19190,DAB
12,,SING,CG,ND,no,N,12,,101130,19190,DAB
13,,SING,CG,HG2,no,N,13,,101130,19190,DAB
14,,SING,CG,HG3,no,N,14,,101130,19190,DAB
15,,SING,ND,HD1,no,N,15,,101130,19190,DAB
16,,SING,ND,HD2,no,N,16,,101130,19190,DAB
17,,SING,OXT,HXT,no,N,17,,101130,19190,DAB
1,,SING,N,CA,no,N,1,,101131,19190,ORN
2,,SING,N,H,no,N,2,,101131,19190,ORN
3,,SING,N,H2,no,N,3,,101131,19190,ORN
4,,SING,CA,CB,no,N,4,,101131,19190,ORN
5,,SING,CA,C,no,N,5,,101131,19190,ORN
6,,SING,CA,HA,no,N,6,,101131,19190,ORN
7,,SING,CB,CG,no,N,7,,101131,19190,ORN
8,,SING,CB,HB2,no,N,8,,101131,19190,ORN
9,,SING,CB,HB3,no,N,9,,101131,19190,ORN
10,,SING,CG,CD,no,N,10,,101131,19190,ORN
11,,SING,CG,HG2,no,N,11,,101131,19190,ORN
12,,SING,CG,HG3,no,N,12,,101131,19190,ORN
13,,SING,CD,NE,no,N,13,,101131,19190,ORN
14,,SING,CD,HD2,no,N,14,,101131,19190,ORN
15,,SING,CD,HD3,no,N,15,,101131,19190,ORN
16,,SING,NE,HE1,no,N,16,,101131,19190,ORN
17,,SING,NE,HE2,no,N,17,,101131,19190,ORN
18,,DOUB,C,O,no,N,18,,101131,19190,ORN
19,,SING,C,OXT,no,N,19,,101131,19190,ORN
20,,SING,OXT,HXT,no,N,20,,101131,19190,ORN
1,,SING,N,CA,no,N,1,,101132,19190,DLY
2,,SING,N,H,no,N,2,,101132,19190,DLY
3,,SING,N,H2,no,N,3,,101132,19190,DLY
4,,SING,CA,C,no,N,4,,101132,19190,DLY
5,,SING,CA,CB,no,N,5,,101132,19190,DLY
6,,SING,CA,HA,no,N,6,,101132,19190,DLY
7,,DOUB,C,O,no,N,7,,101132,19190,DLY
8,,SING,C,OXT,no,N,8,,101132,19190,DLY
9,,SING,CB,CG,no,N,9,,101132,19190,DLY
10,,SING,CB,HB2,no,N,10,,101132,19190,DLY
11,,SING,CB,HB3,no,N,11,,101132,19190,DLY
12,,SING,CG,CD,no,N,12,,101132,19190,DLY
13,,SING,CG,HG2,no,N,13,,101132,19190,DLY
14,,SING,CG,HG3,no,N,14,,101132,19190,DLY
15,,SING,CD,CE,no,N,15,,101132,19190,DLY
16,,SING,CD,HD2,no,N,16,,101132,19190,DLY
17,,SING,CD,HD3,no,N,17,,101132,19190,DLY
18,,SING,CE,NZ,no,N,18,,101132,19190,DLY
19,,SING,CE,HE2,no,N,19,,101132,19190,DLY
20,,SING,CE,HE3,no,N,20,,101132,19190,DLY
21,,SING,NZ,HZ1,no,N,21,,101132,19190,DLY
22,,SING,NZ,HZ2,no,N,22,,101132,19190,DLY
23,,SING,OXT,HXT,no,N,23,,101132,19190,DLY
1,,SING,N,CA,no,N,1,,101133,19190,DPR
2,,SING,N,CD,no,N,2,,101133,19190,DPR
3,,SING,N,H,no,N,3,,101133,19190,DPR
4,,SING,CA,CB,no,N,4,,101133,19190,DPR
5,,SING,CA,C,no,N,5,,101133,19190,DPR
6,,SING,CA,HA,no,N,6,,101133,19190,DPR
7,,SING,CB,CG,no,N,7,,101133,19190,DPR
8,,SING,CB,HB2,no,N,8,,101133,19190,DPR
9,,SING,CB,HB3,no,N,9,,101133,19190,DPR
10,,SING,CG,CD,no,N,10,,101133,19190,DPR
11,,SING,CG,HG2,no,N,11,,101133,19190,DPR
12,,SING,CG,HG3,no,N,12,,101133,19190,DPR
13,,SING,CD,HD2,no,N,13,,101133,19190,DPR
14,,SING,CD,HD3,no,N,14,,101133,19190,DPR
15,,DOUB,C,O,no,N,15,,101133,19190,DPR
16,,SING,C,OXT,no,N,16,,101133,19190,DPR
17,,SING,OXT,HXT,no,N,17,,101133,19190,DPR
1,,SING,N,CA,no,N,1,,101167,19192,DPR
2,,SING,N,CD,no,N,2,,101167,19192,DPR
3,,SING,N,H,no,N,3,,101167,19192,DPR
4,,SING,CA,CB,no,N,4,,101167,19192,DPR
5,,SING,CA,C,no,N,5,,101167,19192,DPR
6,,SING,CA,HA,no,N,6,,101167,19192,DPR
7,,SING,CB,CG,no,N,7,,101167,19192,DPR
8,,SING,CB,HB2,no,N,8,,101167,19192,DPR
9,,SING,CB,HB3,no,N,9,,101167,19192,DPR
10,,SING,CG,CD,no,N,10,,101167,19192,DPR
11,,SING,CG,HG2,no,N,11,,101167,19192,DPR
12,,SING,CG,HG3,no,N,12,,101167,19192,DPR
13,,SING,CD,HD2,no,N,13,,101167,19192,DPR
14,,SING,CD,HD3,no,N,14,,101167,19192,DPR
15,,DOUB,C,O,no,N,15,,101167,19192,DPR
16,,SING,C,OXT,no,N,16,,101167,19192,DPR
17,,SING,OXT,HXT,no,N,17,,101167,19192,DPR
1,,SING,C1,C2,no,N,1,,101330,19200,ION
2,,SING,C1,C12,no,N,2,,101330,19200,ION
3,,SING,C1,H11,no,N,3,,101330,19200,ION
4,,SING,C1,H12,no,N,4,,101330,19200,ION
5,,SING,C2,C3,no,N,5,,101330,19200,ION
6,,SING,C2,C8,no,N,6,,101330,19200,ION
7,,SING,C2,C9,no,N,7,,101330,19200,ION
8,,SING,C3,C4,no,N,8,,101330,19200,ION
9,,SING,C3,C5,no,N,9,,101330,19200,ION
10,,SING,C3,H3,no,N,10,,101330,19200,ION
11,,SING,C4,H41,no,N,11,,101330,19200,ION
12,,SING,C4,H42,no,N,12,,101330,19200,ION
13,,SING,C4,H43,no,N,13,,101330,19200,ION
14,,SING,C5,C6,no,N,14,,101330,19200,ION
15,,SING,C5,H51,no,N,15,,101330,19200,ION
16,,SING,C5,H52,no,N,16,,101330,19200,ION
17,,SING,C6,C7,no,N,17,,101330,19200,ION
18,,SING,C6,H61,no,N,18,,101330,19200,ION
19,,SING,C6,H62,no,N,19,,101330,19200,ION
20,,SING,C7,C8,no,N,20,,101330,19200,ION
21,,SING,C7,H71,no,N,21,,101330,19200,ION
22,,SING,C7,H72,no,N,22,,101330,19200,ION
23,,DOUB,C8,C10,no,N,23,,101330,19200,ION
24,,SING,C9,H91,no,N,24,,101330,19200,ION
25,,SING,C9,H92,no,N,25,,101330,19200,ION
26,,SING,C9,H93,no,N,26,,101330,19200,ION
27,,SING,C10,C11,no,N,27,,101330,19200,ION
28,,SING,C10,H10,no,N,28,,101330,19200,ION
29,,SING,C11,C12,no,N,29,,101330,19200,ION
30,,SING,C11,H111,no,N,30,,101330,19200,ION
31,,SING,C11,H112,no,N,31,,101330,19200,ION
32,,SING,C12,C13,no,N,32,,101330,19200,ION
33,,SING,C12,H121,no,N,33,,101330,19200,ION
34,,SING,C13,C14,no,N,34,,101330,19200,ION
35,,DOUB,C13,C15,no,N,35,,101330,19200,ION
36,,SING,C14,H141,no,N,36,,101330,19200,ION
37,,SING,C14,H142,no,N,37,,101330,19200,ION
38,,SING,C14,H143,no,N,38,,101330,19200,ION
39,,SING,C15,H151,no,N,39,,101330,19200,ION
40,,SING,C15,H152,no,N,40,,101330,19200,ION
1,,SING,N,CA,no,N,1,,101369,19202,CGU
2,,SING,N,H,no,N,2,,101369,19202,CGU
3,,SING,N,HN2,no,N,3,,101369,19202,CGU
4,,SING,CA,C,no,N,4,,101369,19202,CGU
5,,SING,CA,CB,no,N,5,,101369,19202,CGU
6,,SING,CA,HA,no,N,6,,101369,19202,CGU
7,,DOUB,C,O,no,N,7,,101369,19202,CGU
8,,SING,C,OXT,no,N,8,,101369,19202,CGU
9,,SING,OXT,HXT,no,N,9,,101369,19202,CGU
10,,SING,CB,CG,no,N,10,,101369,19202,CGU
11,,SING,CB,HB2,no,N,11,,101369,19202,CGU
12,,SING,CB,HB3,no,N,12,,101369,19202,CGU
13,,SING,CG,CD1,no,N,13,,101369,19202,CGU
14,,SING,CG,CD2,no,N,14,,101369,19202,CGU
15,,SING,CG,HG,no,N,15,,101369,19202,CGU
16,,DOUB,CD1,OE11,no,N,16,,101369,19202,CGU
17,,SING,CD1,OE12,no,N,17,,101369,19202,CGU
18,,DOUB,CD2,OE21,no,N,18,,101369,19202,CGU
19,,SING,CD2,OE22,no,N,19,,101369,19202,CGU
20,,SING,OE12,HE12,no,N,20,,101369,19202,CGU
21,,SING,OE22,HE22,no,N,21,,101369,19202,CGU
1,,SING,N,HN1,no,N,1,,101370,19202,NH2
2,,SING,N,HN2,no,N,2,,101370,19202,NH2
1,,DOUB,PB,O1B,no,N,1,,101474,19208,ADP
2,,SING,PB,O2B,no,N,2,,101474,19208,ADP
3,,SING,PB,O3B,no,N,3,,101474,19208,ADP
4,,SING,PB,O3A,no,N,4,,101474,19208,ADP
5,,SING,O2B,HOB2,no,N,5,,101474,19208,ADP
6,,SING,O3B,HOB3,no,N,6,,101474,19208,ADP
7,,DOUB,PA,O1A,no,N,7,,101474,19208,ADP
8,,SING,PA,O2A,no,N,8,,101474,19208,ADP
9,,SING,PA,O3A,no,N,9,,101474,19208,ADP
10,,SING,PA,O5',no,N,10,,101474,19208,ADP
11,,SING,O2A,HOA2,no,N,11,,101474,19208,ADP
12,,SING,O5',C5',no,N,12,,101474,19208,ADP
13,,SING,C5',C4',no,N,13,,101474,19208,ADP
14,,SING,C5',H5'1,no,N,14,,101474,19208,ADP
15,,SING,C5',H5'2,no,N,15,,101474,19208,ADP
16,,SING,C4',O4',no,N,16,,101474,19208,ADP
17,,SING,C4',C3',no,N,17,,101474,19208,ADP
18,,SING,C4',H4',no,N,18,,101474,19208,ADP
19,,SING,O4',C1',no,N,19,,101474,19208,ADP
20,,SING,C3',O3',no,N,20,,101474,19208,ADP
21,,SING,C3',C2',no,N,21,,101474,19208,ADP
22,,SING,C3',H3',no,N,22,,101474,19208,ADP
23,,SING,O3',HO3',no,N,23,,101474,19208,ADP
24,,SING,C2',O2',no,N,24,,101474,19208,ADP
25,,SING,C2',C1',no,N,25,,101474,19208,ADP
26,,SING,C2',H2',no,N,26,,101474,19208,ADP
27,,SING,O2',HO2',no,N,27,,101474,19208,ADP
28,,SING,C1',N9,no,N,28,,101474,19208,ADP
29,,SING,C1',H1',no,N,29,,101474,19208,ADP
30,,SING,N9,C8,yes,N,30,,101474,19208,ADP
31,,SING,N9,C4,yes,N,31,,101474,19208,ADP
32,,DOUB,C8,N7,yes,N,32,,101474,19208,ADP
33,,SING,C8,H8,no,N,33,,101474,19208,ADP
34,,SING,N7,C5,yes,N,34,,101474,19208,ADP
35,,SING,C5,C6,yes,N,35,,101474,19208,ADP
36,,DOUB,C5,C4,yes,N,36,,101474,19208,ADP
37,,SING,C6,N6,no,N,37,,101474,19208,ADP
38,,DOUB,C6,N1,yes,N,38,,101474,19208,ADP
39,,SING,N6,HN61,no,N,39,,101474,19208,ADP
40,,SING,N6,HN62,no,N,40,,101474,19208,ADP
41,,SING,N1,C2,yes,N,41,,101474,19208,ADP
42,,DOUB,C2,N3,yes,N,42,,101474,19208,ADP
43,,SING,C2,H2,no,N,43,,101474,19208,ADP
44,,SING,N3,C4,yes,N,44,,101474,19208,ADP
1,,SING,N,CA,no,N,1,,101476,19208,ARG
2,,SING,N,H,no,N,2,,101476,19208,ARG
3,,SING,N,H2,no,N,3,,101476,19208,ARG
4,,SING,CA,C,no,N,4,,101476,19208,ARG
5,,SING,CA,CB,no,N,5,,101476,19208,ARG
6,,SING,CA,HA,no,N,6,,101476,19208,ARG
7,,DOUB,C,O,no,N,7,,101476,19208,ARG
8,,SING,C,OXT,no,N,8,,101476,19208,ARG
9,,SING,CB,CG,no,N,9,,101476,19208,ARG
10,,SING,CB,HB2,no,N,10,,101476,19208,ARG
11,,SING,CB,HB3,no,N,11,,101476,19208,ARG
12,,SING,CG,CD,no,N,12,,101476,19208,ARG
13,,SING,CG,HG2,no,N,13,,101476,19208,ARG
14,,SING,CG,HG3,no,N,14,,101476,19208,ARG
15,,SING,CD,NE,no,N,15,,101476,19208,ARG
16,,SING,CD,HD2,no,N,16,,101476,19208,ARG
17,,SING,CD,HD3,no,N,17,,101476,19208,ARG
18,,SING,NE,CZ,no,N,18,,101476,19208,ARG
19,,SING,NE,HE,no,N,19,,101476,19208,ARG
20,,SING,CZ,NH1,no,N,20,,101476,19208,ARG
21,,DOUB,CZ,NH2,no,N,21,,101476,19208,ARG
22,,SING,NH1,HH11,no,N,22,,101476,19208,ARG
23,,SING,NH1,HH12,no,N,23,,101476,19208,ARG
24,,SING,NH2,HH21,no,N,24,,101476,19208,ARG
25,,SING,NH2,HH22,no,N,25,,101476,19208,ARG
26,,SING,OXT,HXT,no,N,26,,101476,19208,ARG
1,,DOUB,N,O1,no,N,1,,101477,19208,NO3
2,,SING,N,O2,no,N,2,,101477,19208,NO3
3,,SING,N,O3,no,N,3,,101477,19208,NO3
1,,SING,C31,C32,no,N,1,,101584,19213,PVN
2,,SING,C31,C3,no,N,2,,101584,19213,PVN
3,,SING,C31,H31,no,N,3,,101584,19213,PVN
4,,SING,C31,HXT,no,N,4,,101584,19213,PVN
5,,SING,C32,H323,no,N,5,,101584,19213,PVN
6,,SING,C32,H321,no,N,6,,101584,19213,PVN
7,,SING,C32,H322,no,N,7,,101584,19213,PVN
8,,SING,C3,C4,no,N,8,,101584,19213,PVN
9,,DOUB,C3,C2,no,N,9,,101584,19213,PVN
10,,SING,C2,C21,no,N,10,,101584,19213,PVN
11,,SING,C2,C1,no,N,11,,101584,19213,PVN
12,,SING,C21,H212,no,N,12,,101584,19213,PVN
13,,SING,C21,H213,no,N,13,,101584,19213,PVN
14,,SING,C21,H211,no,N,14,,101584,19213,PVN
15,,DOUB,C1,O1,no,N,15,,101584,19213,PVN
16,,SING,C1,N1,no,N,16,,101584,19213,PVN
17,,SING,N1,C4,no,N,17,,101584,19213,PVN
18,,SING,N1,HN1,no,N,18,,101584,19213,PVN
19,,SING,C4,C5,no,N,19,,101584,19213,PVN
20,,SING,C4,HC4,no,N,20,,101584,19213,PVN
21,,SING,C5,C6,no,N,21,,101584,19213,PVN
22,,SING,C5,H5C2,no,N,22,,101584,19213,PVN
23,,SING,C5,H5C1,no,N,23,,101584,19213,PVN
24,,DOUB,C6,C7,yes,N,24,,101584,19213,PVN
25,,SING,C6,N2,yes,N,25,,101584,19213,PVN
26,,SING,C7,C41,no,N,26,,101584,19213,PVN
27,,SING,C7,C8,yes,N,27,,101584,19213,PVN
28,,SING,C41,H411,no,N,28,,101584,19213,PVN
29,,SING,C41,H412,no,N,29,,101584,19213,PVN
30,,SING,C41,H413,no,N,30,,101584,19213,PVN
31,,SING,N2,C9,yes,N,31,,101584,19213,PVN
32,,SING,N2,HN2,no,N,32,,101584,19213,PVN
33,,DOUB,C9,C8,yes,N,33,,101584,19213,PVN
34,,SING,C9,C10,no,N,34,,101584,19213,PVN
35,,SING,C8,C51,no,N,35,,101584,19213,PVN
36,,SING,C51,C52,no,N,36,,101584,19213,PVN
37,,SING,C51,H511,no,N,37,,101584,19213,PVN
38,,SING,C51,H512,no,N,38,,101584,19213,PVN
39,,SING,C52,C53,no,N,39,,101584,19213,PVN
40,,SING,C52,H522,no,N,40,,101584,19213,PVN
41,,SING,C52,H521,no,N,41,,101584,19213,PVN
42,,SING,C53,O54,no,N,42,,101584,19213,PVN
43,,DOUB,C53,O55,no,N,43,,101584,19213,PVN
44,,SING,O54,H54,no,N,44,,101584,19213,PVN
45,,DOUB,C10,C11,no,Z,45,,101584,19213,PVN
46,,SING,C10,H101,no,N,46,,101584,19213,PVN
47,,SING,C11,C12,no,N,47,,101584,19213,PVN
48,,SING,C11,N3,no,N,48,,101584,19213,PVN
49,,SING,C12,C61,no,N,49,,101584,19213,PVN
50,,DOUB,C12,C13,no,N,50,,101584,19213,PVN
51,,SING,C61,H611,no,N,51,,101584,19213,PVN
52,,SING,C61,H612,no,N,52,,101584,19213,PVN
53,,SING,C61,C62,no,N,53,,101584,19213,PVN
54,,SING,C62,H621,no,N,54,,101584,19213,PVN
55,,SING,C62,H622,no,N,55,,101584,19213,PVN
56,,SING,C62,C63,no,N,56,,101584,19213,PVN
57,,SING,C63,O65,no,N,57,,101584,19213,PVN
58,,DOUB,C63,O64,no,N,58,,101584,19213,PVN
59,,SING,O65,H65,no,N,59,,101584,19213,PVN
60,,DOUB,N3,C14,no,N,60,,101584,19213,PVN
61,,SING,C14,C13,no,N,61,,101584,19213,PVN
62,,SING,C14,C15,no,N,62,,101584,19213,PVN
63,,SING,C13,C71,no,N,63,,101584,19213,PVN
64,,SING,C71,H713,no,N,64,,101584,19213,PVN
65,,SING,C71,H711,no,N,65,,101584,19213,PVN
66,,SING,C71,H712,no,N,66,,101584,19213,PVN
67,,SING,C15,H151,no,N,67,,101584,19213,PVN
68,,DOUB,C15,C16,no,E,68,,101584,19213,PVN
69,,SING,C16,C17,no,N,69,,101584,19213,PVN
70,,SING,C16,N4,no,N,70,,101584,19213,PVN
71,,SING,C17,C81,no,N,71,,101584,19213,PVN
72,,DOUB,C17,C18,no,N,72,,101584,19213,PVN
73,,SING,C81,H811,no,N,73,,101584,19213,PVN
74,,SING,C81,H812,no,N,74,,101584,19213,PVN
75,,SING,C81,H813,no,N,75,,101584,19213,PVN
76,,SING,N4,HN4,no,N,76,,101584,19213,PVN
77,,SING,N4,C19,no,N,77,,101584,19213,PVN
78,,DOUB,C19,O19,no,N,78,,101584,19213,PVN
79,,SING,C19,C18,no,N,79,,101584,19213,PVN
80,,SING,C18,C91,no,N,80,,101584,19213,PVN
81,,SING,C91,H911,no,N,81,,101584,19213,PVN
82,,SING,C91,H912,no,N,82,,101584,19213,PVN
83,,SING,C91,C92,no,N,83,,101584,19213,PVN
84,,SING,C92,H921,no,N,84,,101584,19213,PVN
85,,SING,C92,H922,no,N,85,,101584,19213,PVN
86,,SING,C92,H923,no,N,86,,101584,19213,PVN
1,,DOUB,CHA,C1A,no,Z,1,,101605,19214,CYC
2,,SING,CHA,C4D,no,N,2,,101605,19214,CYC
3,,SING,CHA,HHA,no,N,3,,101605,19214,CYC
4,,SING,NA,C1A,no,N,4,,101605,19214,CYC
5,,DOUB,NA,C4A,no,N,5,,101605,19214,CYC
6,,SING,C1A,C2A,no,N,6,,101605,19214,CYC
7,,DOUB,C2A,C3A,no,N,7,,101605,19214,CYC
8,,SING,C2A,CAA,no,N,8,,101605,19214,CYC
9,,SING,C3A,C4A,no,N,9,,101605,19214,CYC
10,,SING,C3A,CMA,no,N,10,,101605,19214,CYC
11,,SING,C4A,CHB,no,N,11,,101605,19214,CYC
12,,SING,CMA,HMA1,no,N,12,,101605,19214,CYC
13,,SING,CMA,HMA2,no,N,13,,101605,19214,CYC
14,,SING,CMA,HMA3,no,N,14,,101605,19214,CYC
15,,SING,CAA,CBA,no,N,15,,101605,19214,CYC
16,,SING,CAA,HAA1,no,N,16,,101605,19214,CYC
17,,SING,CAA,HAA2,no,N,17,,101605,19214,CYC
18,,SING,CBA,CGA,no,N,18,,101605,19214,CYC
19,,SING,CBA,HBA1,no,N,19,,101605,19214,CYC
20,,SING,CBA,HBA2,no,N,20,,101605,19214,CYC
21,,DOUB,CGA,O1A,no,N,21,,101605,19214,CYC
22,,SING,CGA,O2A,no,N,22,,101605,19214,CYC
23,,SING,O2A,H2A,no,N,23,,101605,19214,CYC
24,,DOUB,CHB,C1B,no,Z,24,,101605,19214,CYC
25,,SING,CHB,HHB,no,N,25,,101605,19214,CYC
26,,SING,NB,C1B,no,N,26,,101605,19214,CYC
27,,SING,NB,C4B,no,N,27,,101605,19214,CYC
28,,SING,NB,HB,no,N,28,,101605,19214,CYC
29,,SING,C1B,C2B,no,N,29,,101605,19214,CYC
30,,DOUB,C2B,C3B,no,N,30,,101605,19214,CYC
31,,SING,C2B,CMB,no,N,31,,101605,19214,CYC
32,,SING,C3B,C4B,no,N,32,,101605,19214,CYC
33,,SING,C3B,CAB,no,N,33,,101605,19214,CYC
34,,DOUB,C4B,OB,no,N,34,,101605,19214,CYC
35,,SING,CMB,HMB1,no,N,35,,101605,19214,CYC
36,,SING,CMB,HMB2,no,N,36,,101605,19214,CYC
37,,SING,CMB,HMB3,no,N,37,,101605,19214,CYC
38,,SING,CAB,CBB,no,N,38,,101605,19214,CYC
39,,SING,CAB,HAB1,no,N,39,,101605,19214,CYC
40,,SING,CAB,HAB2,no,N,40,,101605,19214,CYC
41,,SING,CBB,HBB1,no,N,41,,101605,19214,CYC
42,,SING,CBB,HBB2,no,N,42,,101605,19214,CYC
43,,SING,CBB,HBB3,no,N,43,,101605,19214,CYC
44,,SING,NC,C1C,no,N,44,,101605,19214,CYC
45,,SING,NC,C4C,no,N,45,,101605,19214,CYC
46,,SING,NC,HC,no,N,46,,101605,19214,CYC
47,,SING,C1C,C2C,no,N,47,,101605,19214,CYC
48,,DOUB,C1C,OC,no,N,48,,101605,19214,CYC
49,,SING,C2C,C3C,no,N,49,,101605,19214,CYC
50,,SING,C2C,CMC,no,N,50,,101605,19214,CYC
51,,SING,C2C,H2C,no,N,51,,101605,19214,CYC
52,,SING,C3C,C4C,no,N,52,,101605,19214,CYC
53,,SING,C3C,CAC,no,N,53,,101605,19214,CYC
54,,SING,C3C,H3C,no,N,54,,101605,19214,CYC
55,,DOUB,C4C,CHD,no,Z,55,,101605,19214,CYC
56,,SING,CMC,HMC1,no,N,56,,101605,19214,CYC
57,,SING,CMC,HMC2,no,N,57,,101605,19214,CYC
58,,SING,CMC,HMC3,no,N,58,,101605,19214,CYC
59,,SING,CAC,CBC,no,N,59,,101605,19214,CYC
60,,SING,CAC,HAC1,no,N,60,,101605,19214,CYC
61,,SING,CAC,HAC2,no,N,61,,101605,19214,CYC
62,,SING,CBC,HBC1,no,N,62,,101605,19214,CYC
63,,SING,CBC,HBC2,no,N,63,,101605,19214,CYC
64,,SING,CBC,HBC3,no,N,64,,101605,19214,CYC
65,,SING,CHD,C1D,no,N,65,,101605,19214,CYC
66,,SING,CHD,HHD,no,N,66,,101605,19214,CYC
67,,SING,ND,C1D,yes,N,67,,101605,19214,CYC
68,,SING,ND,C4D,yes,N,68,,101605,19214,CYC
69,,SING,ND,HD,no,N,69,,101605,19214,CYC
70,,DOUB,C1D,C2D,yes,N,70,,101605,19214,CYC
71,,SING,C2D,C3D,yes,N,71,,101605,19214,CYC
72,,SING,C2D,CMD,no,N,72,,101605,19214,CYC
73,,DOUB,C3D,C4D,yes,N,73,,101605,19214,CYC
74,,SING,C3D,CAD,no,N,74,,101605,19214,CYC
75,,SING,CMD,HMD1,no,N,75,,101605,19214,CYC
76,,SING,CMD,HMD2,no,N,76,,101605,19214,CYC
77,,SING,CMD,HMD3,no,N,77,,101605,19214,CYC
78,,SING,CAD,CBD,no,N,78,,101605,19214,CYC
79,,SING,CAD,HAD1,no,N,79,,101605,19214,CYC
80,,SING,CAD,HAD2,no,N,80,,101605,19214,CYC
81,,SING,CBD,CGD,no,N,81,,101605,19214,CYC
82,,SING,CBD,HBD1,no,N,82,,101605,19214,CYC
83,,SING,CBD,HBD2,no,N,83,,101605,19214,CYC
84,,DOUB,CGD,O1D,no,N,84,,101605,19214,CYC
85,,SING,CGD,O2D,no,N,85,,101605,19214,CYC
86,,SING,O2D,H2D,no,N,86,,101605,19214,CYC
1,,DOUB,O2P,P,no,N,1,,101831,19226,CFZ
2,,SING,P,O5',no,N,2,,101831,19226,CFZ
3,,SING,P,O1P,no,N,3,,101831,19226,CFZ
4,,SING,P,O3P,no,N,4,,101831,19226,CFZ
5,,SING,C6,N1,no,N,5,,101831,19226,CFZ
6,,SING,C2,N1,no,N,6,,101831,19226,CFZ
7,,SING,N1,C1',no,N,7,,101831,19226,CFZ
8,,SING,N3,C2,no,N,8,,101831,19226,CFZ
9,,DOUB,C2,O2,no,N,9,,101831,19226,CFZ
10,,DOUB,C4,N3,no,N,10,,101831,19226,CFZ
11,,SING,N4,C4,no,N,11,,101831,19226,CFZ
12,,SING,C4,C5,no,N,12,,101831,19226,CFZ
13,,SING,N4,HN4,no,N,13,,101831,19226,CFZ
14,,SING,N4,HN4A,no,N,14,,101831,19226,CFZ
15,,DOUB,C5,C6,no,N,15,,101831,19226,CFZ
16,,SING,C5,H5,no,N,16,,101831,19226,CFZ
17,,SING,C6,H6,no,N,17,,101831,19226,CFZ
18,,SING,C2',C1',no,N,18,,101831,19226,CFZ
19,,SING,C1',O4',no,N,19,,101831,19226,CFZ
20,,SING,C1',H1',no,N,20,,101831,19226,CFZ
21,,SING,O1P,HO1P,no,N,21,,101831,19226,CFZ
22,,SING,C3',C2',no,N,22,,101831,19226,CFZ
23,,SING,C2',F2',no,N,23,,101831,19226,CFZ
24,,SING,C2',H2',no,N,24,,101831,19226,CFZ
25,,SING,C3',O3',no,N,25,,101831,19226,CFZ
26,,SING,C3',C4',no,N,26,,101831,19226,CFZ
27,,SING,C3',H3',no,N,27,,101831,19226,CFZ
28,,SING,O3',HO3',no,N,28,,101831,19226,CFZ
29,,SING,O3P,HO3P,no,N,29,,101831,19226,CFZ
30,,SING,O4',C4',no,N,30,,101831,19226,CFZ
31,,SING,C5',C4',no,N,31,,101831,19226,CFZ
32,,SING,C4',H4',no,N,32,,101831,19226,CFZ
33,,SING,O5',C5',no,N,33,,101831,19226,CFZ
34,,SING,C5',H5',no,N,34,,101831,19226,CFZ
35,,SING,C5',H5'A,no,N,35,,101831,19226,CFZ
1,,SING,P,O5',no,N,1,,101832,19226,GF2
2,,SING,N1,C2,no,N,2,,101832,19226,GF2
3,,DOUB,C2,N3,no,N,3,,101832,19226,GF2
4,,SING,C2,N2,no,N,4,,101832,19226,GF2
5,,SING,C4,N3,no,N,5,,101832,19226,GF2
6,,DOUB,C5,C4,yes,N,6,,101832,19226,GF2
7,,SING,C6,N1,no,N,7,,101832,19226,GF2
8,,SING,C6,C5,no,N,8,,101832,19226,GF2
9,,DOUB,O6,C6,no,N,9,,101832,19226,GF2
10,,SING,N7,C5,yes,N,10,,101832,19226,GF2
11,,DOUB,N7,C8,yes,N,11,,101832,19226,GF2
12,,SING,C8,N9,yes,N,12,,101832,19226,GF2
13,,SING,N9,C4,yes,N,13,,101832,19226,GF2
14,,SING,N9,C1',no,N,14,,101832,19226,GF2
15,,SING,C1',O4',no,N,15,,101832,19226,GF2
16,,SING,OP2,P,no,N,16,,101832,19226,GF2
17,,SING,C2',F,no,N,17,,101832,19226,GF2
18,,SING,C2',C1',no,N,18,,101832,19226,GF2
19,,DOUB,OP1,P,no,N,19,,101832,19226,GF2
20,,SING,C3',C2',no,N,20,,101832,19226,GF2
21,,SING,C3',C4',no,N,21,,101832,19226,GF2
22,,SING,O3',C3',no,N,22,,101832,19226,GF2
23,,SING,C4',O4',no,N,23,,101832,19226,GF2
24,,SING,C5',C4',no,N,24,,101832,19226,GF2
25,,SING,O5',C5',no,N,25,,101832,19226,GF2
26,,SING,P,OP3,no,N,26,,101832,19226,GF2
27,,SING,N1,HN1,no,N,27,,101832,19226,GF2
28,,SING,N2,HN2,no,N,28,,101832,19226,GF2
29,,SING,N2,HN2A,no,N,29,,101832,19226,GF2
30,,SING,C8,H8,no,N,30,,101832,19226,GF2
31,,SING,C1',H1',no,N,31,,101832,19226,GF2
32,,SING,OP2,HOP2,no,N,32,,101832,19226,GF2
33,,SING,C2',H2',no,N,33,,101832,19226,GF2
34,,SING,C3',H3',no,N,34,,101832,19226,GF2
35,,SING,O3',HO3',no,N,35,,101832,19226,GF2
36,,SING,C4',H4',no,N,36,,101832,19226,GF2
37,,SING,C5',H5',no,N,37,,101832,19226,GF2
38,,SING,C5',H5'A,no,N,38,,101832,19226,GF2
39,,SING,OP3,HOP3,no,N,39,,101832,19226,GF2
1,,SING,F,C2',no,N,1,,101833,19226,AF2
2,,DOUB,P,OP1,no,N,2,,101833,19226,AF2
3,,SING,P,OP2,no,N,3,,101833,19226,AF2
4,,SING,N1,C6,yes,N,4,,101833,19226,AF2
5,,DOUB,C2,N1,yes,N,5,,101833,19226,AF2
6,,SING,C2,N3,yes,N,6,,101833,19226,AF2
7,,DOUB,N3,C4,yes,N,7,,101833,19226,AF2
8,,SING,C4,N9,yes,N,8,,101833,19226,AF2
9,,SING,C4,C5,yes,N,9,,101833,19226,AF2
10,,SING,C5,N7,yes,N,10,,101833,19226,AF2
11,,DOUB,C6,C5,yes,N,11,,101833,19226,AF2
12,,SING,C6,N6,no,N,12,,101833,19226,AF2
13,,SING,N6,HN6A,no,N,13,,101833,19226,AF2
14,,DOUB,C8,N7,yes,N,14,,101833,19226,AF2
15,,SING,C8,H8,no,N,15,,101833,19226,AF2
16,,SING,N9,C8,yes,N,16,,101833,19226,AF2
17,,SING,C1',N9,no,N,17,,101833,19226,AF2
18,,SING,C1',C2',no,N,18,,101833,19226,AF2
19,,SING,OP2,HOP2,no,N,19,,101833,19226,AF2
20,,SING,C2',H2',no,N,20,,101833,19226,AF2
21,,SING,C2',C3',no,N,21,,101833,19226,AF2
22,,SING,C3',H3',no,N,22,,101833,19226,AF2
23,,SING,C3',O3',no,N,23,,101833,19226,AF2
24,,SING,O3',HO3',no,N,24,,101833,19226,AF2
25,,SING,C4',C3',no,N,25,,101833,19226,AF2
26,,SING,C4',C5',no,N,26,,101833,19226,AF2
27,,SING,O4',C1',no,N,27,,101833,19226,AF2
28,,SING,O4',C4',no,N,28,,101833,19226,AF2
29,,SING,C5',O5',no,N,29,,101833,19226,AF2
30,,SING,C5',H5'A,no,N,30,,101833,19226,AF2
31,,SING,O5',P,no,N,31,,101833,19226,AF2
32,,SING,H2,C2,no,N,32,,101833,19226,AF2
33,,SING,H5',C5',no,N,33,,101833,19226,AF2
34,,SING,H1',C1',no,N,34,,101833,19226,AF2
35,,SING,H4',C4',no,N,35,,101833,19226,AF2
36,,SING,HN6,N6,no,N,36,,101833,19226,AF2
37,,SING,P,OP3,no,N,37,,101833,19226,AF2
38,,SING,OP3,HOP3,no,N,38,,101833,19226,AF2
1,,SING,P,OP1,no,N,1,,101834,19226,TAF
2,,SING,P,OP2,no,N,2,,101834,19226,TAF
3,,DOUB,P,OP3,no,N,3,,101834,19226,TAF
4,,SING,P,O5',no,N,4,,101834,19226,TAF
5,,SING,OP1,HOP1,no,N,5,,101834,19226,TAF
6,,SING,OP2,HOP2,no,N,6,,101834,19226,TAF
7,,SING,O5',C5',no,N,7,,101834,19226,TAF
8,,SING,N1,C6,no,N,8,,101834,19226,TAF
9,,SING,N1,C2,no,N,9,,101834,19226,TAF
10,,SING,N1,C1',no,N,10,,101834,19226,TAF
11,,DOUB,C6,C5,no,N,11,,101834,19226,TAF
12,,SING,C6,H6,no,N,12,,101834,19226,TAF
13,,DOUB,C2,O2,no,N,13,,101834,19226,TAF
14,,SING,C2,N3,no,N,14,,101834,19226,TAF
15,,SING,N3,C4,no,N,15,,101834,19226,TAF
16,,SING,N3,H3,no,N,16,,101834,19226,TAF
17,,DOUB,C4,O4,no,N,17,,101834,19226,TAF
18,,SING,C4,C5,no,N,18,,101834,19226,TAF
19,,SING,C5,C5M,no,N,19,,101834,19226,TAF
20,,SING,C5M,H71,no,N,20,,101834,19226,TAF
21,,SING,C5M,H72,no,N,21,,101834,19226,TAF
22,,SING,C5M,H73,no,N,22,,101834,19226,TAF
23,,SING,F2',C2',no,N,23,,101834,19226,TAF
11,,SING,C4,H42,,,,,240371,6145,TPLi
24,,SING,C2',C1',no,N,24,,101834,19226,TAF
25,,SING,C2',C3',no,N,25,,101834,19226,TAF
26,,SING,C2',H2',no,N,26,,101834,19226,TAF
27,,SING,C5',C4',no,N,27,,101834,19226,TAF
28,,SING,C5',H5',no,N,28,,101834,19226,TAF
29,,SING,C5',H5'',no,N,29,,101834,19226,TAF
30,,SING,C4',O4',no,N,30,,101834,19226,TAF
31,,SING,C4',C3',no,N,31,,101834,19226,TAF
32,,SING,C4',H4',no,N,32,,101834,19226,TAF
33,,SING,O4',C1',no,N,33,,101834,19226,TAF
34,,SING,C1',H1',no,N,34,,101834,19226,TAF
35,,SING,C3',O3',no,N,35,,101834,19226,TAF
36,,SING,C3',H3',no,N,36,,101834,19226,TAF
37,,SING,O3',HO'3,no,N,37,,101834,19226,TAF
1,,SING,OP3,P,no,N,1,,101835,19226,UFT
2,,DOUB,OP1,P,no,N,2,,101835,19226,UFT
3,,SING,P,OP2,no,N,3,,101835,19226,UFT
4,,SING,P,O5',no,N,4,,101835,19226,UFT
5,,SING,OP3,HOP3,no,N,5,,101835,19226,UFT
6,,SING,OP2,HOP2,no,N,6,,101835,19226,UFT
7,,SING,O5',C5',no,N,7,,101835,19226,UFT
8,,SING,C6,N1,no,N,8,,101835,19226,UFT
9,,SING,N1,C2,no,N,9,,101835,19226,UFT
10,,SING,N1,C1',no,N,10,,101835,19226,UFT
11,,DOUB,C5,C6,no,N,11,,101835,19226,UFT
12,,SING,C6,H6,no,N,12,,101835,19226,UFT
13,,SING,N3,C2,no,N,13,,101835,19226,UFT
14,,DOUB,C2,O2,no,N,14,,101835,19226,UFT
15,,SING,C4,N3,no,N,15,,101835,19226,UFT
16,,DOUB,O4,C4,no,N,16,,101835,19226,UFT
17,,SING,C5,C4,no,N,17,,101835,19226,UFT
18,,SING,C5,H5,no,N,18,,101835,19226,UFT
19,,SING,C2',F2',no,N,19,,101835,19226,UFT
20,,SING,C3',C2',no,N,20,,101835,19226,UFT
21,,SING,C2',C1',no,N,21,,101835,19226,UFT
22,,SING,C2',H2',no,N,22,,101835,19226,UFT
23,,SING,C5',C4',no,N,23,,101835,19226,UFT
24,,SING,C5',H5',no,N,24,,101835,19226,UFT
25,,SING,C5',H5'A,no,N,25,,101835,19226,UFT
26,,SING,C3',C4',no,N,26,,101835,19226,UFT
27,,SING,C4',O4',no,N,27,,101835,19226,UFT
28,,SING,C4',H4',no,N,28,,101835,19226,UFT
29,,SING,O4',C1',no,N,29,,101835,19226,UFT
30,,SING,C1',H1',no,N,30,,101835,19226,UFT
31,,SING,C3',O3',no,N,31,,101835,19226,UFT
32,,SING,C3',H3',no,N,32,,101835,19226,UFT
33,,SING,O3',HO3',no,N,33,,101835,19226,UFT
34,,SING,N3,HN3,no,N,34,,101835,19226,UFT
1,,SING,O3P,P,no,N,1,,101836,19226,CFL
2,,SING,O3P,HO3P,no,N,2,,101836,19226,CFL
3,,SING,P,O1P,no,N,3,,101836,19226,CFL
4,,DOUB,P,O2P,no,N,4,,101836,19226,CFL
5,,SING,P,O5',no,N,5,,101836,19226,CFL
6,,SING,O1P,HO1P,no,N,6,,101836,19226,CFL
7,,SING,O5',C5',no,N,7,,101836,19226,CFL
8,,SING,C5',C4',no,N,8,,101836,19226,CFL
9,,SING,C5',H5'1,no,N,9,,101836,19226,CFL
10,,SING,C5',H5'2,no,N,10,,101836,19226,CFL
11,,SING,C4',O4',no,N,11,,101836,19226,CFL
12,,SING,C4',C3',no,N,12,,101836,19226,CFL
13,,SING,C4',H4',no,N,13,,101836,19226,CFL
14,,SING,O4',C1',no,N,14,,101836,19226,CFL
15,,SING,C3',O3',no,N,15,,101836,19226,CFL
16,,SING,C3',C2',no,N,16,,101836,19226,CFL
17,,SING,C3',H3',no,N,17,,101836,19226,CFL
18,,SING,O3',HO3',no,N,18,,101836,19226,CFL
19,,SING,C2',C1',no,N,19,,101836,19226,CFL
20,,SING,C2',F,no,N,20,,101836,19226,CFL
21,,SING,C2',H2',no,N,21,,101836,19226,CFL
22,,SING,C1',N1,no,N,22,,101836,19226,CFL
23,,SING,C1',H1',no,N,23,,101836,19226,CFL
24,,SING,N1,C2,no,N,24,,101836,19226,CFL
25,,SING,N1,C6,no,N,25,,101836,19226,CFL
26,,DOUB,C2,O2,no,N,26,,101836,19226,CFL
27,,SING,C2,N3,no,N,27,,101836,19226,CFL
28,,DOUB,N3,C4,no,N,28,,101836,19226,CFL
29,,SING,C4,N4,no,N,29,,101836,19226,CFL
30,,SING,C4,C5,no,N,30,,101836,19226,CFL
31,,SING,N4,HN41,no,N,31,,101836,19226,CFL
32,,SING,N4,HN42,no,N,32,,101836,19226,CFL
33,,DOUB,C5,C6,no,N,33,,101836,19226,CFL
34,,SING,C5,H5,no,N,34,,101836,19226,CFL
35,,SING,C6,H6,no,N,35,,101836,19226,CFL
1,,SING,O3P,P,no,N,1,,101837,19226,GFL
2,,SING,O3P,HO3P,no,N,2,,101837,19226,GFL
3,,DOUB,P,O1P,no,N,3,,101837,19226,GFL
4,,SING,P,O2P,no,N,4,,101837,19226,GFL
5,,SING,P,O5',no,N,5,,101837,19226,GFL
6,,SING,O2P,HO2P,no,N,6,,101837,19226,GFL
7,,SING,O5',C5',no,N,7,,101837,19226,GFL
8,,SING,C5',C4',no,N,8,,101837,19226,GFL
9,,SING,C5',H5'1,no,N,9,,101837,19226,GFL
10,,SING,C5',H5'2,no,N,10,,101837,19226,GFL
11,,SING,C4',O4',no,N,11,,101837,19226,GFL
12,,SING,C4',C3',no,N,12,,101837,19226,GFL
13,,SING,C4',H4',no,N,13,,101837,19226,GFL
14,,SING,O4',C1',no,N,14,,101837,19226,GFL
15,,SING,C3',O3',no,N,15,,101837,19226,GFL
16,,SING,C3',C2',no,N,16,,101837,19226,GFL
17,,SING,C3',H3',no,N,17,,101837,19226,GFL
18,,SING,O3',HO3',no,N,18,,101837,19226,GFL
12,,SING,C5,H51,,,,,240371,6145,TPLi
19,,SING,C2',C1',no,N,19,,101837,19226,GFL
20,,SING,C2',F,no,N,20,,101837,19226,GFL
21,,SING,C2',H2',no,N,21,,101837,19226,GFL
22,,SING,C1',N9,no,N,22,,101837,19226,GFL
23,,SING,C1',H1',no,N,23,,101837,19226,GFL
24,,SING,N9,C8,yes,N,24,,101837,19226,GFL
25,,SING,N9,C4,yes,N,25,,101837,19226,GFL
26,,DOUB,C8,N7,yes,N,26,,101837,19226,GFL
27,,SING,C8,H8,no,N,27,,101837,19226,GFL
28,,SING,N7,C5,yes,N,28,,101837,19226,GFL
29,,SING,C5,C6,no,N,29,,101837,19226,GFL
30,,DOUB,C5,C4,yes,N,30,,101837,19226,GFL
31,,DOUB,C6,O6,no,N,31,,101837,19226,GFL
32,,SING,C6,N1,no,N,32,,101837,19226,GFL
33,,SING,N1,C2,no,N,33,,101837,19226,GFL
34,,SING,N1,HN1,no,N,34,,101837,19226,GFL
35,,SING,C2,N2,no,N,35,,101837,19226,GFL
36,,DOUB,C2,N3,no,N,36,,101837,19226,GFL
37,,SING,N2,HN21,no,N,37,,101837,19226,GFL
38,,SING,N2,HN22,no,N,38,,101837,19226,GFL
39,,SING,N3,C4,no,N,39,,101837,19226,GFL
1,,SING,N,CA,no,N,1,,102062,19237,PCA
2,,SING,N,CD,no,N,2,,102062,19237,PCA
3,,SING,N,H,no,N,3,,102062,19237,PCA
4,,SING,CA,CB,no,N,4,,102062,19237,PCA
5,,SING,CA,C,no,N,5,,102062,19237,PCA
6,,SING,CA,HA,no,N,6,,102062,19237,PCA
7,,SING,CB,CG,no,N,7,,102062,19237,PCA
8,,SING,CB,HB2,no,N,8,,102062,19237,PCA
9,,SING,CB,HB3,no,N,9,,102062,19237,PCA
10,,SING,CG,CD,no,N,10,,102062,19237,PCA
11,,SING,CG,HG2,no,N,11,,102062,19237,PCA
12,,SING,CG,HG3,no,N,12,,102062,19237,PCA
13,,DOUB,CD,OE,no,N,13,,102062,19237,PCA
14,,DOUB,C,O,no,N,14,,102062,19237,PCA
15,,SING,C,OXT,no,N,15,,102062,19237,PCA
16,,SING,OXT,HXT,no,N,16,,102062,19237,PCA
1,,SING,N,CA,no,N,1,,102203,19245,HIS
2,,SING,N,H,no,N,2,,102203,19245,HIS
3,,SING,N,H2,no,N,3,,102203,19245,HIS
4,,SING,CA,C,no,N,4,,102203,19245,HIS
5,,SING,CA,CB,no,N,5,,102203,19245,HIS
6,,SING,CA,HA,no,N,6,,102203,19245,HIS
7,,DOUB,C,O,no,N,7,,102203,19245,HIS
8,,SING,C,OXT,no,N,8,,102203,19245,HIS
9,,SING,CB,CG,no,N,9,,102203,19245,HIS
10,,SING,CB,HB2,no,N,10,,102203,19245,HIS
11,,SING,CB,HB3,no,N,11,,102203,19245,HIS
12,,SING,CG,ND1,yes,N,12,,102203,19245,HIS
13,,DOUB,CG,CD2,yes,N,13,,102203,19245,HIS
14,,DOUB,ND1,CE1,yes,N,14,,102203,19245,HIS
15,,SING,ND1,HD1,no,N,15,,102203,19245,HIS
16,,SING,CD2,NE2,yes,N,16,,102203,19245,HIS
17,,SING,CD2,HD2,no,N,17,,102203,19245,HIS
18,,SING,CE1,NE2,yes,N,18,,102203,19245,HIS
19,,SING,CE1,HE1,no,N,19,,102203,19245,HIS
20,,SING,NE2,HE2,no,N,20,,102203,19245,HIS
21,,SING,OXT,HXT,no,N,21,,102203,19245,HIS
1,,SING,C13,C12,no,N,1,,102359,19254,KGM
2,,SING,C12,C11,no,N,2,,102359,19254,KGM
3,,SING,C11,C10,no,N,3,,102359,19254,KGM
4,,SING,C10,C9,no,N,4,,102359,19254,KGM
5,,SING,C9,C8,no,N,5,,102359,19254,KGM
6,,SING,C8,C7,no,N,6,,102359,19254,KGM
7,,SING,C7,O1,no,N,7,,102359,19254,KGM
8,,SING,O1,C1,no,N,8,,102359,19254,KGM
9,,SING,C1,C2,no,N,9,,102359,19254,KGM
10,,SING,C1,O5,no,N,10,,102359,19254,KGM
11,,SING,C2,O2,no,N,11,,102359,19254,KGM
12,,SING,C2,C3,no,N,12,,102359,19254,KGM
13,,SING,C3,O3,no,N,13,,102359,19254,KGM
14,,SING,C3,C4,no,N,14,,102359,19254,KGM
15,,SING,C4,O4,no,N,15,,102359,19254,KGM
16,,SING,C4,C5,no,N,16,,102359,19254,KGM
17,,SING,C5,O5,no,N,17,,102359,19254,KGM
18,,SING,C5,C6,no,N,18,,102359,19254,KGM
19,,SING,C6,O6,no,N,19,,102359,19254,KGM
20,,SING,C13,H131,no,N,20,,102359,19254,KGM
21,,SING,C13,H132,no,N,21,,102359,19254,KGM
22,,SING,C13,H133,no,N,22,,102359,19254,KGM
23,,SING,C12,H121,no,N,23,,102359,19254,KGM
24,,SING,C12,H122,no,N,24,,102359,19254,KGM
25,,SING,C11,H111,no,N,25,,102359,19254,KGM
26,,SING,C11,H112,no,N,26,,102359,19254,KGM
27,,SING,C10,H101,no,N,27,,102359,19254,KGM
28,,SING,C10,H102,no,N,28,,102359,19254,KGM
29,,SING,C9,H91C,no,N,29,,102359,19254,KGM
30,,SING,C9,H92C,no,N,30,,102359,19254,KGM
31,,SING,C8,H81C,no,N,31,,102359,19254,KGM
32,,SING,C8,H82C,no,N,32,,102359,19254,KGM
33,,SING,C7,H71C,no,N,33,,102359,19254,KGM
34,,SING,C7,H72C,no,N,34,,102359,19254,KGM
35,,SING,C1,H1,no,N,35,,102359,19254,KGM
36,,SING,C2,H2,no,N,36,,102359,19254,KGM
37,,SING,O2,HA,no,N,37,,102359,19254,KGM
38,,SING,C3,H3,no,N,38,,102359,19254,KGM
39,,SING,O3,HB,no,N,39,,102359,19254,KGM
40,,SING,C4,H4,no,N,40,,102359,19254,KGM
41,,SING,O4,HC,no,N,41,,102359,19254,KGM
42,,SING,C5,H5,no,N,42,,102359,19254,KGM
43,,SING,C6,H61C,no,N,43,,102359,19254,KGM
44,,SING,C6,H62C,no,N,44,,102359,19254,KGM
45,,SING,O6,H6,no,N,45,,102359,19254,KGM
1,,SING,C13,C12,no,N,1,,102399,19256,KGM
2,,SING,C12,C11,no,N,2,,102399,19256,KGM
3,,SING,C11,C10,no,N,3,,102399,19256,KGM
4,,SING,C10,C9,no,N,4,,102399,19256,KGM
5,,SING,C9,C8,no,N,5,,102399,19256,KGM
6,,SING,C8,C7,no,N,6,,102399,19256,KGM
7,,SING,C7,O1,no,N,7,,102399,19256,KGM
8,,SING,O1,C1,no,N,8,,102399,19256,KGM
9,,SING,C1,C2,no,N,9,,102399,19256,KGM
10,,SING,C1,O5,no,N,10,,102399,19256,KGM
11,,SING,C2,O2,no,N,11,,102399,19256,KGM
12,,SING,C2,C3,no,N,12,,102399,19256,KGM
13,,SING,C3,O3,no,N,13,,102399,19256,KGM
14,,SING,C3,C4,no,N,14,,102399,19256,KGM
15,,SING,C4,O4,no,N,15,,102399,19256,KGM
16,,SING,C4,C5,no,N,16,,102399,19256,KGM
17,,SING,C5,O5,no,N,17,,102399,19256,KGM
18,,SING,C5,C6,no,N,18,,102399,19256,KGM
19,,SING,C6,O6,no,N,19,,102399,19256,KGM
20,,SING,C13,H131,no,N,20,,102399,19256,KGM
21,,SING,C13,H132,no,N,21,,102399,19256,KGM
22,,SING,C13,H133,no,N,22,,102399,19256,KGM
23,,SING,C12,H121,no,N,23,,102399,19256,KGM
24,,SING,C12,H122,no,N,24,,102399,19256,KGM
25,,SING,C11,H111,no,N,25,,102399,19256,KGM
26,,SING,C11,H112,no,N,26,,102399,19256,KGM
27,,SING,C10,H101,no,N,27,,102399,19256,KGM
28,,SING,C10,H102,no,N,28,,102399,19256,KGM
29,,SING,C9,H91C,no,N,29,,102399,19256,KGM
30,,SING,C9,H92C,no,N,30,,102399,19256,KGM
31,,SING,C8,H81C,no,N,31,,102399,19256,KGM
32,,SING,C8,H82C,no,N,32,,102399,19256,KGM
33,,SING,C7,H71C,no,N,33,,102399,19256,KGM
34,,SING,C7,H72C,no,N,34,,102399,19256,KGM
35,,SING,C1,H1,no,N,35,,102399,19256,KGM
36,,SING,C2,H2,no,N,36,,102399,19256,KGM
37,,SING,O2,HA,no,N,37,,102399,19256,KGM
38,,SING,C3,H3,no,N,38,,102399,19256,KGM
39,,SING,O3,HB,no,N,39,,102399,19256,KGM
40,,SING,C4,H4,no,N,40,,102399,19256,KGM
41,,SING,O4,HC,no,N,41,,102399,19256,KGM
42,,SING,C5,H5,no,N,42,,102399,19256,KGM
43,,SING,C6,H61C,no,N,43,,102399,19256,KGM
44,,SING,C6,H62C,no,N,44,,102399,19256,KGM
45,,SING,O6,H6,no,N,45,,102399,19256,KGM
1,,SING,FE1,S1,no,N,1,,102709,19273,FES
2,,SING,FE1,S2,no,N,2,,102709,19273,FES
3,,SING,FE2,S1,no,N,3,,102709,19273,FES
4,,SING,FE2,S2,no,N,4,,102709,19273,FES
1,,SING,N,CA,no,N,1,,102746,19275,DBB
2,,SING,CA,C,no,N,2,,102746,19275,DBB
3,,SING,CA,CB,no,N,3,,102746,19275,DBB
4,,DOUB,C,O,no,N,4,,102746,19275,DBB
5,,SING,CB,CG,no,N,5,,102746,19275,DBB
6,,SING,C,OXT,no,N,6,,102746,19275,DBB
7,,SING,N,H,no,N,7,,102746,19275,DBB
8,,SING,N,H1,no,N,8,,102746,19275,DBB
9,,SING,CA,HA,no,N,9,,102746,19275,DBB
10,,SING,CB,HB2,no,N,10,,102746,19275,DBB
11,,SING,CB,HB3,no,N,11,,102746,19275,DBB
12,,SING,CG,HG1,no,N,12,,102746,19275,DBB
13,,SING,CG,HG2,no,N,13,,102746,19275,DBB
14,,SING,CG,HG3,no,N,14,,102746,19275,DBB
15,,SING,OXT,HXT,no,N,15,,102746,19275,DBB
1,,SING,BE,F1,no,N,1,,102973,19286,BEF
2,,SING,BE,F2,no,N,2,,102973,19286,BEF
3,,SING,BE,F3,no,N,3,,102973,19286,BEF
1,,SING,C1,C2,no,N,1,,103066,19292,NAG
2,,SING,C1,O1,no,N,2,,103066,19292,NAG
3,,SING,C1,O5,no,N,3,,103066,19292,NAG
4,,SING,C1,H1,no,N,4,,103066,19292,NAG
5,,SING,C2,C3,no,N,5,,103066,19292,NAG
6,,SING,C2,N2,no,N,6,,103066,19292,NAG
7,,SING,C2,H2,no,N,7,,103066,19292,NAG
8,,SING,C3,C4,no,N,8,,103066,19292,NAG
9,,SING,C3,O3,no,N,9,,103066,19292,NAG
10,,SING,C3,H3,no,N,10,,103066,19292,NAG
11,,SING,C4,C5,no,N,11,,103066,19292,NAG
12,,SING,C4,O4,no,N,12,,103066,19292,NAG
13,,SING,C4,H4,no,N,13,,103066,19292,NAG
14,,SING,C5,C6,no,N,14,,103066,19292,NAG
15,,SING,C5,O5,no,N,15,,103066,19292,NAG
16,,SING,C5,H5,no,N,16,,103066,19292,NAG
17,,SING,C6,O6,no,N,17,,103066,19292,NAG
18,,SING,C6,H61,no,N,18,,103066,19292,NAG
19,,SING,C6,H62,no,N,19,,103066,19292,NAG
20,,SING,C7,C8,no,N,20,,103066,19292,NAG
21,,SING,C7,N2,no,N,21,,103066,19292,NAG
22,,DOUB,C7,O7,no,N,22,,103066,19292,NAG
23,,SING,C8,H81,no,N,23,,103066,19292,NAG
24,,SING,C8,H82,no,N,24,,103066,19292,NAG
25,,SING,C8,H83,no,N,25,,103066,19292,NAG
26,,SING,N2,HN2,no,N,26,,103066,19292,NAG
27,,SING,O1,HO1,no,N,27,,103066,19292,NAG
28,,SING,O3,HO3,no,N,28,,103066,19292,NAG
29,,SING,O4,HO4,no,N,29,,103066,19292,NAG
30,,SING,O6,HO6,no,N,30,,103066,19292,NAG
1,,SING,C1,C2,no,N,1,,103130,19296,NAG
2,,SING,C1,O1,no,N,2,,103130,19296,NAG
3,,SING,C1,O5,no,N,3,,103130,19296,NAG
4,,SING,C1,H1,no,N,4,,103130,19296,NAG
5,,SING,C2,C3,no,N,5,,103130,19296,NAG
6,,SING,C2,N2,no,N,6,,103130,19296,NAG
7,,SING,C2,H2,no,N,7,,103130,19296,NAG
8,,SING,C3,C4,no,N,8,,103130,19296,NAG
9,,SING,C3,O3,no,N,9,,103130,19296,NAG
10,,SING,C3,H3,no,N,10,,103130,19296,NAG
11,,SING,C4,C5,no,N,11,,103130,19296,NAG
12,,SING,C4,O4,no,N,12,,103130,19296,NAG
13,,SING,C4,H4,no,N,13,,103130,19296,NAG
14,,SING,C5,C6,no,N,14,,103130,19296,NAG
15,,SING,C5,O5,no,N,15,,103130,19296,NAG
16,,SING,C5,H5,no,N,16,,103130,19296,NAG
17,,SING,C6,O6,no,N,17,,103130,19296,NAG
18,,SING,C6,H61,no,N,18,,103130,19296,NAG
19,,SING,C6,H62,no,N,19,,103130,19296,NAG
20,,SING,C7,C8,no,N,20,,103130,19296,NAG
21,,SING,C7,N2,no,N,21,,103130,19296,NAG
22,,DOUB,C7,O7,no,N,22,,103130,19296,NAG
23,,SING,C8,H81,no,N,23,,103130,19296,NAG
24,,SING,C8,H82,no,N,24,,103130,19296,NAG
25,,SING,C8,H83,no,N,25,,103130,19296,NAG
26,,SING,N2,HN2,no,N,26,,103130,19296,NAG
27,,SING,O1,HO1,no,N,27,,103130,19296,NAG
28,,SING,O3,HO3,no,N,28,,103130,19296,NAG
29,,SING,O4,HO4,no,N,29,,103130,19296,NAG
30,,SING,O6,HO6,no,N,30,,103130,19296,NAG
1,,SING,N1,C2,yes,N,1,,103246,19301,FMN
2,,DOUB,N1,C10,yes,N,2,,103246,19301,FMN
3,,DOUB,C2,O2,no,N,3,,103246,19301,FMN
4,,SING,C2,N3,yes,N,4,,103246,19301,FMN
5,,SING,N3,C4,yes,N,5,,103246,19301,FMN
6,,SING,N3,HN3,no,N,6,,103246,19301,FMN
7,,DOUB,C4,O4,no,N,7,,103246,19301,FMN
8,,SING,C4,C4A,yes,N,8,,103246,19301,FMN
9,,DOUB,C4A,N5,yes,N,9,,103246,19301,FMN
10,,SING,C4A,C10,yes,N,10,,103246,19301,FMN
11,,SING,N5,C5A,yes,N,11,,103246,19301,FMN
12,,DOUB,C5A,C6,yes,N,12,,103246,19301,FMN
13,,SING,C5A,C9A,yes,N,13,,103246,19301,FMN
14,,SING,C6,C7,yes,N,14,,103246,19301,FMN
15,,SING,C6,H6,no,N,15,,103246,19301,FMN
16,,SING,C7,C7M,no,N,16,,103246,19301,FMN
17,,DOUB,C7,C8,yes,N,17,,103246,19301,FMN
18,,SING,C7M,HM71,no,N,18,,103246,19301,FMN
19,,SING,C7M,HM72,no,N,19,,103246,19301,FMN
20,,SING,C7M,HM73,no,N,20,,103246,19301,FMN
21,,SING,C8,C8M,no,N,21,,103246,19301,FMN
22,,SING,C8,C9,yes,N,22,,103246,19301,FMN
23,,SING,C8M,HM81,no,N,23,,103246,19301,FMN
24,,SING,C8M,HM82,no,N,24,,103246,19301,FMN
25,,SING,C8M,HM83,no,N,25,,103246,19301,FMN
26,,DOUB,C9,C9A,yes,N,26,,103246,19301,FMN
27,,SING,C9,H9,no,N,27,,103246,19301,FMN
28,,SING,C9A,N10,yes,N,28,,103246,19301,FMN
29,,SING,N10,C10,yes,N,29,,103246,19301,FMN
30,,SING,N10,C1',no,N,30,,103246,19301,FMN
31,,SING,C1',C2',no,N,31,,103246,19301,FMN
32,,SING,C1',H1'1,no,N,32,,103246,19301,FMN
33,,SING,C1',H1'2,no,N,33,,103246,19301,FMN
34,,SING,C2',O2',no,N,34,,103246,19301,FMN
35,,SING,C2',C3',no,N,35,,103246,19301,FMN
36,,SING,C2',H2',no,N,36,,103246,19301,FMN
37,,SING,O2',HO2',no,N,37,,103246,19301,FMN
38,,SING,C3',O3',no,N,38,,103246,19301,FMN
39,,SING,C3',C4',no,N,39,,103246,19301,FMN
40,,SING,C3',H3',no,N,40,,103246,19301,FMN
41,,SING,O3',HO3',no,N,41,,103246,19301,FMN
42,,SING,C4',O4',no,N,42,,103246,19301,FMN
43,,SING,C4',C5',no,N,43,,103246,19301,FMN
44,,SING,C4',H4',no,N,44,,103246,19301,FMN
45,,SING,O4',HO4',no,N,45,,103246,19301,FMN
46,,SING,C5',O5',no,N,46,,103246,19301,FMN
47,,SING,C5',H5'1,no,N,47,,103246,19301,FMN
48,,SING,C5',H5'2,no,N,48,,103246,19301,FMN
49,,SING,O5',P,no,N,49,,103246,19301,FMN
50,,DOUB,P,O1P,no,N,50,,103246,19301,FMN
51,,SING,P,O2P,no,N,51,,103246,19301,FMN
52,,SING,P,O3P,no,N,52,,103246,19301,FMN
53,,SING,O2P,HOP2,no,N,53,,103246,19301,FMN
54,,SING,O3P,HOP3,no,N,54,,103246,19301,FMN
1,,DOUB,PA,O1A,no,N,1,,103247,19301,FAD
2,,SING,PA,O2A,no,N,2,,103247,19301,FAD
3,,SING,PA,O5B,no,N,3,,103247,19301,FAD
4,,SING,PA,O3P,no,N,4,,103247,19301,FAD
5,,SING,O2A,HOA2,no,N,5,,103247,19301,FAD
6,,SING,O5B,C5B,no,N,6,,103247,19301,FAD
7,,SING,C5B,C4B,no,N,7,,103247,19301,FAD
8,,SING,C5B,H51A,no,N,8,,103247,19301,FAD
9,,SING,C5B,H52A,no,N,9,,103247,19301,FAD
10,,SING,C4B,O4B,no,N,10,,103247,19301,FAD
11,,SING,C4B,C3B,no,N,11,,103247,19301,FAD
12,,SING,C4B,H4B,no,N,12,,103247,19301,FAD
13,,SING,O4B,C1B,no,N,13,,103247,19301,FAD
14,,SING,C3B,O3B,no,N,14,,103247,19301,FAD
15,,SING,C3B,C2B,no,N,15,,103247,19301,FAD
16,,SING,C3B,H3B,no,N,16,,103247,19301,FAD
17,,SING,O3B,HO3A,no,N,17,,103247,19301,FAD
18,,SING,C2B,O2B,no,N,18,,103247,19301,FAD
19,,SING,C2B,C1B,no,N,19,,103247,19301,FAD
20,,SING,C2B,H2B,no,N,20,,103247,19301,FAD
21,,SING,O2B,HO2A,no,N,21,,103247,19301,FAD
22,,SING,C1B,N9A,no,N,22,,103247,19301,FAD
23,,SING,C1B,H1B,no,N,23,,103247,19301,FAD
24,,SING,N9A,C8A,yes,N,24,,103247,19301,FAD
25,,SING,N9A,C4A,yes,N,25,,103247,19301,FAD
26,,DOUB,C8A,N7A,yes,N,26,,103247,19301,FAD
27,,SING,C8A,H8A,no,N,27,,103247,19301,FAD
28,,SING,N7A,C5A,yes,N,28,,103247,19301,FAD
29,,SING,C5A,C6A,yes,N,29,,103247,19301,FAD
30,,DOUB,C5A,C4A,yes,N,30,,103247,19301,FAD
31,,SING,C6A,N6A,no,N,31,,103247,19301,FAD
32,,DOUB,C6A,N1A,yes,N,32,,103247,19301,FAD
33,,SING,N6A,H61A,no,N,33,,103247,19301,FAD
34,,SING,N6A,H62A,no,N,34,,103247,19301,FAD
35,,SING,N1A,C2A,yes,N,35,,103247,19301,FAD
36,,DOUB,C2A,N3A,yes,N,36,,103247,19301,FAD
37,,SING,C2A,H2A,no,N,37,,103247,19301,FAD
38,,SING,N3A,C4A,yes,N,38,,103247,19301,FAD
39,,SING,N1,C2,no,N,39,,103247,19301,FAD
40,,DOUB,N1,C10,no,N,40,,103247,19301,FAD
41,,DOUB,C2,O2,no,N,41,,103247,19301,FAD
42,,SING,C2,N3,no,N,42,,103247,19301,FAD
43,,SING,N3,C4,no,N,43,,103247,19301,FAD
44,,SING,N3,HN3,no,N,44,,103247,19301,FAD
45,,DOUB,C4,O4,no,N,45,,103247,19301,FAD
46,,SING,C4,C4X,no,N,46,,103247,19301,FAD
47,,DOUB,C4X,N5,no,N,47,,103247,19301,FAD
48,,SING,C4X,C10,no,N,48,,103247,19301,FAD
49,,SING,N5,C5X,no,N,49,,103247,19301,FAD
50,,DOUB,C5X,C6,yes,N,50,,103247,19301,FAD
51,,SING,C5X,C9A,yes,N,51,,103247,19301,FAD
52,,SING,C6,C7,yes,N,52,,103247,19301,FAD
53,,SING,C6,H6,no,N,53,,103247,19301,FAD
54,,SING,C7,C7M,no,N,54,,103247,19301,FAD
55,,DOUB,C7,C8,yes,N,55,,103247,19301,FAD
56,,SING,C7M,HM71,no,N,56,,103247,19301,FAD
57,,SING,C7M,HM72,no,N,57,,103247,19301,FAD
58,,SING,C7M,HM73,no,N,58,,103247,19301,FAD
59,,SING,C8,C8M,no,N,59,,103247,19301,FAD
60,,SING,C8,C9,yes,N,60,,103247,19301,FAD
61,,SING,C8M,HM81,no,N,61,,103247,19301,FAD
62,,SING,C8M,HM82,no,N,62,,103247,19301,FAD
63,,SING,C8M,HM83,no,N,63,,103247,19301,FAD
64,,DOUB,C9,C9A,yes,N,64,,103247,19301,FAD
65,,SING,C9,H9,no,N,65,,103247,19301,FAD
66,,SING,C9A,N10,no,N,66,,103247,19301,FAD
67,,SING,N10,C10,no,N,67,,103247,19301,FAD
68,,SING,N10,C1',no,N,68,,103247,19301,FAD
69,,SING,C1',C2',no,N,69,,103247,19301,FAD
70,,SING,C1',H1'1,no,N,70,,103247,19301,FAD
71,,SING,C1',H1'2,no,N,71,,103247,19301,FAD
72,,SING,C2',O2',no,N,72,,103247,19301,FAD
73,,SING,C2',C3',no,N,73,,103247,19301,FAD
74,,SING,C2',H2',no,N,74,,103247,19301,FAD
75,,SING,O2',HO2',no,N,75,,103247,19301,FAD
76,,SING,C3',O3',no,N,76,,103247,19301,FAD
77,,SING,C3',C4',no,N,77,,103247,19301,FAD
78,,SING,C3',H3',no,N,78,,103247,19301,FAD
79,,SING,O3',HO3',no,N,79,,103247,19301,FAD
80,,SING,C4',O4',no,N,80,,103247,19301,FAD
81,,SING,C4',C5',no,N,81,,103247,19301,FAD
82,,SING,C4',H4',no,N,82,,103247,19301,FAD
83,,SING,O4',HO4',no,N,83,,103247,19301,FAD
84,,SING,C5',O5',no,N,84,,103247,19301,FAD
85,,SING,C5',H5'1,no,N,85,,103247,19301,FAD
86,,SING,C5',H5'2,no,N,86,,103247,19301,FAD
87,,SING,O5',P,no,N,87,,103247,19301,FAD
88,,DOUB,P,O1P,no,N,88,,103247,19301,FAD
89,,SING,P,O2P,no,N,89,,103247,19301,FAD
90,,SING,P,O3P,no,N,90,,103247,19301,FAD
91,,SING,O2P,HOP2,no,N,91,,103247,19301,FAD
1,,DOUB,C,O1,no,N,1,,103321,19305,BEZ
2,,SING,C,O2,no,N,2,,103321,19305,BEZ
3,,SING,C,C1,no,N,3,,103321,19305,BEZ
4,,SING,O2,HO2,no,N,4,,103321,19305,BEZ
5,,DOUB,C1,C2,yes,N,5,,103321,19305,BEZ
6,,SING,C1,C6,yes,N,6,,103321,19305,BEZ
7,,SING,C2,C3,yes,N,7,,103321,19305,BEZ
8,,SING,C2,H2,no,N,8,,103321,19305,BEZ
9,,DOUB,C3,C4,yes,N,9,,103321,19305,BEZ
10,,SING,C3,H3,no,N,10,,103321,19305,BEZ
11,,SING,C4,C5,yes,N,11,,103321,19305,BEZ
12,,SING,C4,H4,no,N,12,,103321,19305,BEZ
13,,DOUB,C5,C6,yes,N,13,,103321,19305,BEZ
14,,SING,C5,H5,no,N,14,,103321,19305,BEZ
15,,SING,C6,H6,no,N,15,,103321,19305,BEZ
1,,SING,N,CA,no,N,1,,103322,19305,NLE
2,,SING,N,H,no,N,2,,103322,19305,NLE
3,,SING,N,HN2,no,N,3,,103322,19305,NLE
4,,SING,CA,C,no,N,4,,103322,19305,NLE
5,,SING,CA,CB,no,N,5,,103322,19305,NLE
6,,SING,CA,HA,no,N,6,,103322,19305,NLE
7,,DOUB,C,O,no,N,7,,103322,19305,NLE
8,,SING,C,OXT,no,N,8,,103322,19305,NLE
9,,SING,OXT,HXT,no,N,9,,103322,19305,NLE
10,,SING,CB,CG,no,N,10,,103322,19305,NLE
11,,SING,CB,HB2,no,N,11,,103322,19305,NLE
12,,SING,CB,HB3,no,N,12,,103322,19305,NLE
13,,SING,CG,CD,no,N,13,,103322,19305,NLE
14,,SING,CG,HG2,no,N,14,,103322,19305,NLE
15,,SING,CG,HG3,no,N,15,,103322,19305,NLE
16,,SING,CD,CE,no,N,16,,103322,19305,NLE
17,,SING,CD,HD2,no,N,17,,103322,19305,NLE
18,,SING,CD,HD3,no,N,18,,103322,19305,NLE
19,,SING,CE,HE1,no,N,19,,103322,19305,NLE
20,,SING,CE,HE2,no,N,20,,103322,19305,NLE
21,,SING,CE,HE3,no,N,21,,103322,19305,NLE
1,,SING,N,HN,no,N,1,,103323,19305,M9P
2,,SING,N,HNA,no,N,2,,103323,19305,M9P
13,,SING,C5,H52,,,,,240371,6145,TPLi
3,,SING,F1,CF,no,N,3,,103323,19305,M9P
4,,SING,F2,CF,no,N,4,,103323,19305,M9P
5,,SING,CA,N,no,N,5,,103323,19305,M9P
6,,SING,CA,HA,no,N,6,,103323,19305,M9P
7,,SING,CB,CA,no,N,7,,103323,19305,M9P
8,,SING,CB,HBA,no,N,8,,103323,19305,M9P
9,,SING,CD,NE,no,N,9,,103323,19305,M9P
10,,SING,CD,CG,no,N,10,,103323,19305,M9P
11,,SING,NE,HNE,no,N,11,,103323,19305,M9P
12,,SING,CF,F3,no,N,12,,103323,19305,M9P
13,,SING,CG,CB,no,N,13,,103323,19305,M9P
14,,SING,CG,HG,no,N,14,,103323,19305,M9P
15,,SING,CI,CA,no,N,15,,103323,19305,M9P
16,,SING,CI,CF,no,N,16,,103323,19305,M9P
17,,SING,CI,HI,no,N,17,,103323,19305,M9P
18,,SING,CZ,NE,no,N,18,,103323,19305,M9P
19,,SING,CZ,NH1,no,N,19,,103323,19305,M9P
20,,SING,NH1,HNH1,no,N,20,,103323,19305,M9P
21,,DOUB,NH2,CZ,no,N,21,,103323,19305,M9P
22,,SING,NH2,HNHB,no,N,22,,103323,19305,M9P
23,,SING,OI2,CI,no,N,23,,103323,19305,M9P
24,,SING,HNHA,NH1,no,N,24,,103323,19305,M9P
25,,SING,HNH2,NH2,no,N,25,,103323,19305,M9P
26,,SING,HB,CB,no,N,26,,103323,19305,M9P
27,,SING,HD,CD,no,N,27,,103323,19305,M9P
28,,SING,HDA,CD,no,N,28,,103323,19305,M9P
29,,SING,HGA,CG,no,N,29,,103323,19305,M9P
30,,SING,HOI2,OI2,no,N,30,,103323,19305,M9P
1,,DOUB,C,O1,no,N,1,,103341,19306,BEZ
2,,SING,C,O2,no,N,2,,103341,19306,BEZ
3,,SING,C,C1,no,N,3,,103341,19306,BEZ
4,,SING,O2,HO2,no,N,4,,103341,19306,BEZ
5,,DOUB,C1,C2,yes,N,5,,103341,19306,BEZ
6,,SING,C1,C6,yes,N,6,,103341,19306,BEZ
7,,SING,C2,C3,yes,N,7,,103341,19306,BEZ
8,,SING,C2,H2,no,N,8,,103341,19306,BEZ
9,,DOUB,C3,C4,yes,N,9,,103341,19306,BEZ
10,,SING,C3,H3,no,N,10,,103341,19306,BEZ
11,,SING,C4,C5,yes,N,11,,103341,19306,BEZ
12,,SING,C4,H4,no,N,12,,103341,19306,BEZ
13,,DOUB,C5,C6,yes,N,13,,103341,19306,BEZ
14,,SING,C5,H5,no,N,14,,103341,19306,BEZ
15,,SING,C6,H6,no,N,15,,103341,19306,BEZ
1,,SING,N,CA,no,N,1,,103342,19306,NLE
2,,SING,N,H,no,N,2,,103342,19306,NLE
3,,SING,N,HN2,no,N,3,,103342,19306,NLE
4,,SING,CA,C,no,N,4,,103342,19306,NLE
5,,SING,CA,CB,no,N,5,,103342,19306,NLE
6,,SING,CA,HA,no,N,6,,103342,19306,NLE
7,,DOUB,C,O,no,N,7,,103342,19306,NLE
8,,SING,C,OXT,no,N,8,,103342,19306,NLE
9,,SING,OXT,HXT,no,N,9,,103342,19306,NLE
10,,SING,CB,CG,no,N,10,,103342,19306,NLE
11,,SING,CB,HB2,no,N,11,,103342,19306,NLE
12,,SING,CB,HB3,no,N,12,,103342,19306,NLE
13,,SING,CG,CD,no,N,13,,103342,19306,NLE
14,,SING,CG,HG2,no,N,14,,103342,19306,NLE
15,,SING,CG,HG3,no,N,15,,103342,19306,NLE
16,,SING,CD,CE,no,N,16,,103342,19306,NLE
17,,SING,CD,HD2,no,N,17,,103342,19306,NLE
18,,SING,CD,HD3,no,N,18,,103342,19306,NLE
19,,SING,CE,HE1,no,N,19,,103342,19306,NLE
20,,SING,CE,HE2,no,N,20,,103342,19306,NLE
21,,SING,CE,HE3,no,N,21,,103342,19306,NLE
1,,SING,N,HN,no,N,1,,103343,19306,M9P
2,,SING,N,HNA,no,N,2,,103343,19306,M9P
3,,SING,F1,CF,no,N,3,,103343,19306,M9P
4,,SING,F2,CF,no,N,4,,103343,19306,M9P
5,,SING,CA,N,no,N,5,,103343,19306,M9P
6,,SING,CA,HA,no,N,6,,103343,19306,M9P
7,,SING,CB,CA,no,N,7,,103343,19306,M9P
8,,SING,CB,HBA,no,N,8,,103343,19306,M9P
9,,SING,CD,NE,no,N,9,,103343,19306,M9P
10,,SING,CD,CG,no,N,10,,103343,19306,M9P
11,,SING,NE,HNE,no,N,11,,103343,19306,M9P
12,,SING,CF,F3,no,N,12,,103343,19306,M9P
13,,SING,CG,CB,no,N,13,,103343,19306,M9P
14,,SING,CG,HG,no,N,14,,103343,19306,M9P
15,,SING,CI,CA,no,N,15,,103343,19306,M9P
16,,SING,CI,CF,no,N,16,,103343,19306,M9P
17,,SING,CI,HI,no,N,17,,103343,19306,M9P
18,,SING,CZ,NE,no,N,18,,103343,19306,M9P
19,,SING,CZ,NH1,no,N,19,,103343,19306,M9P
20,,SING,NH1,HNH1,no,N,20,,103343,19306,M9P
21,,DOUB,NH2,CZ,no,N,21,,103343,19306,M9P
22,,SING,NH2,HNHB,no,N,22,,103343,19306,M9P
23,,SING,OI2,CI,no,N,23,,103343,19306,M9P
24,,SING,HNHA,NH1,no,N,24,,103343,19306,M9P
25,,SING,HNH2,NH2,no,N,25,,103343,19306,M9P
26,,SING,HB,CB,no,N,26,,103343,19306,M9P
27,,SING,HD,CD,no,N,27,,103343,19306,M9P
28,,SING,HDA,CD,no,N,28,,103343,19306,M9P
29,,SING,HGA,CG,no,N,29,,103343,19306,M9P
30,,SING,HOI2,OI2,no,N,30,,103343,19306,M9P
1,,SING,C5,O,yes,N,1,,103395,19309,EVG
2,,SING,C2,O,yes,N,2,,103395,19309,EVG
3,,SING,C2,S,no,N,3,,103395,19309,EVG
4,,DOUB,O2,S,no,N,4,,103395,19309,EVG
5,,DOUB,S,O1,no,N,5,,103395,19309,EVG
6,,SING,S,NH,no,N,6,,103395,19309,EVG
7,,DOUB,C3,C2,yes,N,7,,103395,19309,EVG
8,,SING,C4,C3,yes,N,8,,103395,19309,EVG
9,,SING,C3,H3,no,N,9,,103395,19309,EVG
10,,DOUB,C4,C5,yes,N,10,,103395,19309,EVG
11,,SING,C4,H4,no,N,11,,103395,19309,EVG
12,,SING,C5,H5,no,N,12,,103395,19309,EVG
13,,SING,NH,HNH,no,N,13,,103395,19309,EVG
14,,SING,NH,HNHA,no,N,14,,103395,19309,EVG
1,,SING,O1,C,no,N,1,,104138,19355,ILM
2,,DOUB,C,O,no,N,2,,104138,19355,ILM
3,,SING,C,CA,no,N,3,,104138,19355,ILM
4,,SING,H2,N,no,N,4,,104138,19355,ILM
5,,SING,CA,N,no,N,5,,104138,19355,ILM
6,,SING,N,H,no,N,6,,104138,19355,ILM
7,,SING,CE1,O1,no,N,7,,104138,19355,ILM
8,,SING,CB,CA,no,N,8,,104138,19355,ILM
9,,SING,CA,HA,no,N,9,,104138,19355,ILM
10,,SING,HB,CB,no,N,10,,104138,19355,ILM
11,,SING,CG2,CB,no,N,11,,104138,19355,ILM
12,,SING,CB,CG1,no,N,12,,104138,19355,ILM
13,,SING,HD1,CD1,no,N,13,,104138,19355,ILM
14,,SING,CD1,HD1B,no,N,14,,104138,19355,ILM
15,,SING,CD1,CG1,no,N,15,,104138,19355,ILM
16,,SING,CD1,HD1A,no,N,16,,104138,19355,ILM
17,,SING,HE1A,CE1,no,N,17,,104138,19355,ILM
18,,SING,CE1,HE1B,no,N,18,,104138,19355,ILM
19,,SING,CE1,HE1,no,N,19,,104138,19355,ILM
20,,SING,CG1,HG1A,no,N,20,,104138,19355,ILM
21,,SING,CG1,HG1,no,N,21,,104138,19355,ILM
22,,SING,HG2,CG2,no,N,22,,104138,19355,ILM
23,,SING,CG2,HG2A,no,N,23,,104138,19355,ILM
24,,SING,CG2,HG2B,no,N,24,,104138,19355,ILM
1,,SING,N14,C14,no,N,1,,104474,19375,IQG
2,,DOUB,C14,N15,yes,N,2,,104474,19375,IQG
3,,SING,C14,N13,yes,N,3,,104474,19375,IQG
4,,SING,C13,N13,no,N,4,,104474,19375,IQG
5,,SING,O3',C3',no,N,5,,104474,19375,IQG
6,,SING,N15,C16,yes,N,6,,104474,19375,IQG
7,,DOUB,OP1,P,no,N,7,,104474,19375,IQG
8,,SING,N13,C12,yes,N,8,,104474,19375,IQG
9,,SING,C3',C4',no,N,9,,104474,19375,IQG
10,,SING,C3',C2',no,N,10,,104474,19375,IQG
11,,SING,C5',C4',no,N,11,,104474,19375,IQG
12,,SING,C5',O5',no,N,12,,104474,19375,IQG
13,,SING,C4',O4',no,N,13,,104474,19375,IQG
14,,SING,O5',P,no,N,14,,104474,19375,IQG
15,,SING,C16,C12,yes,N,15,,104474,19375,IQG
16,,DOUB,C16,C17,yes,N,16,,104474,19375,IQG
17,,SING,P,OP2,no,N,17,,104474,19375,IQG
18,,DOUB,C12,C11,yes,N,18,,104474,19375,IQG
19,,SING,C2',C1',no,N,19,,104474,19375,IQG
20,,SING,C18,C17,yes,N,20,,104474,19375,IQG
21,,DOUB,C18,C19,yes,N,21,,104474,19375,IQG
22,,SING,O4',C1',no,N,22,,104474,19375,IQG
23,,SING,C17,C22,yes,N,23,,104474,19375,IQG
24,,SING,C11,C23,yes,N,24,,104474,19375,IQG
25,,SING,C1',N9,no,N,25,,104474,19375,IQG
26,,SING,C19,C20,yes,N,26,,104474,19375,IQG
27,,DOUB,C22,C23,yes,N,27,,104474,19375,IQG
28,,SING,C22,N21,yes,N,28,,104474,19375,IQG
29,,SING,C23,N2,no,N,29,,104474,19375,IQG
30,,SING,N9,C4,yes,N,30,,104474,19375,IQG
31,,SING,N9,C8,yes,N,31,,104474,19375,IQG
32,,SING,N3,C4,no,N,32,,104474,19375,IQG
33,,DOUB,N3,C2,no,N,33,,104474,19375,IQG
34,,DOUB,C20,N21,yes,N,34,,104474,19375,IQG
35,,DOUB,C4,C5,yes,N,35,,104474,19375,IQG
36,,SING,N2,C2,no,N,36,,104474,19375,IQG
37,,DOUB,C8,N7,yes,N,37,,104474,19375,IQG
38,,SING,C2,N1,no,N,38,,104474,19375,IQG
39,,SING,C5,N7,yes,N,39,,104474,19375,IQG
40,,SING,C5,C6,no,N,40,,104474,19375,IQG
41,,SING,N1,C6,no,N,41,,104474,19375,IQG
42,,DOUB,C6,O6,no,N,42,,104474,19375,IQG
43,,SING,OP2,HO2',no,N,43,,104474,19375,IQG
44,,SING,C5',H5'2,no,N,44,,104474,19375,IQG
45,,SING,C5',H5'1,no,N,45,,104474,19375,IQG
46,,SING,C4',H4',no,N,46,,104474,19375,IQG
47,,SING,C1',H1',no,N,47,,104474,19375,IQG
48,,SING,C8,H8,no,N,48,,104474,19375,IQG
49,,SING,N1,H1,no,N,49,,104474,19375,IQG
50,,SING,N2,H2,no,N,50,,104474,19375,IQG
51,,SING,C20,H20,no,N,51,,104474,19375,IQG
52,,SING,C19,H19,no,N,52,,104474,19375,IQG
53,,SING,C18,H18,no,N,53,,104474,19375,IQG
54,,SING,N14,H14,no,N,54,,104474,19375,IQG
55,,SING,N14,H14',no,N,55,,104474,19375,IQG
56,,SING,C13,H13,no,N,56,,104474,19375,IQG
57,,SING,C13,H13',no,N,57,,104474,19375,IQG
58,,SING,C13,H12,no,N,58,,104474,19375,IQG
59,,SING,C11,H11,no,N,59,,104474,19375,IQG
60,,SING,C3',H3',no,N,60,,104474,19375,IQG
61,,SING,C2',H2'1,no,N,61,,104474,19375,IQG
62,,SING,C2',H2'2,no,N,62,,104474,19375,IQG
63,,SING,O3',H3,no,N,63,,104474,19375,IQG
64,,SING,P,OP3,no,N,64,,104474,19375,IQG
65,,SING,OP3,HO3',no,N,65,,104474,19375,IQG
1,,SING,OP3,P,no,N,1,,104575,19381,0G
2,,SING,OP3,HOP3,no,N,2,,104575,19381,0G
3,,DOUB,P,OP1,no,N,3,,104575,19381,0G
4,,SING,P,OP2,no,N,4,,104575,19381,0G
5,,SING,P,O5',no,N,5,,104575,19381,0G
6,,SING,OP2,HOP2,no,N,6,,104575,19381,0G
7,,SING,O5',C5',no,N,7,,104575,19381,0G
8,,SING,C5',C4',no,N,8,,104575,19381,0G
9,,SING,C5',H5',no,N,9,,104575,19381,0G
10,,SING,C5',H5'',no,N,10,,104575,19381,0G
11,,SING,C4',O4',no,N,11,,104575,19381,0G
12,,SING,C4',C3',no,N,12,,104575,19381,0G
13,,SING,C4',H4',no,N,13,,104575,19381,0G
14,,SING,O4',C1',no,N,14,,104575,19381,0G
15,,SING,C3',O3',no,N,15,,104575,19381,0G
16,,SING,C3',C2',no,N,16,,104575,19381,0G
17,,SING,C3',H3',no,N,17,,104575,19381,0G
18,,SING,O3',HO3',no,N,18,,104575,19381,0G
19,,SING,C2',O2',no,N,19,,104575,19381,0G
20,,SING,C2',C1',no,N,20,,104575,19381,0G
21,,SING,C2',H2',no,N,21,,104575,19381,0G
22,,SING,O2',HO2',no,N,22,,104575,19381,0G
23,,SING,C1',N9,no,N,23,,104575,19381,0G
24,,SING,C1',H1',no,N,24,,104575,19381,0G
25,,SING,N9,C8,yes,N,25,,104575,19381,0G
26,,SING,N9,C4,yes,N,26,,104575,19381,0G
27,,DOUB,C8,N7,yes,N,27,,104575,19381,0G
28,,SING,C8,H8,no,N,28,,104575,19381,0G
29,,SING,N7,C5,yes,N,29,,104575,19381,0G
30,,DOUB,C6,O6,no,N,30,,104575,19381,0G
31,,SING,C6,C5,no,N,31,,104575,19381,0G
32,,SING,C6,N1,no,N,32,,104575,19381,0G
33,,DOUB,C5,C4,yes,N,33,,104575,19381,0G
34,,SING,N1,C2,no,N,34,,104575,19381,0G
35,,SING,N1,H1,no,N,35,,104575,19381,0G
36,,SING,C2,N2,no,N,36,,104575,19381,0G
37,,DOUB,C2,N3,no,N,37,,104575,19381,0G
38,,SING,N2,H21,no,N,38,,104575,19381,0G
39,,SING,N2,H22,no,N,39,,104575,19381,0G
40,,SING,N3,C4,no,N,40,,104575,19381,0G
1,,SING,N,CA,no,N,1,,104630,19384,PCA
2,,SING,N,CD,no,N,2,,104630,19384,PCA
3,,SING,N,H,no,N,3,,104630,19384,PCA
4,,SING,CA,CB,no,N,4,,104630,19384,PCA
5,,SING,CA,C,no,N,5,,104630,19384,PCA
6,,SING,CA,HA,no,N,6,,104630,19384,PCA
7,,SING,CB,CG,no,N,7,,104630,19384,PCA
8,,SING,CB,HB2,no,N,8,,104630,19384,PCA
9,,SING,CB,HB3,no,N,9,,104630,19384,PCA
10,,SING,CG,CD,no,N,10,,104630,19384,PCA
11,,SING,CG,HG2,no,N,11,,104630,19384,PCA
12,,SING,CG,HG3,no,N,12,,104630,19384,PCA
13,,DOUB,CD,OE,no,N,13,,104630,19384,PCA
14,,DOUB,C,O,no,N,14,,104630,19384,PCA
15,,SING,C,OXT,no,N,15,,104630,19384,PCA
16,,SING,OXT,HXT,no,N,16,,104630,19384,PCA
1,,SING,N,CA,no,N,1,,104631,19384,HYP
2,,SING,N,CD,no,N,2,,104631,19384,HYP
3,,SING,N,H,no,N,3,,104631,19384,HYP
4,,SING,CA,C,no,N,4,,104631,19384,HYP
5,,SING,CA,CB,no,N,5,,104631,19384,HYP
6,,SING,CA,HA,no,N,6,,104631,19384,HYP
7,,DOUB,C,O,no,N,7,,104631,19384,HYP
8,,SING,C,OXT,no,N,8,,104631,19384,HYP
9,,SING,CB,CG,no,N,9,,104631,19384,HYP
10,,SING,CB,HB2,no,N,10,,104631,19384,HYP
11,,SING,CB,HB3,no,N,11,,104631,19384,HYP
12,,SING,CG,CD,no,N,12,,104631,19384,HYP
13,,SING,CG,OD1,no,N,13,,104631,19384,HYP
14,,SING,CG,HG,no,N,14,,104631,19384,HYP
15,,SING,CD,HD22,no,N,15,,104631,19384,HYP
16,,SING,CD,HD23,no,N,16,,104631,19384,HYP
17,,SING,OD1,HD1,no,N,17,,104631,19384,HYP
18,,SING,OXT,HXT,no,N,18,,104631,19384,HYP
1,,SING,N,HN1,no,N,1,,104632,19384,NH2
2,,SING,N,HN2,no,N,2,,104632,19384,NH2
1,,SING,N,CA,no,N,1,,104651,19385,PCA
2,,SING,N,CD,no,N,2,,104651,19385,PCA
3,,SING,N,H,no,N,3,,104651,19385,PCA
4,,SING,CA,CB,no,N,4,,104651,19385,PCA
5,,SING,CA,C,no,N,5,,104651,19385,PCA
6,,SING,CA,HA,no,N,6,,104651,19385,PCA
7,,SING,CB,CG,no,N,7,,104651,19385,PCA
8,,SING,CB,HB2,no,N,8,,104651,19385,PCA
9,,SING,CB,HB3,no,N,9,,104651,19385,PCA
10,,SING,CG,CD,no,N,10,,104651,19385,PCA
11,,SING,CG,HG2,no,N,11,,104651,19385,PCA
12,,SING,CG,HG3,no,N,12,,104651,19385,PCA
13,,DOUB,CD,OE,no,N,13,,104651,19385,PCA
14,,DOUB,C,O,no,N,14,,104651,19385,PCA
15,,SING,C,OXT,no,N,15,,104651,19385,PCA
16,,SING,OXT,HXT,no,N,16,,104651,19385,PCA
1,,SING,N,CA,no,N,1,,104652,19385,HYP
2,,SING,N,CD,no,N,2,,104652,19385,HYP
3,,SING,N,H,no,N,3,,104652,19385,HYP
4,,SING,CA,C,no,N,4,,104652,19385,HYP
5,,SING,CA,CB,no,N,5,,104652,19385,HYP
6,,SING,CA,HA,no,N,6,,104652,19385,HYP
7,,DOUB,C,O,no,N,7,,104652,19385,HYP
8,,SING,C,OXT,no,N,8,,104652,19385,HYP
9,,SING,CB,CG,no,N,9,,104652,19385,HYP
10,,SING,CB,HB2,no,N,10,,104652,19385,HYP
11,,SING,CB,HB3,no,N,11,,104652,19385,HYP
12,,SING,CG,CD,no,N,12,,104652,19385,HYP
13,,SING,CG,OD1,no,N,13,,104652,19385,HYP
14,,SING,CG,HG,no,N,14,,104652,19385,HYP
15,,SING,CD,HD22,no,N,15,,104652,19385,HYP
16,,SING,CD,HD23,no,N,16,,104652,19385,HYP
17,,SING,OD1,HD1,no,N,17,,104652,19385,HYP
18,,SING,OXT,HXT,no,N,18,,104652,19385,HYP
1,,SING,N,HN1,no,N,1,,104653,19385,NH2
2,,SING,N,HN2,no,N,2,,104653,19385,NH2
1,,SING,N10,C20,no,N,1,,104689,19387,L2H
2,,DOUB,O5,C21,no,N,2,,104689,19387,L2H
3,,SING,C23,O6,yes,N,3,,104689,19387,L2H
4,,DOUB,C23,C22,yes,N,4,,104689,19387,L2H
5,,SING,C20,C19,no,N,5,,104689,19387,L2H
6,,SING,C21,C22,no,N,6,,104689,19387,L2H
7,,SING,C21,N5,no,N,7,,104689,19387,L2H
8,,SING,O6,C24,yes,N,8,,104689,19387,L2H
9,,SING,C22,N6,yes,N,9,,104689,19387,L2H
10,,SING,C19,C18,no,N,10,,104689,19387,L2H
11,,SING,O4,C15,yes,N,11,,104689,19387,L2H
12,,SING,O4,C14,yes,N,12,,104689,19387,L2H
13,,SING,C16,C15,no,N,13,,104689,19387,L2H
14,,SING,C16,N5,no,N,14,,104689,19387,L2H
15,,SING,C16,C17,no,N,15,,104689,19387,L2H
16,,DOUB,C15,N4,yes,N,16,,104689,19387,L2H
17,,DOUB,C24,N6,yes,N,17,,104689,19387,L2H
18,,SING,C24,C25,no,N,18,,104689,19387,L2H
19,,DOUB,C14,C13,yes,N,19,,104689,19387,L2H
20,,SING,N4,C13,yes,N,20,,104689,19387,L2H
21,,SING,C27,C26,no,N,21,,104689,19387,L2H
22,,SING,C13,C12,no,N,22,,104689,19387,L2H
23,,SING,C18,C17,no,N,23,,104689,19387,L2H
24,,DOUB,C25,C26,yes,N,24,,104689,19387,L2H
25,,SING,C25,N7,yes,N,25,,104689,19387,L2H
26,,SING,C26,O7,yes,N,26,,104689,19387,L2H
27,,SING,C12,O3,yes,N,27,,104689,19387,L2H
28,,DOUB,C12,N3,yes,N,28,,104689,19387,L2H
29,,DOUB,N7,C28,yes,N,29,,104689,19387,L2H
30,,SING,O3,C11,yes,N,30,,104689,19387,L2H
31,,SING,O7,C28,yes,N,31,,104689,19387,L2H
32,,SING,N3,C10,yes,N,32,,104689,19387,L2H
33,,SING,C28,C29,no,N,33,,104689,19387,L2H
34,,DOUB,C11,C10,yes,N,34,,104689,19387,L2H
35,,SING,C10,C9,no,N,35,,104689,19387,L2H
36,,SING,C29,N8,yes,N,36,,104689,19387,L2H
37,,DOUB,C29,C30,yes,N,37,,104689,19387,L2H
38,,DOUB,C9,N2,yes,N,38,,104689,19387,L2H
39,,SING,C9,O2,yes,N,39,,104689,19387,L2H
40,,SING,C31,C30,no,N,40,,104689,19387,L2H
41,,DOUB,N8,C32,yes,N,41,,104689,19387,L2H
42,,SING,N2,C7,yes,N,42,,104689,19387,L2H
43,,SING,C30,O8,yes,N,43,,104689,19387,L2H
44,,SING,O2,C8,yes,N,44,,104689,19387,L2H
45,,DOUB,C7,C8,yes,N,45,,104689,19387,L2H
46,,SING,C7,C6,no,N,46,,104689,19387,L2H
47,,SING,C32,O8,yes,N,47,,104689,19387,L2H
48,,SING,C32,C5,no,N,48,,104689,19387,L2H
49,,SING,N1,C6,no,N,49,,104689,19387,L2H
50,,SING,N1,C5,no,N,50,,104689,19387,L2H
51,,DOUB,C6,O1,no,N,51,,104689,19387,L2H
52,,SING,C5,C4,no,N,52,,104689,19387,L2H
53,,SING,C4,C3,no,N,53,,104689,19387,L2H
54,,SING,C2,C3,no,N,54,,104689,19387,L2H
55,,SING,C2,C1,no,N,55,,104689,19387,L2H
56,,SING,N9,C1,no,N,56,,104689,19387,L2H
57,,SING,C1,HB2,no,N,57,,104689,19387,L2H
58,,SING,C1,HB1,no,N,58,,104689,19387,L2H
59,,SING,C2,HC2,no,N,59,,104689,19387,L2H
60,,SING,C2,HC1,no,N,60,,104689,19387,L2H
61,,SING,C5,HF,no,N,61,,104689,19387,L2H
62,,SING,C3,HD2,no,N,62,,104689,19387,L2H
63,,SING,C3,HD1,no,N,63,,104689,19387,L2H
64,,SING,C20,HB2',no,N,64,,104689,19387,L2H
65,,SING,C20,HB1',no,N,65,,104689,19387,L2H
66,,SING,C19,HC2',no,N,66,,104689,19387,L2H
67,,SING,C19,HC1',no,N,67,,104689,19387,L2H
68,,SING,C18,HD1',no,N,68,,104689,19387,L2H
69,,SING,C18,HD2',no,N,69,,104689,19387,L2H
70,,SING,C23,HL,no,N,70,,104689,19387,L2H
71,,SING,C4,HE1,no,N,71,,104689,19387,L2H
72,,SING,C4,HE2,no,N,72,,104689,19387,L2H
73,,SING,C8,HH,no,N,73,,104689,19387,L2H
74,,SING,C17,HE1',no,N,74,,104689,19387,L2H
75,,SING,C17,HE2',no,N,75,,104689,19387,L2H
76,,SING,C31,HN3,no,N,76,,104689,19387,L2H
77,,SING,C31,HN2,no,N,77,,104689,19387,L2H
78,,SING,C31,HN1,no,N,78,,104689,19387,L2H
79,,SING,C11,HI,no,N,79,,104689,19387,L2H
80,,SING,C27,HM1,no,N,80,,104689,19387,L2H
81,,SING,C27,HM3,no,N,81,,104689,19387,L2H
82,,SING,C27,HM2,no,N,82,,104689,19387,L2H
83,,SING,C16,HF',no,N,83,,104689,19387,L2H
84,,SING,C14,HJ,no,N,84,,104689,19387,L2H
85,,SING,N9,HA1,no,N,85,,104689,19387,L2H
86,,SING,N9,HA2,no,N,86,,104689,19387,L2H
87,,SING,N10,HA3',no,N,87,,104689,19387,L2H
88,,SING,N10,HA2',no,N,88,,104689,19387,L2H
89,,SING,N5,HK,no,N,89,,104689,19387,L2H
90,,SING,N1,HG,no,N,90,,104689,19387,L2H
1,,SING,O4',C4',no,N,1,,104780,19391,5HC
2,,SING,O4',C1',no,N,2,,104780,19391,5HC
3,,SING,C4',C5',no,N,3,,104780,19391,5HC
4,,SING,C4',C3',no,N,4,,104780,19391,5HC
5,,DOUB,O2,C2,no,N,5,,104780,19391,5HC
6,,SING,C1',N1,no,N,6,,104780,19391,5HC
7,,SING,C1',C2',no,N,7,,104780,19391,5HC
8,,SING,C5',O5',no,N,8,,104780,19391,5HC
9,,SING,C2,N1,no,N,9,,104780,19391,5HC
10,,SING,C2,N3,no,N,10,,104780,19391,5HC
11,,SING,N1,C6,no,N,11,,104780,19391,5HC
12,,DOUB,N3,C4,no,N,12,,104780,19391,5HC
13,,SING,O5',P,no,N,13,,104780,19391,5HC
14,,SING,C2',C3',no,N,14,,104780,19391,5HC
15,,DOUB,C6,C5,no,N,15,,104780,19391,5HC
16,,SING,C3',O3',no,N,16,,104780,19391,5HC
17,,DOUB,P,OP1,no,N,17,,104780,19391,5HC
18,,SING,P,OP2,no,N,18,,104780,19391,5HC
19,,SING,C4,C5,no,N,19,,104780,19391,5HC
20,,SING,C4,N4,no,N,20,,104780,19391,5HC
21,,SING,C5,C5M,no,N,21,,104780,19391,5HC
22,,SING,C5M,O5,no,N,22,,104780,19391,5HC
23,,SING,P,OP3,no,N,23,,104780,19391,5HC
24,,SING,OP2,HOP2,no,N,24,,104780,19391,5HC
25,,SING,C5',H5',no,N,25,,104780,19391,5HC
26,,SING,C5',H5'',no,N,26,,104780,19391,5HC
27,,SING,C4',H4,no,N,27,,104780,19391,5HC
28,,SING,C3',H3',no,N,28,,104780,19391,5HC
29,,SING,O3',HO3',no,N,29,,104780,19391,5HC
30,,SING,C2',H2',no,N,30,,104780,19391,5HC
31,,SING,C2',H2'',no,N,31,,104780,19391,5HC
32,,SING,C1',H1',no,N,32,,104780,19391,5HC
33,,SING,N4,HN41,no,N,33,,104780,19391,5HC
34,,SING,N4,HN42,no,N,34,,104780,19391,5HC
35,,SING,C5M,H5M2,no,N,35,,104780,19391,5HC
36,,SING,C5M,H5M1,no,N,36,,104780,19391,5HC
37,,SING,O5,HO5,no,N,37,,104780,19391,5HC
38,,SING,C6,H6,no,N,38,,104780,19391,5HC
39,,SING,OP3,HOP3,no,N,39,,104780,19391,5HC
1,,SING,C22,C20,no,N,1,,104857,19395,LL5
2,,SING,C22,H22,no,N,2,,104857,19395,LL5
3,,SING,C22,H22A,no,N,3,,104857,19395,LL5
4,,SING,C22,H22B,no,N,4,,104857,19395,LL5
5,,SING,C20,C19,no,N,5,,104857,19395,LL5
6,,SING,C20,C21,no,N,6,,104857,19395,LL5
7,,SING,C20,H20,no,N,7,,104857,19395,LL5
8,,SING,C21,H21,no,N,8,,104857,19395,LL5
9,,SING,C21,H21A,no,N,9,,104857,19395,LL5
10,,SING,C21,H21B,no,N,10,,104857,19395,LL5
11,,SING,C7,C19,no,N,11,,104857,19395,LL5
12,,SING,N33,C19,no,N,12,,104857,19395,LL5
13,,SING,C19,H19,no,N,13,,104857,19395,LL5
14,,SING,N33,HN33,no,N,14,,104857,19395,LL5
15,,SING,N33,HN3A,no,N,15,,104857,19395,LL5
16,,DOUB,O32,C7,no,N,16,,104857,19395,LL5
17,,SING,C7,N1,no,N,17,,104857,19395,LL5
18,,SING,C6,N1,no,N,18,,104857,19395,LL5
19,,SING,N1,C2,no,N,19,,104857,19395,LL5
20,,SING,C3,C2,no,N,20,,104857,19395,LL5
21,,SING,C2,H2,no,N,21,,104857,19395,LL5
22,,SING,C2,H2A,no,N,22,,104857,19395,LL5
23,,SING,C4,C3,no,N,23,,104857,19395,LL5
24,,SING,C3,H3,no,N,24,,104857,19395,LL5
25,,SING,C3,H3A,no,N,25,,104857,19395,LL5
26,,SING,C5,C6,no,N,26,,104857,19395,LL5
27,,SING,C6,H6,no,N,27,,104857,19395,LL5
28,,SING,C6,H6A,no,N,28,,104857,19395,LL5
29,,SING,C5,C4,no,N,29,,104857,19395,LL5
30,,SING,C5,H5,no,N,30,,104857,19395,LL5
31,,SING,C5,H5A,no,N,31,,104857,19395,LL5
32,,SING,C14,C4,no,N,32,,104857,19395,LL5
33,,SING,C4,H4,no,N,33,,104857,19395,LL5
34,,SING,O26,C14,yes,N,34,,104857,19395,LL5
35,,DOUB,C14,N23,yes,N,35,,104857,19395,LL5
36,,SING,C24,N23,yes,N,36,,104857,19395,LL5
37,,SING,N25,O26,yes,N,37,,104857,19395,LL5
38,,DOUB,N25,C24,yes,N,38,,104857,19395,LL5
39,,SING,C24,C27,yes,N,39,,104857,19395,LL5
40,,SING,S28,C27,yes,N,40,,104857,19395,LL5
41,,DOUB,C27,C31,yes,N,41,,104857,19395,LL5
42,,SING,C30,C31,yes,N,42,,104857,19395,LL5
43,,SING,C31,H31,no,N,43,,104857,19395,LL5
44,,DOUB,C29,C30,yes,N,44,,104857,19395,LL5
45,,SING,C30,H30,no,N,45,,104857,19395,LL5
46,,SING,S28,C29,yes,N,46,,104857,19395,LL5
47,,SING,C29,H29,no,N,47,,104857,19395,LL5
1,,SING,OA1,C4,no,N,1,,104858,19395,ORI
2,,DOUB,C6,C7,yes,N,2,,104858,19395,ORI
3,,SING,C6,C5,yes,N,3,,104858,19395,ORI
4,,DOUB,C4,C5,yes,N,4,,104858,19395,ORI
5,,SING,C4,C3,yes,N,5,,104858,19395,ORI
6,,SING,C7,C8,yes,N,6,,104858,19395,ORI
7,,SING,C5,C10,yes,N,7,,104858,19395,ORI
8,,DOUB,C3,C2,yes,N,8,,104858,19395,ORI
9,,DOUB,C8,C9,yes,N,9,,104858,19395,ORI
10,,SING,C10,C9,yes,N,10,,104858,19395,ORI
11,,DOUB,C10,C1,yes,N,11,,104858,19395,ORI
12,,SING,C2,C1,yes,N,12,,104858,19395,ORI
13,,SING,C1,N1,no,N,13,,104858,19395,ORI
14,,DOUB,N1,N2,no,N,14,,104858,19395,ORI
15,,SING,N2,CB1,no,N,15,,104858,19395,ORI
16,,DOUB,CB1,CB2,yes,N,16,,104858,19395,ORI
17,,SING,CB1,CB6,yes,N,17,,104858,19395,ORI
18,,SING,CB2,CB3,yes,N,18,,104858,19395,ORI
19,,DOUB,CB6,CB5,yes,N,19,,104858,19395,ORI
20,,DOUB,CB3,CB4,yes,N,20,,104858,19395,ORI
21,,SING,CB5,CB4,yes,N,21,,104858,19395,ORI
22,,SING,CB4,SB,no,N,22,,104858,19395,ORI
23,,DOUB,OB4,SB,no,N,23,,104858,19395,ORI
24,,DOUB,SB,OB2,no,N,24,,104858,19395,ORI
25,,SING,SB,OB3,no,N,25,,104858,19395,ORI
26,,SING,CB5,H1,no,N,26,,104858,19395,ORI
27,,SING,CB6,H2,no,N,27,,104858,19395,ORI
28,,SING,CB3,H3,no,N,28,,104858,19395,ORI
29,,SING,CB2,H4,no,N,29,,104858,19395,ORI
30,,SING,C2,H5,no,N,30,,104858,19395,ORI
31,,SING,C3,H6,no,N,31,,104858,19395,ORI
32,,SING,OA1,H7,no,N,32,,104858,19395,ORI
33,,SING,C6,H8,no,N,33,,104858,19395,ORI
34,,SING,C7,H9,no,N,34,,104858,19395,ORI
35,,SING,C8,H10,no,N,35,,104858,19395,ORI
36,,SING,C9,H11,no,N,36,,104858,19395,ORI
37,,SING,OB3,H12,no,N,37,,104858,19395,ORI
1,,DOUB,P,OP1,no,N,1,,104983,19402,BGM
2,,SING,P,OP2,no,N,2,,104983,19402,BGM
3,,SING,P,O5',no,N,3,,104983,19402,BGM
4,,SING,P,OP3,no,N,4,,104983,19402,BGM
5,,SING,OP2,HOP2,no,N,5,,104983,19402,BGM
6,,SING,O5',C5',no,N,6,,104983,19402,BGM
7,,SING,C5',C4',no,N,7,,104983,19402,BGM
8,,SING,C5',H5',no,N,8,,104983,19402,BGM
9,,SING,C5',H5'',no,N,9,,104983,19402,BGM
10,,SING,C4',O4',no,N,10,,104983,19402,BGM
11,,SING,C4',C3',no,N,11,,104983,19402,BGM
12,,SING,C4',H4',no,N,12,,104983,19402,BGM
13,,SING,O4',C1',no,N,13,,104983,19402,BGM
14,,SING,C1',N9,no,N,14,,104983,19402,BGM
15,,SING,C1',C2',no,N,15,,104983,19402,BGM
16,,SING,C1',H1',no,N,16,,104983,19402,BGM
17,,SING,N9,C8,yes,N,17,,104983,19402,BGM
18,,SING,N9,C4,yes,N,18,,104983,19402,BGM
19,,DOUB,C8,N7,yes,N,19,,104983,19402,BGM
20,,SING,C8,BR,no,N,20,,104983,19402,BGM
21,,SING,N7,C5,yes,N,21,,104983,19402,BGM
22,,DOUB,C5,C4,yes,N,22,,104983,19402,BGM
23,,SING,C5,C6,no,N,23,,104983,19402,BGM
24,,SING,C4,N3,no,N,24,,104983,19402,BGM
25,,DOUB,N3,C2,no,N,25,,104983,19402,BGM
26,,SING,C2,N2,no,N,26,,104983,19402,BGM
27,,SING,C2,N1,no,N,27,,104983,19402,BGM
28,,SING,N2,H21,no,N,28,,104983,19402,BGM
29,,SING,N2,H22,no,N,29,,104983,19402,BGM
30,,SING,N1,C6,no,N,30,,104983,19402,BGM
31,,SING,N1,H1,no,N,31,,104983,19402,BGM
32,,DOUB,C6,O6,no,N,32,,104983,19402,BGM
33,,SING,C2',C3',no,N,33,,104983,19402,BGM
34,,SING,C2',H2',no,N,34,,104983,19402,BGM
35,,SING,C2',H2'',no,N,35,,104983,19402,BGM
36,,SING,C3',O3',no,N,36,,104983,19402,BGM
37,,SING,C3',H3',no,N,37,,104983,19402,BGM
38,,SING,O3',HO3',no,N,38,,104983,19402,BGM
39,,SING,OP3,HOP3,no,N,39,,104983,19402,BGM
1,,SING,NAB,NAO,no,N,1,,105190,19414,1YO
2,,SING,NAO,CAG,yes,N,2,,105190,19414,1YO
3,,SING,NAO,CAN,yes,N,3,,105190,19414,1YO
4,,SING,SAK,CAN,no,N,4,,105190,19414,1YO
5,,SING,SAK,CAH,no,N,5,,105190,19414,1YO
6,,DOUB,CAG,NAI,yes,N,6,,105190,19414,1YO
7,,SING,CAA,CAL,no,N,7,,105190,19414,1YO
8,,DOUB,CAN,NAJ,yes,N,8,,105190,19414,1YO
9,,DOUB,CAL,CAE,yes,N,9,,105190,19414,1YO
10,,SING,CAL,CAM,yes,N,10,,105190,19414,1YO
11,,SING,CAE,CAC,yes,N,11,,105190,19414,1YO
12,,SING,CAM,CAH,no,N,12,,105190,19414,1YO
13,,DOUB,CAM,CAF,yes,N,13,,105190,19414,1YO
14,,DOUB,CAC,CAD,yes,N,14,,105190,19414,1YO
15,,SING,NAI,NAJ,yes,N,15,,105190,19414,1YO
16,,SING,CAF,CAD,yes,N,16,,105190,19414,1YO
17,,SING,CAA,HAC,no,N,17,,105190,19414,1YO
18,,SING,CAA,HAA,no,N,18,,105190,19414,1YO
19,,SING,CAA,HAB,no,N,19,,105190,19414,1YO
20,,SING,CAC,HAD,no,N,20,,105190,19414,1YO
21,,SING,CAD,HAE,no,N,21,,105190,19414,1YO
22,,SING,CAE,HAF,no,N,22,,105190,19414,1YO
23,,SING,CAF,HAG,no,N,23,,105190,19414,1YO
24,,SING,CAG,HAH,no,N,24,,105190,19414,1YO
25,,SING,CAH,HAI,no,N,25,,105190,19414,1YO
26,,SING,CAH,HAJ,no,N,26,,105190,19414,1YO
27,,SING,NAB,HAL,no,N,27,,105190,19414,1YO
28,,SING,NAB,HAK,no,N,28,,105190,19414,1YO
1,,SING,N,CA,no,N,1,,105300,19421,BB9
2,,SING,CA,C,no,N,2,,105300,19421,BB9
3,,DOUB,CA,CB,no,N,3,,105300,19421,BB9
4,,DOUB,C,O,no,N,4,,105300,19421,BB9
5,,SING,C,OXT,no,Z,5,,105300,19421,BB9
6,,SING,CB,SG,no,N,6,,105300,19421,BB9
7,,SING,N,HN1,no,N,7,,105300,19421,BB9
8,,SING,N,HN2,no,N,8,,105300,19421,BB9
9,,SING,CB,HB,no,N,9,,105300,19421,BB9
10,,SING,OXT,HXT,no,N,10,,105300,19421,BB9
11,,SING,SG,HG,no,N,11,,105300,19421,BB9
1,,SING,N,CA,no,N,1,,105301,19421,DHA
2,,SING,N,H,no,N,2,,105301,19421,DHA
3,,SING,N,H2,no,N,3,,105301,19421,DHA
4,,DOUB,CA,CB,no,N,4,,105301,19421,DHA
5,,SING,CA,C,no,N,5,,105301,19421,DHA
6,,SING,CB,HB1,no,N,6,,105301,19421,DHA
7,,SING,CB,HB2,no,N,7,,105301,19421,DHA
8,,DOUB,C,O,no,N,8,,105301,19421,DHA
9,,SING,C,OXT,no,N,9,,105301,19421,DHA
10,,SING,OXT,HXT,no,N,10,,105301,19421,DHA
1,,SING,N,HN1,no,N,1,,105302,19421,NH2
2,,SING,N,HN2,no,N,2,,105302,19421,NH2
1,,SING,C6,CB,no,N,1,,105303,19421,MOZ
2,,SING,OG,CB,no,N,2,,105303,19421,MOZ
3,,DOUB,CB,CA,no,Z,3,,105303,19421,MOZ
4,,SING,CA,N,no,N,4,,105303,19421,MOZ
5,,SING,CA,C,no,N,5,,105303,19421,MOZ
6,,DOUB,O,C,no,N,6,,105303,19421,MOZ
7,,SING,C,OXT,no,N,7,,105303,19421,MOZ
8,,SING,N,H,no,N,8,,105303,19421,MOZ
9,,SING,N,H2,no,N,9,,105303,19421,MOZ
10,,SING,OG,H3,no,N,10,,105303,19421,MOZ
11,,SING,C6,H62,no,N,11,,105303,19421,MOZ
12,,SING,C6,H63,no,N,12,,105303,19421,MOZ
13,,SING,C6,H61,no,N,13,,105303,19421,MOZ
14,,SING,OXT,HXT,no,N,14,,105303,19421,MOZ
1,,SING,C16,C17,no,N,1,,105304,19421,MH7
2,,SING,C16,C15,no,N,2,,105304,19421,MH7
3,,SING,C14,C15,no,N,3,,105304,19421,MH7
4,,SING,C14,N12,no,N,4,,105304,19421,MH7
5,,SING,N12,C13,no,N,5,,105304,19421,MH7
6,,SING,N12,C10,no,N,6,,105304,19421,MH7
7,,DOUB,O11,C10,no,N,7,,105304,19421,MH7
8,,SING,C10,C09,no,N,8,,105304,19421,MH7
9,,SING,C26,C25,no,N,9,,105304,19421,MH7
10,,SING,C26,C20,no,N,10,,105304,19421,MH7
11,,DOUB,C09,C08,yes,N,11,,105304,19421,MH7
12,,SING,C09,C18,yes,N,12,,105304,19421,MH7
13,,SING,N19,C18,no,N,13,,105304,19421,MH7
14,,SING,N19,C20,no,N,14,,105304,19421,MH7
15,,SING,C08,N07,yes,N,15,,105304,19421,MH7
16,,DOUB,C18,N27,yes,N,16,,105304,19421,MH7
17,,SING,C25,C23,no,N,17,,105304,19421,MH7
18,,SING,C20,C21,no,N,18,,105304,19421,MH7
19,,DOUB,N07,C06,yes,N,19,,105304,19421,MH7
20,,SING,N27,C06,yes,N,20,,105304,19421,MH7
21,,SING,C23,O24,no,N,21,,105304,19421,MH7
22,,SING,C23,C22,no,N,22,,105304,19421,MH7
23,,SING,C06,N05,no,N,23,,105304,19421,MH7
24,,SING,C21,C22,no,N,24,,105304,19421,MH7
25,,SING,N05,C04,no,N,25,,105304,19421,MH7
26,,SING,C04,C03,no,N,26,,105304,19421,MH7
27,,SING,C03,C02,no,N,27,,105304,19421,MH7
28,,SING,C01,C02,no,N,28,,105304,19421,MH7
29,,SING,C01,H012,no,N,29,,105304,19421,MH7
30,,SING,C01,H011,no,N,30,,105304,19421,MH7
31,,SING,C01,H013,no,N,31,,105304,19421,MH7
32,,SING,C02,H021,no,N,32,,105304,19421,MH7
33,,SING,C02,H022,no,N,33,,105304,19421,MH7
34,,SING,C03,H031,no,N,34,,105304,19421,MH7
35,,SING,C03,H032,no,N,35,,105304,19421,MH7
36,,SING,C04,H041,no,N,36,,105304,19421,MH7
37,,SING,C04,H042,no,N,37,,105304,19421,MH7
38,,SING,N05,H051,no,N,38,,105304,19421,MH7
39,,SING,C08,H081,no,N,39,,105304,19421,MH7
40,,SING,C13,H133,no,N,40,,105304,19421,MH7
41,,SING,C13,H131,no,N,41,,105304,19421,MH7
42,,SING,C13,H132,no,N,42,,105304,19421,MH7
43,,SING,C14,H141,no,N,43,,105304,19421,MH7
44,,SING,C14,H142,no,N,44,,105304,19421,MH7
45,,SING,C15,H152,no,N,45,,105304,19421,MH7
46,,SING,C15,H151,no,N,46,,105304,19421,MH7
47,,SING,C16,H162,no,N,47,,105304,19421,MH7
48,,SING,C16,H161,no,N,48,,105304,19421,MH7
49,,SING,C17,H172,no,N,49,,105304,19421,MH7
50,,SING,C17,H173,no,N,50,,105304,19421,MH7
51,,SING,C17,H171,no,N,51,,105304,19421,MH7
52,,SING,N19,H191,no,N,52,,105304,19421,MH7
53,,SING,C20,H201,no,N,53,,105304,19421,MH7
54,,SING,C21,H212,no,N,54,,105304,19421,MH7
55,,SING,C21,H211,no,N,55,,105304,19421,MH7
56,,SING,C22,H221,no,N,56,,105304,19421,MH7
57,,SING,C22,H222,no,N,57,,105304,19421,MH7
58,,SING,C23,H231,no,N,58,,105304,19421,MH7
59,,SING,O24,H241,no,N,59,,105304,19421,MH7
60,,SING,C25,H251,no,N,60,,105304,19421,MH7
61,,SING,C25,H252,no,N,61,,105304,19421,MH7
62,,SING,C26,H261,no,N,62,,105304,19421,MH7
63,,SING,C26,H262,no,N,63,,105304,19421,MH7
1,,SING,N,CA,no,N,1,,105335,19422,DBU
2,,SING,N,H,no,N,2,,105335,19422,DBU
3,,SING,N,H2,no,N,3,,105335,19422,DBU
4,,DOUB,CA,CB,no,Z,4,,105335,19422,DBU
5,,SING,CA,C,no,N,5,,105335,19422,DBU
6,,SING,CB,CG,no,N,6,,105335,19422,DBU
7,,SING,CB,HB,no,N,7,,105335,19422,DBU
8,,SING,CG,HG1,no,N,8,,105335,19422,DBU
9,,SING,CG,HG2,no,N,9,,105335,19422,DBU
10,,SING,CG,HG3,no,N,10,,105335,19422,DBU
11,,DOUB,C,O,no,N,11,,105335,19422,DBU
12,,SING,C,OXT,no,N,12,,105335,19422,DBU
13,,SING,OXT,HXT,no,N,13,,105335,19422,DBU
1,,DOUB,N,CA,no,N,1,,105336,19422,MH6
2,,SING,CA,C,no,N,2,,105336,19422,MH6
3,,SING,CA,CB,no,N,3,,105336,19422,MH6
4,,DOUB,C,O,no,N,4,,105336,19422,MH6
5,,SING,C,OXT,no,N,5,,105336,19422,MH6
6,,SING,CB,OG,no,N,6,,105336,19422,MH6
7,,SING,N,H,no,N,7,,105336,19422,MH6
8,,SING,CB,HB2,no,N,8,,105336,19422,MH6
9,,SING,CB,HB3,no,N,9,,105336,19422,MH6
10,,SING,OXT,HXT,no,N,10,,105336,19422,MH6
11,,SING,OG,HG,no,N,11,,105336,19422,MH6
1,,SING,N,CA,no,N,1,,105337,19422,DHA
2,,SING,N,H,no,N,2,,105337,19422,DHA
3,,SING,N,H2,no,N,3,,105337,19422,DHA
4,,DOUB,CA,CB,no,N,4,,105337,19422,DHA
5,,SING,CA,C,no,N,5,,105337,19422,DHA
6,,SING,CB,HB1,no,N,6,,105337,19422,DHA
7,,SING,CB,HB2,no,N,7,,105337,19422,DHA
8,,DOUB,C,O,no,N,8,,105337,19422,DHA
9,,SING,C,OXT,no,N,9,,105337,19422,DHA
10,,SING,OXT,HXT,no,N,10,,105337,19422,DHA
1,,SING,N,HN1,no,N,1,,105338,19422,NH2
2,,SING,N,HN2,no,N,2,,105338,19422,NH2
1,,SING,N,CA,no,N,1,,105339,19422,3GL
2,,SING,CA,C,no,N,2,,105339,19422,3GL
3,,SING,CA,CB,no,N,3,,105339,19422,3GL
4,,DOUB,C,O,no,N,4,,105339,19422,3GL
5,,SING,CB,CG,no,N,5,,105339,19422,3GL
6,,SING,CG,OH,no,N,6,,105339,19422,3GL
7,,SING,CG,CD,no,N,7,,105339,19422,3GL
8,,SING,CD,OE1,no,N,8,,105339,19422,3GL
9,,DOUB,CD,OE2,no,N,9,,105339,19422,3GL
10,,SING,C,OXT,no,N,10,,105339,19422,3GL
11,,SING,N,HN1,no,N,11,,105339,19422,3GL
12,,SING,N,HN2,no,N,12,,105339,19422,3GL
13,,SING,CA,HA,no,N,13,,105339,19422,3GL
14,,SING,CB,HB1C,no,N,14,,105339,19422,3GL
15,,SING,CB,HB2C,no,N,15,,105339,19422,3GL
16,,SING,CG,HG,no,N,16,,105339,19422,3GL
17,,SING,OH,HH,no,N,17,,105339,19422,3GL
18,,SING,OE1,HE1,no,N,18,,105339,19422,3GL
19,,SING,OXT,HXT,no,N,19,,105339,19422,3GL
1,,DOUB,C,O,no,N,1,,105340,19422,NO1
2,,SING,C,CD1,no,N,2,,105340,19422,NO1
3,,SING,CB,CG,no,N,3,,105340,19422,NO1
4,,DOUB,CG,CD1,yes,N,4,,105340,19422,NO1
5,,SING,CG,CD2,yes,N,5,,105340,19422,NO1
6,,SING,CD1,NE1,yes,N,6,,105340,19422,NO1
7,,SING,NE1,CE2,yes,N,7,,105340,19422,NO1
8,,SING,CD2,CE2,yes,N,8,,105340,19422,NO1
9,,DOUB,CD2,CE3,yes,N,9,,105340,19422,NO1
10,,DOUB,CE2,CZ2,yes,N,10,,105340,19422,NO1
11,,SING,CE3,CZ3,yes,N,11,,105340,19422,NO1
12,,SING,CE3,CF,no,N,12,,105340,19422,NO1
13,,SING,CZ2,CH2,yes,N,13,,105340,19422,NO1
14,,DOUB,CZ3,CH2,yes,N,14,,105340,19422,NO1
15,,SING,CF,OH,no,N,15,,105340,19422,NO1
16,,SING,C,OXT,no,N,16,,105340,19422,NO1
17,,SING,CB,HB1C,no,N,17,,105340,19422,NO1
18,,SING,CB,HB2C,no,N,18,,105340,19422,NO1
19,,SING,CB,HB3C,no,N,19,,105340,19422,NO1
20,,SING,NE1,HE1,no,N,20,,105340,19422,NO1
21,,SING,CZ2,HZ2,no,N,21,,105340,19422,NO1
22,,SING,CZ3,HZ3,no,N,22,,105340,19422,NO1
23,,SING,CF,HF1C,no,N,23,,105340,19422,NO1
24,,SING,CF,HF2C,no,N,24,,105340,19422,NO1
25,,SING,CH2,HH2,no,N,25,,105340,19422,NO1
26,,SING,OH,HH,no,N,26,,105340,19422,NO1
27,,SING,OXT,HXT,no,N,27,,105340,19422,NO1
1,,SING,N,CA,no,N,1,,105341,19422,BB9
2,,SING,CA,C,no,N,2,,105341,19422,BB9
3,,DOUB,CA,CB,no,N,3,,105341,19422,BB9
4,,DOUB,C,O,no,N,4,,105341,19422,BB9
5,,SING,C,OXT,no,Z,5,,105341,19422,BB9
6,,SING,CB,SG,no,N,6,,105341,19422,BB9
7,,SING,N,HN1,no,N,7,,105341,19422,BB9
8,,SING,N,HN2,no,N,8,,105341,19422,BB9
9,,SING,CB,HB,no,N,9,,105341,19422,BB9
10,,SING,OXT,HXT,no,N,10,,105341,19422,BB9
11,,SING,SG,HG,no,N,11,,105341,19422,BB9
1,,SING,N,CA,no,N,1,,105373,19423,PTR
2,,SING,N,H,no,N,2,,105373,19423,PTR
3,,SING,N,HN2,no,N,3,,105373,19423,PTR
4,,SING,CA,C,no,N,4,,105373,19423,PTR
5,,SING,CA,CB,no,N,5,,105373,19423,PTR
6,,SING,CA,HA,no,N,6,,105373,19423,PTR
7,,DOUB,C,O,no,N,7,,105373,19423,PTR
8,,SING,C,OXT,no,N,8,,105373,19423,PTR
9,,SING,OXT,HXT,no,N,9,,105373,19423,PTR
10,,SING,CB,CG,no,N,10,,105373,19423,PTR
11,,SING,CB,HB2,no,N,11,,105373,19423,PTR
12,,SING,CB,HB3,no,N,12,,105373,19423,PTR
13,,DOUB,CG,CD1,yes,N,13,,105373,19423,PTR
14,,SING,CG,CD2,yes,N,14,,105373,19423,PTR
15,,SING,CD1,CE1,yes,N,15,,105373,19423,PTR
16,,SING,CD1,HD1,no,N,16,,105373,19423,PTR
17,,DOUB,CD2,CE2,yes,N,17,,105373,19423,PTR
18,,SING,CD2,HD2,no,N,18,,105373,19423,PTR
19,,DOUB,CE1,CZ,yes,N,19,,105373,19423,PTR
20,,SING,CE1,HE1,no,N,20,,105373,19423,PTR
21,,SING,CE2,CZ,yes,N,21,,105373,19423,PTR
22,,SING,CE2,HE2,no,N,22,,105373,19423,PTR
23,,SING,CZ,OH,no,N,23,,105373,19423,PTR
24,,SING,OH,P,no,N,24,,105373,19423,PTR
25,,DOUB,P,O1P,no,N,25,,105373,19423,PTR
26,,SING,P,O2P,no,N,26,,105373,19423,PTR
27,,SING,P,O3P,no,N,27,,105373,19423,PTR
28,,SING,O2P,HO2P,no,N,28,,105373,19423,PTR
29,,SING,O3P,HO3P,no,N,29,,105373,19423,PTR
1,,DOUB,C126,C127,yes,N,1,,105567,19435,RUL
2,,SING,C126,C125,yes,N,2,,105567,19435,RUL
3,,SING,C127,C128,yes,N,3,,105567,19435,RUL
4,,DOUB,C122,C121,yes,N,4,,105567,19435,RUL
5,,SING,C122,C123,yes,N,5,,105567,19435,RUL
6,,SING,C121,C120,yes,N,6,,105567,19435,RUL
7,,DOUB,C125,C124,yes,N,7,,105567,19435,RUL
8,,SING,C128,C123,no,N,8,,105567,19435,RUL
9,,DOUB,C128,N28,yes,N,9,,105567,19435,RUL
10,,DOUB,C120,C119,yes,N,10,,105567,19435,RUL
11,,DOUB,C123,N27,yes,N,11,,105567,19435,RUL
12,,DOUB,C110,C109,yes,N,12,,105567,19435,RUL
13,,SING,C110,C111,yes,N,13,,105567,19435,RUL
14,,SING,C109,N25,yes,N,14,,105567,19435,RUL
15,,SING,N27,C119,yes,N,15,,105567,19435,RUL
16,,SING,N27,RU4,no,N,16,,105567,19435,RUL
17,,SING,C124,N28,yes,N,17,,105567,19435,RUL
18,,DOUB,C111,C112,yes,N,18,,105567,19435,RUL
19,,SING,N28,RU4,no,N,19,,105567,19435,RUL
20,,SING,N25,RU4,no,N,20,,105567,19435,RUL
21,,DOUB,N25,C113,yes,N,21,,105567,19435,RUL
22,,SING,C112,C113,yes,N,22,,105567,19435,RUL
23,,SING,RU4,N24,no,N,23,,105567,19435,RUL
24,,SING,RU4,N26,no,N,24,,105567,19435,RUL
25,,SING,RU4,N23,no,N,25,,105567,19435,RUL
26,,SING,C113,C118,no,N,26,,105567,19435,RUL
27,,DOUB,C103,N24,yes,N,27,,105567,19435,RUL
28,,SING,C103,C104,yes,N,28,,105567,19435,RUL
29,,SING,N24,C107,yes,N,29,,105567,19435,RUL
30,,DOUB,N26,C118,yes,N,30,,105567,19435,RUL
31,,SING,N26,C114,yes,N,31,,105567,19435,RUL
32,,SING,C118,C117,yes,N,32,,105567,19435,RUL
33,,DOUB,C104,C105,yes,N,33,,105567,19435,RUL
34,,DOUB,N23,C97,yes,N,34,,105567,19435,RUL
35,,SING,N23,C101,yes,N,35,,105567,19435,RUL
36,,DOUB,C114,C115,yes,N,36,,105567,19435,RUL
37,,SING,C97,C98,yes,N,37,,105567,19435,RUL
38,,DOUB,C117,C116,yes,N,38,,105567,19435,RUL
39,,DOUB,C107,C101,yes,N,39,,105567,19435,RUL
40,,SING,C107,C106,yes,N,40,,105567,19435,RUL
41,,SING,C101,C100,yes,N,41,,105567,19435,RUL
42,,SING,C105,C106,yes,N,42,,105567,19435,RUL
43,,SING,C115,C116,yes,N,43,,105567,19435,RUL
44,,DOUB,C106,C108,yes,N,44,,105567,19435,RUL
45,,DOUB,C98,C99,yes,N,45,,105567,19435,RUL
46,,SING,C100,C99,yes,N,46,,105567,19435,RUL
47,,DOUB,C100,C102,yes,N,47,,105567,19435,RUL
48,,SING,C108,C102,yes,N,48,,105567,19435,RUL
49,,SING,C108,N18,yes,N,49,,105567,19435,RUL
50,,SING,C102,N16,yes,N,50,,105567,19435,RUL
51,,DOUB,N18,C76,yes,N,51,,105567,19435,RUL
52,,DOUB,N16,C70,yes,N,52,,105567,19435,RUL
53,,SING,C76,C70,yes,N,53,,105567,19435,RUL
54,,SING,C76,C74,yes,N,54,,105567,19435,RUL
55,,SING,C70,C68,yes,N,55,,105567,19435,RUL
56,,DOUB,C73,C74,yes,N,56,,105567,19435,RUL
57,,SING,C73,C72,yes,N,57,,105567,19435,RUL
58,,SING,C74,C75,yes,N,58,,105567,19435,RUL
59,,DOUB,C72,C71,yes,N,59,,105567,19435,RUL
60,,DOUB,C68,C67,yes,N,60,,105567,19435,RUL
61,,SING,C68,C69,yes,N,61,,105567,19435,RUL
62,,SING,C67,C66,yes,N,62,,105567,19435,RUL
63,,SING,C75,C69,yes,N,63,,105567,19435,RUL
64,,DOUB,C75,N17,yes,N,64,,105567,19435,RUL
65,,DOUB,C69,N15,yes,N,65,,105567,19435,RUL
66,,SING,C71,N17,yes,N,66,,105567,19435,RUL
67,,SING,N17,RU3,no,N,67,,105567,19435,RUL
68,,DOUB,C83,C84,yes,N,68,,105567,19435,RUL
69,,SING,C83,C82,yes,N,69,,105567,19435,RUL
70,,DOUB,C66,C65,yes,N,70,,105567,19435,RUL
71,,SING,C84,C85,yes,N,71,,105567,19435,RUL
72,,DOUB,C82,N20,yes,N,72,,105567,19435,RUL
73,,SING,N15,C65,yes,N,73,,105567,19435,RUL
74,,SING,N15,RU3,no,N,74,,105567,19435,RUL
75,,DOUB,C85,C86,yes,N,75,,105567,19435,RUL
76,,SING,N20,C86,yes,N,76,,105567,19435,RUL
77,,SING,N20,RU3,no,N,77,,105567,19435,RUL
78,,SING,C86,C81,no,N,78,,105567,19435,RUL
79,,SING,RU3,N21,no,N,79,,105567,19435,RUL
80,,SING,RU3,N19,no,N,80,,105567,19435,RUL
81,,SING,RU3,N22,no,N,81,,105567,19435,RUL
82,,DOUB,C81,C80,yes,N,82,,105567,19435,RUL
83,,SING,C81,N19,yes,N,83,,105567,19435,RUL
84,,DOUB,C87,N21,yes,N,84,,105567,19435,RUL
85,,SING,C87,C88,yes,N,85,,105567,19435,RUL
86,,SING,C80,C79,yes,N,86,,105567,19435,RUL
87,,SING,N21,C91,yes,N,87,,105567,19435,RUL
88,,DOUB,N19,C77,yes,N,88,,105567,19435,RUL
89,,DOUB,C88,C89,yes,N,89,,105567,19435,RUL
90,,DOUB,C79,C78,yes,N,90,,105567,19435,RUL
91,,DOUB,N22,C92,yes,N,91,,105567,19435,RUL
92,,SING,N22,C96,yes,N,92,,105567,19435,RUL
93,,SING,C77,C78,yes,N,93,,105567,19435,RUL
94,,SING,C91,C96,no,N,94,,105567,19435,RUL
95,,DOUB,C91,C90,yes,N,95,,105567,19435,RUL
96,,SING,C92,C93,yes,N,96,,105567,19435,RUL
97,,DOUB,C96,C95,yes,N,97,,105567,19435,RUL
98,,SING,C89,C90,yes,N,98,,105567,19435,RUL
99,,DOUB,C93,C94,yes,N,99,,105567,19435,RUL
100,,SING,C95,C94,yes,N,100,,105567,19435,RUL
101,,SING,C65,H45,no,N,101,,105567,19435,RUL
102,,SING,C66,H46,no,N,102,,105567,19435,RUL
103,,SING,C67,H47,no,N,103,,105567,19435,RUL
104,,SING,C71,H48,no,N,104,,105567,19435,RUL
105,,SING,C72,H49,no,N,105,,105567,19435,RUL
106,,SING,C73,H50,no,N,106,,105567,19435,RUL
107,,SING,C77,H51,no,N,107,,105567,19435,RUL
108,,SING,C78,H52,no,N,108,,105567,19435,RUL
109,,SING,C79,H53,no,N,109,,105567,19435,RUL
110,,SING,C80,H54,no,N,110,,105567,19435,RUL
111,,SING,C82,H55,no,N,111,,105567,19435,RUL
112,,SING,C83,H56,no,N,112,,105567,19435,RUL
113,,SING,C84,H57,no,N,113,,105567,19435,RUL
114,,SING,C85,H58,no,N,114,,105567,19435,RUL
115,,SING,C87,H59,no,N,115,,105567,19435,RUL
116,,SING,C88,H60,no,N,116,,105567,19435,RUL
117,,SING,C89,H61,no,N,117,,105567,19435,RUL
118,,SING,C90,H62,no,N,118,,105567,19435,RUL
119,,SING,C92,H63,no,N,119,,105567,19435,RUL
120,,SING,C93,H64,no,N,120,,105567,19435,RUL
121,,SING,C94,H65,no,N,121,,105567,19435,RUL
122,,SING,C95,H66,no,N,122,,105567,19435,RUL
123,,SING,C97,H67,no,N,123,,105567,19435,RUL
124,,SING,C98,H68,no,N,124,,105567,19435,RUL
125,,SING,C99,H69,no,N,125,,105567,19435,RUL
126,,SING,C103,H70,no,N,126,,105567,19435,RUL
127,,SING,C104,H71,no,N,127,,105567,19435,RUL
128,,SING,C105,H72,no,N,128,,105567,19435,RUL
129,,SING,C109,H73,no,N,129,,105567,19435,RUL
130,,SING,C110,H74,no,N,130,,105567,19435,RUL
131,,SING,C111,H75,no,N,131,,105567,19435,RUL
132,,SING,C112,H76,no,N,132,,105567,19435,RUL
133,,SING,C114,H77,no,N,133,,105567,19435,RUL
134,,SING,C115,H78,no,N,134,,105567,19435,RUL
135,,SING,C116,H79,no,N,135,,105567,19435,RUL
136,,SING,C117,H80,no,N,136,,105567,19435,RUL
137,,SING,C119,H81,no,N,137,,105567,19435,RUL
138,,SING,C120,H82,no,N,138,,105567,19435,RUL
139,,SING,C121,H83,no,N,139,,105567,19435,RUL
140,,SING,C122,H84,no,N,140,,105567,19435,RUL
141,,SING,C124,H85,no,N,141,,105567,19435,RUL
142,,SING,C125,H86,no,N,142,,105567,19435,RUL
143,,SING,C126,H87,no,N,143,,105567,19435,RUL
144,,SING,C127,H88,no,N,144,,105567,19435,RUL
1,,DOUB,C1,O1A,no,N,1,,105609,19437,DPC
2,,SING,C1,O1B,no,N,2,,105609,19437,DPC
3,,SING,C1,C2,no,N,3,,105609,19437,DPC
4,,SING,O1B,HO1,no,N,4,,105609,19437,DPC
5,,DOUB,C2,C3,no,N,5,,105609,19437,DPC
6,,SING,C2,O6,no,N,6,,105609,19437,DPC
7,,SING,C3,C4,no,N,7,,105609,19437,DPC
8,,SING,C3,H3,no,N,8,,105609,19437,DPC
9,,SING,C4,C5,no,N,9,,105609,19437,DPC
10,,SING,C4,NE,no,N,10,,105609,19437,DPC
11,,SING,C4,H4,no,N,11,,105609,19437,DPC
12,,SING,C5,N5,no,N,12,,105609,19437,DPC
13,,SING,C5,C6,no,N,13,,105609,19437,DPC
14,,SING,C5,H5,no,N,14,,105609,19437,DPC
15,,SING,N5,C10,no,N,15,,105609,19437,DPC
16,,SING,N5,HN5,no,N,16,,105609,19437,DPC
17,,DOUB,C10,O10,no,N,17,,105609,19437,DPC
18,,SING,C10,C11,no,N,18,,105609,19437,DPC
19,,SING,C11,H111,no,N,19,,105609,19437,DPC
20,,SING,C11,H112,no,N,20,,105609,19437,DPC
21,,SING,C11,H113,no,N,21,,105609,19437,DPC
22,,SING,C6,O6,no,N,22,,105609,19437,DPC
23,,SING,C6,C7,no,N,23,,105609,19437,DPC
24,,SING,C6,H6,no,N,24,,105609,19437,DPC
25,,DOUB,C7,O7,no,N,25,,105609,19437,DPC
26,,SING,C7,N8,no,N,26,,105609,19437,DPC
27,,SING,N8,C81,no,N,27,,105609,19437,DPC
28,,SING,N8,C9,no,N,28,,105609,19437,DPC
29,,SING,C81,C82,no,N,29,,105609,19437,DPC
30,,SING,C81,H811,no,N,30,,105609,19437,DPC
31,,SING,C81,H812,no,N,31,,105609,19437,DPC
32,,SING,C82,CG,no,N,32,,105609,19437,DPC
33,,SING,C82,H821,no,N,33,,105609,19437,DPC
34,,SING,C82,H822,no,N,34,,105609,19437,DPC
35,,DOUB,CG,CD1,yes,N,35,,105609,19437,DPC
36,,SING,CG,CD2,yes,N,36,,105609,19437,DPC
37,,SING,CD1,CE1,yes,N,37,,105609,19437,DPC
38,,SING,CD1,HD1,no,N,38,,105609,19437,DPC
39,,DOUB,CD2,CE2,yes,N,39,,105609,19437,DPC
40,,SING,CD2,HD2,no,N,40,,105609,19437,DPC
41,,DOUB,CE1,CZ,yes,N,41,,105609,19437,DPC
42,,SING,CE1,HE1,no,N,42,,105609,19437,DPC
43,,SING,CE2,CZ,yes,N,43,,105609,19437,DPC
44,,SING,CE2,HE2,no,N,44,,105609,19437,DPC
45,,SING,CZ,HZ,no,N,45,,105609,19437,DPC
46,,SING,C9,C91,no,N,46,,105609,19437,DPC
47,,SING,C9,H91,no,N,47,,105609,19437,DPC
48,,SING,C9,H92,no,N,48,,105609,19437,DPC
49,,SING,C91,C92,no,N,49,,105609,19437,DPC
50,,SING,C91,H911,no,N,50,,105609,19437,DPC
51,,SING,C91,H912,no,N,51,,105609,19437,DPC
52,,SING,C92,H921,no,N,52,,105609,19437,DPC
53,,SING,C92,H922,no,N,53,,105609,19437,DPC
54,,SING,C92,H923,no,N,54,,105609,19437,DPC
55,,SING,NE,HNE1,no,N,55,,105609,19437,DPC
56,,SING,NE,HNE2,no,N,56,,105609,19437,DPC
1,,SING,NI,CJ,no,N,1,,105684,19441,N4S
2,,SING,NI,CH,no,N,2,,105684,19441,N4S
3,,SING,CG,CF,no,N,3,,105684,19441,N4S
4,,SING,CG,CH,no,N,4,,105684,19441,N4S
5,,SING,CJ,CK,no,N,5,,105684,19441,N4S
6,,SING,CE,CF,no,N,6,,105684,19441,N4S
7,,SING,CE,ND,no,N,7,,105684,19441,N4S
8,,SING,CK,CL,no,N,8,,105684,19441,N4S
9,,SING,CL,NM,no,N,9,,105684,19441,N4S
10,,SING,ND,CC,no,N,10,,105684,19441,N4S
11,,SING,CC,CB,no,N,11,,105684,19441,N4S
12,,SING,CB,CA,no,N,12,,105684,19441,N4S
13,,DOUB,O2,C2,no,N,13,,105684,19441,N4S
14,,SING,N3,C2,no,N,14,,105684,19441,N4S
15,,DOUB,N3,C4,no,N,15,,105684,19441,N4S
16,,SING,N4,C4,no,N,16,,105684,19441,N4S
17,,SING,N4,CA,no,N,17,,105684,19441,N4S
18,,SING,C2,N1,no,N,18,,105684,19441,N4S
19,,SING,C4,C5,no,N,19,,105684,19441,N4S
20,,SING,C2',C1',no,N,20,,105684,19441,N4S
21,,SING,C2',C3',no,N,21,,105684,19441,N4S
22,,SING,N1,C1',no,N,22,,105684,19441,N4S
23,,SING,N1,C6,no,N,23,,105684,19441,N4S
24,,DOUB,C5,C6,no,N,24,,105684,19441,N4S
25,,SING,C1',O4',no,N,25,,105684,19441,N4S
26,,SING,O3',C3',no,N,26,,105684,19441,N4S
27,,SING,C3',C4',no,N,27,,105684,19441,N4S
28,,SING,O4',C4',no,N,28,,105684,19441,N4S
29,,SING,C4',C5',no,N,29,,105684,19441,N4S
30,,DOUB,OP2,P,no,N,30,,105684,19441,N4S
31,,SING,O5',C5',no,N,31,,105684,19441,N4S
32,,SING,O5',P,no,N,32,,105684,19441,N4S
33,,SING,P,OP1,no,N,33,,105684,19441,N4S
34,,SING,OP1,H1,no,N,34,,105684,19441,N4S
35,,SING,C5',H5'',no,N,35,,105684,19441,N4S
36,,SING,C5',H5',no,N,36,,105684,19441,N4S
37,,SING,C4',H4',no,N,37,,105684,19441,N4S
38,,SING,C3',H3',no,N,38,,105684,19441,N4S
39,,SING,O3',H3,no,N,39,,105684,19441,N4S
40,,SING,C2',H2'',no,N,40,,105684,19441,N4S
41,,SING,C2',H2',no,N,41,,105684,19441,N4S
42,,SING,C1',H1',no,N,42,,105684,19441,N4S
43,,SING,N4,H41,no,N,43,,105684,19441,N4S
44,,SING,C5,H5,no,N,44,,105684,19441,N4S
45,,SING,C6,H6,no,N,45,,105684,19441,N4S
46,,SING,CA,HA2,no,N,46,,105684,19441,N4S
47,,SING,CA,HA1,no,N,47,,105684,19441,N4S
48,,SING,CB,HB1,no,N,48,,105684,19441,N4S
49,,SING,CB,HB2,no,N,49,,105684,19441,N4S
50,,SING,CC,HC2,no,N,50,,105684,19441,N4S
51,,SING,CC,HC1,no,N,51,,105684,19441,N4S
52,,SING,CE,HE2,no,N,52,,105684,19441,N4S
53,,SING,CE,HE1,no,N,53,,105684,19441,N4S
54,,SING,CF,HF2,no,N,54,,105684,19441,N4S
55,,SING,CF,HF1,no,N,55,,105684,19441,N4S
56,,SING,CG,HG1,no,N,56,,105684,19441,N4S
57,,SING,CG,HG2,no,N,57,,105684,19441,N4S
58,,SING,CH,HH1,no,N,58,,105684,19441,N4S
59,,SING,CH,HH2,no,N,59,,105684,19441,N4S
60,,SING,CJ,HJ2,no,N,60,,105684,19441,N4S
61,,SING,CJ,HJ1,no,N,61,,105684,19441,N4S
62,,SING,CK,HK1,no,N,62,,105684,19441,N4S
63,,SING,CK,HK2,no,N,63,,105684,19441,N4S
64,,SING,CL,HL2,no,N,64,,105684,19441,N4S
65,,SING,CL,HL1,no,N,65,,105684,19441,N4S
66,,SING,ND,HD1,no,N,66,,105684,19441,N4S
67,,SING,NI,HI1,no,N,67,,105684,19441,N4S
68,,SING,NM,HM3,no,N,68,,105684,19441,N4S
69,,SING,NM,HM2,no,N,69,,105684,19441,N4S
70,,SING,P,OP3,no,N,70,,105684,19441,N4S
71,,SING,OP3,H7,no,N,71,,105684,19441,N4S
1,,DOUB,C15,C16,yes,N,1,,105805,19448,2FJ
2,,SING,C15,C14,yes,N,2,,105805,19448,2FJ
3,,SING,C16,C17,yes,N,3,,105805,19448,2FJ
4,,DOUB,C21,C20,yes,N,4,,105805,19448,2FJ
5,,SING,C21,C22,yes,N,5,,105805,19448,2FJ
6,,DOUB,C14,C13,yes,N,6,,105805,19448,2FJ
7,,SING,C20,C19,yes,N,7,,105805,19448,2FJ
8,,SING,C17,C22,no,N,8,,105805,19448,2FJ
9,,DOUB,C17,N3,yes,N,9,,105805,19448,2FJ
10,,DOUB,C22,N4,yes,N,10,,105805,19448,2FJ
11,,SING,C13,N3,yes,N,11,,105805,19448,2FJ
12,,DOUB,C19,C18,yes,N,12,,105805,19448,2FJ
13,,SING,N4,C18,yes,N,13,,105805,19448,2FJ
14,,DOUB,C1,C2,yes,N,14,,105805,19448,2FJ
15,,SING,C1,N1,yes,N,15,,105805,19448,2FJ
16,,SING,C2,C3,yes,N,16,,105805,19448,2FJ
17,,DOUB,N1,C5,yes,N,17,,105805,19448,2FJ
18,,DOUB,C3,C4,yes,N,18,,105805,19448,2FJ
19,,DOUB,C23,N5,yes,N,19,,105805,19448,2FJ
20,,SING,C23,C24,yes,N,20,,105805,19448,2FJ
21,,SING,C5,C4,yes,N,21,,105805,19448,2FJ
22,,SING,C5,C11,yes,N,22,,105805,19448,2FJ
23,,SING,N5,C27,yes,N,23,,105805,19448,2FJ
24,,SING,C4,C6,yes,N,24,,105805,19448,2FJ
25,,DOUB,C24,C25,yes,N,25,,105805,19448,2FJ
26,,DOUB,N6,C28,yes,N,26,,105805,19448,2FJ
27,,SING,N6,C32,yes,N,27,,105805,19448,2FJ
28,,SING,C27,C32,no,N,28,,105805,19448,2FJ
29,,DOUB,C27,C26,yes,N,29,,105805,19448,2FJ
30,,SING,C25,C26,yes,N,30,,105805,19448,2FJ
31,,SING,C28,C29,yes,N,31,,105805,19448,2FJ
32,,DOUB,N8,C6,yes,N,32,,105805,19448,2FJ
33,,SING,N8,C38,yes,N,33,,105805,19448,2FJ
34,,SING,C11,N2,yes,N,34,,105805,19448,2FJ
35,,DOUB,C11,C10,yes,N,35,,105805,19448,2FJ
36,,SING,C6,C12,yes,N,36,,105805,19448,2FJ
37,,DOUB,C32,C31,yes,N,37,,105805,19448,2FJ
38,,DOUB,N2,C7,yes,N,38,,105805,19448,2FJ
39,,DOUB,C35,C34,yes,N,39,,105805,19448,2FJ
40,,SING,C35,C36,yes,N,40,,105805,19448,2FJ
41,,SING,C34,C33,yes,N,41,,105805,19448,2FJ
42,,DOUB,C29,C30,yes,N,42,,105805,19448,2FJ
43,,DOUB,C38,C36,yes,N,43,,105805,19448,2FJ
44,,SING,C38,C44,yes,N,44,,105805,19448,2FJ
45,,SING,C31,C30,yes,N,45,,105805,19448,2FJ
46,,SING,C10,C12,yes,N,46,,105805,19448,2FJ
47,,SING,C10,C9,yes,N,47,,105805,19448,2FJ
48,,DOUB,C12,N10,yes,N,48,,105805,19448,2FJ
49,,SING,C36,C37,yes,N,49,,105805,19448,2FJ
50,,SING,C7,C8,yes,N,50,,105805,19448,2FJ
51,,DOUB,C56,C55,yes,N,51,,105805,19448,2FJ
52,,SING,C56,C57,yes,N,52,,105805,19448,2FJ
53,,DOUB,C33,N7,yes,N,53,,105805,19448,2FJ
54,,SING,C55,N13,yes,N,54,,105805,19448,2FJ
55,,SING,C44,N10,yes,N,55,,105805,19448,2FJ
56,,DOUB,C44,C42,yes,N,56,,105805,19448,2FJ
57,,DOUB,C9,C8,yes,N,57,,105805,19448,2FJ
58,,DOUB,C57,C58,yes,N,58,,105805,19448,2FJ
59,,SING,C37,N7,yes,N,59,,105805,19448,2FJ
60,,DOUB,C37,C43,yes,N,60,,105805,19448,2FJ
61,,SING,C42,C43,yes,N,61,,105805,19448,2FJ
62,,SING,C42,C41,yes,N,62,,105805,19448,2FJ
63,,SING,C43,N9,yes,N,63,,105805,19448,2FJ
64,,DOUB,N13,C59,yes,N,64,,105805,19448,2FJ
65,,SING,C58,C59,yes,N,65,,105805,19448,2FJ
66,,DOUB,C45,C46,yes,N,66,,105805,19448,2FJ
67,,SING,C45,N11,yes,N,67,,105805,19448,2FJ
68,,SING,C46,C47,yes,N,68,,105805,19448,2FJ
69,,DOUB,C41,C40,yes,N,69,,105805,19448,2FJ
70,,SING,C59,C64,no,N,70,,105805,19448,2FJ
71,,DOUB,N11,C49,yes,N,71,,105805,19448,2FJ
72,,DOUB,N9,C39,yes,N,72,,105805,19448,2FJ
73,,DOUB,C47,C48,yes,N,73,,105805,19448,2FJ
74,,SING,C49,C48,yes,N,74,,105805,19448,2FJ
75,,SING,C49,C54,no,N,75,,105805,19448,2FJ
76,,SING,C40,C39,yes,N,76,,105805,19448,2FJ
77,,DOUB,C54,N12,yes,N,77,,105805,19448,2FJ
78,,SING,C54,C53,yes,N,78,,105805,19448,2FJ
79,,SING,N12,C50,yes,N,79,,105805,19448,2FJ
80,,DOUB,C64,N14,yes,N,80,,105805,19448,2FJ
81,,SING,C64,C63,yes,N,81,,105805,19448,2FJ
82,,DOUB,C53,C52,yes,N,82,,105805,19448,2FJ
83,,SING,N14,C60,yes,N,83,,105805,19448,2FJ
84,,DOUB,C50,C51,yes,N,84,,105805,19448,2FJ
85,,SING,C52,C51,yes,N,85,,105805,19448,2FJ
86,,DOUB,C63,C62,yes,N,86,,105805,19448,2FJ
87,,DOUB,C60,C61,yes,N,87,,105805,19448,2FJ
88,,SING,C62,C61,yes,N,88,,105805,19448,2FJ
89,,SING,N7,RU2,no,N,89,,105805,19448,2FJ
90,,SING,N1,RU1,no,N,90,,105805,19448,2FJ
91,,SING,RU1,N5,no,N,91,,105805,19448,2FJ
92,,SING,RU1,N4,no,N,92,,105805,19448,2FJ
93,,SING,RU2,N12,no,N,93,,105805,19448,2FJ
94,,SING,RU2,N13,no,N,94,,105805,19448,2FJ
95,,SING,C1,H1,no,N,95,,105805,19448,2FJ
96,,SING,C2,H2,no,N,96,,105805,19448,2FJ
97,,SING,C3,H3,no,N,97,,105805,19448,2FJ
98,,SING,C7,H4,no,N,98,,105805,19448,2FJ
99,,SING,C8,H5,no,N,99,,105805,19448,2FJ
100,,SING,C9,H6,no,N,100,,105805,19448,2FJ
101,,SING,C13,H7,no,N,101,,105805,19448,2FJ
102,,SING,C14,H8,no,N,102,,105805,19448,2FJ
103,,SING,C15,H9,no,N,103,,105805,19448,2FJ
104,,SING,C16,H10,no,N,104,,105805,19448,2FJ
105,,SING,C19,H12,no,N,105,,105805,19448,2FJ
106,,SING,C20,H13,no,N,106,,105805,19448,2FJ
107,,SING,C21,H14,no,N,107,,105805,19448,2FJ
108,,SING,C23,H15,no,N,108,,105805,19448,2FJ
109,,SING,C24,H16,no,N,109,,105805,19448,2FJ
110,,SING,C25,H17,no,N,110,,105805,19448,2FJ
111,,SING,C26,H18,no,N,111,,105805,19448,2FJ
112,,SING,C28,H19,no,N,112,,105805,19448,2FJ
113,,SING,C29,H20,no,N,113,,105805,19448,2FJ
114,,SING,C30,H21,no,N,114,,105805,19448,2FJ
115,,SING,C31,H22,no,N,115,,105805,19448,2FJ
116,,SING,C33,H23,no,N,116,,105805,19448,2FJ
117,,SING,C34,H24,no,N,117,,105805,19448,2FJ
118,,SING,C35,H25,no,N,118,,105805,19448,2FJ
119,,SING,C39,H26,no,N,119,,105805,19448,2FJ
120,,SING,C40,H27,no,N,120,,105805,19448,2FJ
121,,SING,C41,H28,no,N,121,,105805,19448,2FJ
122,,SING,C45,H29,no,N,122,,105805,19448,2FJ
123,,SING,C46,H30,no,N,123,,105805,19448,2FJ
124,,SING,C47,H31,no,N,124,,105805,19448,2FJ
125,,SING,C48,H32,no,N,125,,105805,19448,2FJ
126,,SING,C50,H33,no,N,126,,105805,19448,2FJ
127,,SING,C51,H34,no,N,127,,105805,19448,2FJ
128,,SING,C52,H35,no,N,128,,105805,19448,2FJ
129,,SING,C53,H36,no,N,129,,105805,19448,2FJ
130,,SING,C55,H37,no,N,130,,105805,19448,2FJ
131,,SING,C56,H38,no,N,131,,105805,19448,2FJ
132,,SING,C57,H39,no,N,132,,105805,19448,2FJ
133,,SING,C58,H40,no,N,133,,105805,19448,2FJ
134,,SING,C60,H41,no,N,134,,105805,19448,2FJ
135,,SING,C61,H42,no,N,135,,105805,19448,2FJ
136,,SING,C62,H43,no,N,136,,105805,19448,2FJ
137,,SING,C63,H44,no,N,137,,105805,19448,2FJ
138,,SING,RU2,N9,no,N,138,,105805,19448,2FJ
139,,SING,RU2,N11,no,N,139,,105805,19448,2FJ
140,,SING,RU2,N14,no,N,140,,105805,19448,2FJ
141,,SING,RU1,N3,no,N,141,,105805,19448,2FJ
142,,SING,RU1,N2,no,N,142,,105805,19448,2FJ
143,,SING,RU1,N6,no,N,143,,105805,19448,2FJ
144,,SING,C18,H11,no,N,144,,105805,19448,2FJ
1,,SING,N,HN1,no,N,1,,105840,19450,NH2
2,,SING,N,HN2,no,N,2,,105840,19450,NH2
1,,SING,N,HN1,no,N,1,,105913,19454,NH2
2,,SING,N,HN2,no,N,2,,105913,19454,NH2
1,,SING,N,HN1,no,N,1,,105946,19455,NH2
2,,SING,N,HN2,no,N,2,,105946,19455,NH2
1,,SING,N,HN1,no,N,1,,105976,19456,NH2
2,,SING,N,HN2,no,N,2,,105976,19456,NH2
1,,SING,N,HN1,no,N,1,,106004,19457,NH2
2,,SING,N,HN2,no,N,2,,106004,19457,NH2
1,,DOUB,PB,O1B,no,N,1,,106936,19510,ADP
2,,SING,PB,O2B,no,N,2,,106936,19510,ADP
3,,SING,PB,O3B,no,N,3,,106936,19510,ADP
4,,SING,PB,O3A,no,N,4,,106936,19510,ADP
5,,SING,O2B,HOB2,no,N,5,,106936,19510,ADP
6,,SING,O3B,HOB3,no,N,6,,106936,19510,ADP
7,,DOUB,PA,O1A,no,N,7,,106936,19510,ADP
8,,SING,PA,O2A,no,N,8,,106936,19510,ADP
9,,SING,PA,O3A,no,N,9,,106936,19510,ADP
10,,SING,PA,O5',no,N,10,,106936,19510,ADP
11,,SING,O2A,HOA2,no,N,11,,106936,19510,ADP
12,,SING,O5',C5',no,N,12,,106936,19510,ADP
13,,SING,C5',C4',no,N,13,,106936,19510,ADP
14,,SING,C5',H5'1,no,N,14,,106936,19510,ADP
15,,SING,C5',H5'2,no,N,15,,106936,19510,ADP
16,,SING,C4',O4',no,N,16,,106936,19510,ADP
17,,SING,C4',C3',no,N,17,,106936,19510,ADP
18,,SING,C4',H4',no,N,18,,106936,19510,ADP
19,,SING,O4',C1',no,N,19,,106936,19510,ADP
20,,SING,C3',O3',no,N,20,,106936,19510,ADP
21,,SING,C3',C2',no,N,21,,106936,19510,ADP
22,,SING,C3',H3',no,N,22,,106936,19510,ADP
23,,SING,O3',HO3',no,N,23,,106936,19510,ADP
24,,SING,C2',O2',no,N,24,,106936,19510,ADP
25,,SING,C2',C1',no,N,25,,106936,19510,ADP
26,,SING,C2',H2',no,N,26,,106936,19510,ADP
27,,SING,O2',HO2',no,N,27,,106936,19510,ADP
28,,SING,C1',N9,no,N,28,,106936,19510,ADP
29,,SING,C1',H1',no,N,29,,106936,19510,ADP
30,,SING,N9,C8,yes,N,30,,106936,19510,ADP
31,,SING,N9,C4,yes,N,31,,106936,19510,ADP
32,,DOUB,C8,N7,yes,N,32,,106936,19510,ADP
33,,SING,C8,H8,no,N,33,,106936,19510,ADP
34,,SING,N7,C5,yes,N,34,,106936,19510,ADP
35,,SING,C5,C6,yes,N,35,,106936,19510,ADP
36,,DOUB,C5,C4,yes,N,36,,106936,19510,ADP
37,,SING,C6,N6,no,N,37,,106936,19510,ADP
38,,DOUB,C6,N1,yes,N,38,,106936,19510,ADP
39,,SING,N6,HN61,no,N,39,,106936,19510,ADP
40,,SING,N6,HN62,no,N,40,,106936,19510,ADP
41,,SING,N1,C2,yes,N,41,,106936,19510,ADP
42,,DOUB,C2,N3,yes,N,42,,106936,19510,ADP
43,,SING,C2,H2,no,N,43,,106936,19510,ADP
44,,SING,N3,C4,yes,N,44,,106936,19510,ADP
1,,SING,N,CA,no,N,1,,107829,19555,HYP
2,,SING,N,CD,no,N,2,,107829,19555,HYP
3,,SING,N,H,no,N,3,,107829,19555,HYP
4,,SING,CA,C,no,N,4,,107829,19555,HYP
5,,SING,CA,CB,no,N,5,,107829,19555,HYP
6,,SING,CA,HA,no,N,6,,107829,19555,HYP
7,,DOUB,C,O,no,N,7,,107829,19555,HYP
8,,SING,C,OXT,no,N,8,,107829,19555,HYP
9,,SING,CB,CG,no,N,9,,107829,19555,HYP
10,,SING,CB,HB2,no,N,10,,107829,19555,HYP
11,,SING,CB,HB3,no,N,11,,107829,19555,HYP
12,,SING,CG,CD,no,N,12,,107829,19555,HYP
13,,SING,CG,OD1,no,N,13,,107829,19555,HYP
14,,SING,CG,HG,no,N,14,,107829,19555,HYP
15,,SING,CD,HD22,no,N,15,,107829,19555,HYP
16,,SING,CD,HD23,no,N,16,,107829,19555,HYP
17,,SING,OD1,HD1,no,N,17,,107829,19555,HYP
18,,SING,OXT,HXT,no,N,18,,107829,19555,HYP
1,,SING,N,CA,no,N,1,,107847,19556,HYP
2,,SING,N,CD,no,N,2,,107847,19556,HYP
3,,SING,N,H,no,N,3,,107847,19556,HYP
4,,SING,CA,C,no,N,4,,107847,19556,HYP
5,,SING,CA,CB,no,N,5,,107847,19556,HYP
6,,SING,CA,HA,no,N,6,,107847,19556,HYP
7,,DOUB,C,O,no,N,7,,107847,19556,HYP
8,,SING,C,OXT,no,N,8,,107847,19556,HYP
9,,SING,CB,CG,no,N,9,,107847,19556,HYP
10,,SING,CB,HB2,no,N,10,,107847,19556,HYP
11,,SING,CB,HB3,no,N,11,,107847,19556,HYP
12,,SING,CG,CD,no,N,12,,107847,19556,HYP
13,,SING,CG,OD1,no,N,13,,107847,19556,HYP
14,,SING,CG,HG,no,N,14,,107847,19556,HYP
15,,SING,CD,HD22,no,N,15,,107847,19556,HYP
16,,SING,CD,HD23,no,N,16,,107847,19556,HYP
17,,SING,OD1,HD1,no,N,17,,107847,19556,HYP
18,,SING,OXT,HXT,no,N,18,,107847,19556,HYP
1,,SING,N,CA,no,N,1,,107968,19562,PTR
2,,SING,N,H,no,N,2,,107968,19562,PTR
3,,SING,N,HN2,no,N,3,,107968,19562,PTR
4,,SING,CA,C,no,N,4,,107968,19562,PTR
5,,SING,CA,CB,no,N,5,,107968,19562,PTR
6,,SING,CA,HA,no,N,6,,107968,19562,PTR
7,,DOUB,C,O,no,N,7,,107968,19562,PTR
8,,SING,C,OXT,no,N,8,,107968,19562,PTR
9,,SING,OXT,HXT,no,N,9,,107968,19562,PTR
10,,SING,CB,CG,no,N,10,,107968,19562,PTR
11,,SING,CB,HB2,no,N,11,,107968,19562,PTR
12,,SING,CB,HB3,no,N,12,,107968,19562,PTR
13,,DOUB,CG,CD1,yes,N,13,,107968,19562,PTR
14,,SING,CG,CD2,yes,N,14,,107968,19562,PTR
15,,SING,CD1,CE1,yes,N,15,,107968,19562,PTR
16,,SING,CD1,HD1,no,N,16,,107968,19562,PTR
17,,DOUB,CD2,CE2,yes,N,17,,107968,19562,PTR
18,,SING,CD2,HD2,no,N,18,,107968,19562,PTR
19,,DOUB,CE1,CZ,yes,N,19,,107968,19562,PTR
20,,SING,CE1,HE1,no,N,20,,107968,19562,PTR
21,,SING,CE2,CZ,yes,N,21,,107968,19562,PTR
22,,SING,CE2,HE2,no,N,22,,107968,19562,PTR
23,,SING,CZ,OH,no,N,23,,107968,19562,PTR
24,,SING,OH,P,no,N,24,,107968,19562,PTR
25,,DOUB,P,O1P,no,N,25,,107968,19562,PTR
26,,SING,P,O2P,no,N,26,,107968,19562,PTR
27,,SING,P,O3P,no,N,27,,107968,19562,PTR
28,,SING,O2P,HO2P,no,N,28,,107968,19562,PTR
29,,SING,O3P,HO3P,no,N,29,,107968,19562,PTR
1,,SING,N1,C2,yes,N,1,,108000,19563,FOL
2,,SING,N1,C8A,yes,N,2,,108000,19563,FOL
3,,SING,N1,HN1,no,N,3,,108000,19563,FOL
4,,SING,C2,NA2,no,N,4,,108000,19563,FOL
5,,DOUB,C2,N3,yes,N,5,,108000,19563,FOL
6,,SING,NA2,HN21,no,N,6,,108000,19563,FOL
7,,SING,NA2,HN22,no,N,7,,108000,19563,FOL
8,,SING,N3,C4,yes,N,8,,108000,19563,FOL
9,,DOUB,C4,O4,no,N,9,,108000,19563,FOL
10,,SING,C4,C4A,yes,N,10,,108000,19563,FOL
11,,SING,C4A,N5,yes,N,11,,108000,19563,FOL
12,,DOUB,C4A,C8A,yes,N,12,,108000,19563,FOL
13,,DOUB,N5,C6,yes,N,13,,108000,19563,FOL
14,,SING,C6,C7,yes,N,14,,108000,19563,FOL
15,,SING,C6,C9,no,N,15,,108000,19563,FOL
16,,DOUB,C7,N8,yes,N,16,,108000,19563,FOL
17,,SING,C7,H7,no,N,17,,108000,19563,FOL
18,,SING,N8,C8A,yes,N,18,,108000,19563,FOL
19,,SING,C9,N10,no,N,19,,108000,19563,FOL
20,,SING,C9,H91,no,N,20,,108000,19563,FOL
21,,SING,C9,H92,no,N,21,,108000,19563,FOL
22,,SING,N10,C14,no,N,22,,108000,19563,FOL
23,,SING,N10,HN0,no,N,23,,108000,19563,FOL
24,,DOUB,C11,C12,yes,N,24,,108000,19563,FOL
25,,SING,C11,C16,yes,N,25,,108000,19563,FOL
26,,SING,C11,C,no,N,26,,108000,19563,FOL
27,,SING,C12,C13,yes,N,27,,108000,19563,FOL
28,,SING,C12,H12,no,N,28,,108000,19563,FOL
29,,DOUB,C13,C14,yes,N,29,,108000,19563,FOL
30,,SING,C13,H13,no,N,30,,108000,19563,FOL
31,,SING,C14,C15,yes,N,31,,108000,19563,FOL
32,,DOUB,C15,C16,yes,N,32,,108000,19563,FOL
33,,SING,C15,H15,no,N,33,,108000,19563,FOL
34,,SING,C16,H16,no,N,34,,108000,19563,FOL
35,,DOUB,C,O,no,N,35,,108000,19563,FOL
36,,SING,C,N,no,N,36,,108000,19563,FOL
37,,SING,N,CA,no,N,37,,108000,19563,FOL
38,,SING,N,HN,no,N,38,,108000,19563,FOL
39,,SING,CA,CB,no,N,39,,108000,19563,FOL
40,,SING,CA,CT,no,N,40,,108000,19563,FOL
41,,SING,CA,HA,no,N,41,,108000,19563,FOL
42,,SING,CB,CG,no,N,42,,108000,19563,FOL
43,,SING,CB,HB1,no,N,43,,108000,19563,FOL
44,,SING,CB,HB2,no,N,44,,108000,19563,FOL
45,,SING,CG,CD,no,N,45,,108000,19563,FOL
46,,SING,CG,HG1,no,N,46,,108000,19563,FOL
47,,SING,CG,HG2,no,N,47,,108000,19563,FOL
48,,DOUB,CD,OE1,no,N,48,,108000,19563,FOL
49,,SING,CD,OE2,no,N,49,,108000,19563,FOL
50,,SING,OE2,HOE2,no,N,50,,108000,19563,FOL
51,,DOUB,CT,O1,no,N,51,,108000,19563,FOL
52,,SING,CT,O2,no,N,52,,108000,19563,FOL
53,,SING,O2,HO2,no,N,53,,108000,19563,FOL
1,,SING,N3,C2,yes,N,1,,108019,19564,THG
2,,SING,N3,C4,yes,N,2,,108019,19564,THG
3,,SING,N3,HN3,no,N,3,,108019,19564,THG
4,,DOUB,C2,N1,yes,N,4,,108019,19564,THG
5,,SING,C2,N2,no,N,5,,108019,19564,THG
6,,SING,N1,C8A,yes,N,6,,108019,19564,THG
7,,DOUB,C8A,C4A,yes,N,7,,108019,19564,THG
8,,SING,C8A,N8,no,N,8,,108019,19564,THG
9,,SING,C4A,C4,yes,N,9,,108019,19564,THG
10,,SING,C4A,N5,no,N,10,,108019,19564,THG
11,,DOUB,C4,O4,no,N,11,,108019,19564,THG
12,,SING,N8,C7,no,N,12,,108019,19564,THG
13,,SING,N8,HN8,no,N,13,,108019,19564,THG
14,,SING,C7,C6,no,N,14,,108019,19564,THG
15,,SING,C7,HC71,no,N,15,,108019,19564,THG
16,,SING,C7,HC72,no,N,16,,108019,19564,THG
17,,SING,C6,N5,no,N,17,,108019,19564,THG
18,,SING,C6,C9,no,N,18,,108019,19564,THG
19,,SING,C6,HC6,no,N,19,,108019,19564,THG
20,,SING,N5,HN5,no,N,20,,108019,19564,THG
21,,SING,C9,N10,no,N,21,,108019,19564,THG
22,,SING,C9,HC91,no,N,22,,108019,19564,THG
23,,SING,C9,HC92,no,N,23,,108019,19564,THG
24,,SING,N10,C4',no,N,24,,108019,19564,THG
25,,SING,N10,H10,no,N,25,,108019,19564,THG
26,,DOUB,C4',C3',yes,N,26,,108019,19564,THG
27,,SING,C4',C5',yes,N,27,,108019,19564,THG
28,,SING,C3',C2',yes,N,28,,108019,19564,THG
29,,SING,C3',HC3,no,N,29,,108019,19564,THG
30,,DOUB,C2',C1',yes,N,30,,108019,19564,THG
31,,SING,C2',HC2,no,N,31,,108019,19564,THG
32,,SING,C1',C6',yes,N,32,,108019,19564,THG
14,,SING,C5,H53,,,,,240371,6145,TPLi
33,,SING,C1',C11,no,N,33,,108019,19564,THG
34,,DOUB,C6',C5',yes,N,34,,108019,19564,THG
35,,SING,C6',HC61,no,N,35,,108019,19564,THG
36,,SING,C5',HC5,no,N,36,,108019,19564,THG
37,,SING,C11,N,no,N,37,,108019,19564,THG
38,,DOUB,C11,O11,no,N,38,,108019,19564,THG
39,,SING,N,CA,no,N,39,,108019,19564,THG
40,,SING,N,HN,no,N,40,,108019,19564,THG
41,,SING,CA,C,no,N,41,,108019,19564,THG
42,,SING,CA,CB,no,N,42,,108019,19564,THG
43,,SING,CA,HCA,no,N,43,,108019,19564,THG
44,,SING,C,OX2,no,N,44,,108019,19564,THG
45,,DOUB,C,OX1,no,N,45,,108019,19564,THG
46,,SING,OX2,HX2,no,N,46,,108019,19564,THG
47,,SING,CB,CG,no,N,47,,108019,19564,THG
48,,SING,CB,HCB1,no,N,48,,108019,19564,THG
49,,SING,CB,HCB2,no,N,49,,108019,19564,THG
50,,SING,CG,CD,no,N,50,,108019,19564,THG
51,,SING,CG,HCG1,no,N,51,,108019,19564,THG
52,,SING,CG,HCG2,no,N,52,,108019,19564,THG
53,,DOUB,CD,OE1,no,N,53,,108019,19564,THG
54,,SING,CD,OE2,no,N,54,,108019,19564,THG
55,,SING,OE2,HE2,no,N,55,,108019,19564,THG
56,,SING,N2,HN21,no,N,56,,108019,19564,THG
57,,SING,N2,HN22,no,N,57,,108019,19564,THG
1,,DOUB,PA,O1A,no,N,1,,108041,19565,NDP
2,,SING,PA,O2A,no,N,2,,108041,19565,NDP
3,,SING,PA,O5B,no,N,3,,108041,19565,NDP
4,,SING,PA,O3,no,N,4,,108041,19565,NDP
5,,SING,O2A,HOA2,no,N,5,,108041,19565,NDP
6,,SING,O5B,C5B,no,N,6,,108041,19565,NDP
7,,SING,C5B,C4B,no,N,7,,108041,19565,NDP
8,,SING,C5B,H51A,no,N,8,,108041,19565,NDP
9,,SING,C5B,H52A,no,N,9,,108041,19565,NDP
10,,SING,C4B,O4B,no,N,10,,108041,19565,NDP
11,,SING,C4B,C3B,no,N,11,,108041,19565,NDP
12,,SING,C4B,H4B,no,N,12,,108041,19565,NDP
13,,SING,O4B,C1B,no,N,13,,108041,19565,NDP
14,,SING,C3B,O3B,no,N,14,,108041,19565,NDP
15,,SING,C3B,C2B,no,N,15,,108041,19565,NDP
16,,SING,C3B,H3B,no,N,16,,108041,19565,NDP
17,,SING,O3B,HO3A,no,N,17,,108041,19565,NDP
18,,SING,C2B,O2B,no,N,18,,108041,19565,NDP
19,,SING,C2B,C1B,no,N,19,,108041,19565,NDP
20,,SING,C2B,H2B,no,N,20,,108041,19565,NDP
21,,SING,O2B,P2B,no,N,21,,108041,19565,NDP
22,,SING,C1B,N9A,no,N,22,,108041,19565,NDP
23,,SING,C1B,H1B,no,N,23,,108041,19565,NDP
24,,SING,N9A,C8A,yes,N,24,,108041,19565,NDP
25,,SING,N9A,C4A,yes,N,25,,108041,19565,NDP
26,,DOUB,C8A,N7A,yes,N,26,,108041,19565,NDP
27,,SING,C8A,H8A,no,N,27,,108041,19565,NDP
28,,SING,N7A,C5A,yes,N,28,,108041,19565,NDP
29,,SING,C5A,C6A,yes,N,29,,108041,19565,NDP
30,,DOUB,C5A,C4A,yes,N,30,,108041,19565,NDP
31,,SING,C6A,N6A,no,N,31,,108041,19565,NDP
32,,DOUB,C6A,N1A,yes,N,32,,108041,19565,NDP
33,,SING,N6A,H61A,no,N,33,,108041,19565,NDP
34,,SING,N6A,H62A,no,N,34,,108041,19565,NDP
35,,SING,N1A,C2A,yes,N,35,,108041,19565,NDP
36,,DOUB,C2A,N3A,yes,N,36,,108041,19565,NDP
37,,SING,C2A,H2A,no,N,37,,108041,19565,NDP
38,,SING,N3A,C4A,yes,N,38,,108041,19565,NDP
39,,SING,O3,PN,no,N,39,,108041,19565,NDP
40,,DOUB,PN,O1N,no,N,40,,108041,19565,NDP
41,,SING,PN,O2N,no,N,41,,108041,19565,NDP
42,,SING,PN,O5D,no,N,42,,108041,19565,NDP
43,,SING,O2N,H21N,no,N,43,,108041,19565,NDP
44,,SING,O5D,C5D,no,N,44,,108041,19565,NDP
45,,SING,C5D,C4D,no,N,45,,108041,19565,NDP
46,,SING,C5D,H51N,no,N,46,,108041,19565,NDP
47,,SING,C5D,H52N,no,N,47,,108041,19565,NDP
48,,SING,C4D,O4D,no,N,48,,108041,19565,NDP
49,,SING,C4D,C3D,no,N,49,,108041,19565,NDP
50,,SING,C4D,H4D,no,N,50,,108041,19565,NDP
51,,SING,O4D,C1D,no,N,51,,108041,19565,NDP
52,,SING,C3D,O3D,no,N,52,,108041,19565,NDP
53,,SING,C3D,C2D,no,N,53,,108041,19565,NDP
54,,SING,C3D,H3D,no,N,54,,108041,19565,NDP
55,,SING,O3D,HO3N,no,N,55,,108041,19565,NDP
56,,SING,C2D,O2D,no,N,56,,108041,19565,NDP
57,,SING,C2D,C1D,no,N,57,,108041,19565,NDP
58,,SING,C2D,H2D,no,N,58,,108041,19565,NDP
59,,SING,O2D,HO2N,no,N,59,,108041,19565,NDP
60,,SING,C1D,N1N,no,N,60,,108041,19565,NDP
61,,SING,C1D,H1D,no,N,61,,108041,19565,NDP
62,,SING,N1N,C2N,no,N,62,,108041,19565,NDP
63,,SING,N1N,C6N,no,N,63,,108041,19565,NDP
64,,DOUB,C2N,C3N,no,N,64,,108041,19565,NDP
65,,SING,C2N,H2N,no,N,65,,108041,19565,NDP
66,,SING,C3N,C7N,no,N,66,,108041,19565,NDP
67,,SING,C3N,C4N,no,N,67,,108041,19565,NDP
68,,DOUB,C7N,O7N,no,N,68,,108041,19565,NDP
69,,SING,C7N,N7N,no,N,69,,108041,19565,NDP
70,,SING,N7N,H71N,no,N,70,,108041,19565,NDP
71,,SING,N7N,H72N,no,N,71,,108041,19565,NDP
72,,SING,C4N,C5N,no,N,72,,108041,19565,NDP
73,,SING,C4N,H41N,no,N,73,,108041,19565,NDP
74,,SING,C4N,H42N,no,N,74,,108041,19565,NDP
75,,DOUB,C5N,C6N,no,N,75,,108041,19565,NDP
76,,SING,C5N,H5N,no,N,76,,108041,19565,NDP
77,,SING,C6N,H6N,no,N,77,,108041,19565,NDP
78,,DOUB,P2B,O1X,no,N,78,,108041,19565,NDP
79,,SING,P2B,O2X,no,N,79,,108041,19565,NDP
80,,SING,P2B,O3X,no,N,80,,108041,19565,NDP
81,,SING,O2X,HOP2,no,N,81,,108041,19565,NDP
82,,SING,O3X,HOP3,no,N,82,,108041,19565,NDP
1,,SING,N3,C2,yes,N,1,,108042,19565,THG
2,,SING,N3,C4,yes,N,2,,108042,19565,THG
3,,SING,N3,HN3,no,N,3,,108042,19565,THG
4,,DOUB,C2,N1,yes,N,4,,108042,19565,THG
5,,SING,C2,N2,no,N,5,,108042,19565,THG
6,,SING,N1,C8A,yes,N,6,,108042,19565,THG
7,,DOUB,C8A,C4A,yes,N,7,,108042,19565,THG
8,,SING,C8A,N8,no,N,8,,108042,19565,THG
9,,SING,C4A,C4,yes,N,9,,108042,19565,THG
10,,SING,C4A,N5,no,N,10,,108042,19565,THG
11,,DOUB,C4,O4,no,N,11,,108042,19565,THG
12,,SING,N8,C7,no,N,12,,108042,19565,THG
13,,SING,N8,HN8,no,N,13,,108042,19565,THG
14,,SING,C7,C6,no,N,14,,108042,19565,THG
15,,SING,C7,HC71,no,N,15,,108042,19565,THG
16,,SING,C7,HC72,no,N,16,,108042,19565,THG
17,,SING,C6,N5,no,N,17,,108042,19565,THG
18,,SING,C6,C9,no,N,18,,108042,19565,THG
19,,SING,C6,HC6,no,N,19,,108042,19565,THG
20,,SING,N5,HN5,no,N,20,,108042,19565,THG
21,,SING,C9,N10,no,N,21,,108042,19565,THG
22,,SING,C9,HC91,no,N,22,,108042,19565,THG
23,,SING,C9,HC92,no,N,23,,108042,19565,THG
24,,SING,N10,C4',no,N,24,,108042,19565,THG
25,,SING,N10,H10,no,N,25,,108042,19565,THG
26,,DOUB,C4',C3',yes,N,26,,108042,19565,THG
27,,SING,C4',C5',yes,N,27,,108042,19565,THG
28,,SING,C3',C2',yes,N,28,,108042,19565,THG
29,,SING,C3',HC3,no,N,29,,108042,19565,THG
30,,DOUB,C2',C1',yes,N,30,,108042,19565,THG
31,,SING,C2',HC2,no,N,31,,108042,19565,THG
32,,SING,C1',C6',yes,N,32,,108042,19565,THG
33,,SING,C1',C11,no,N,33,,108042,19565,THG
34,,DOUB,C6',C5',yes,N,34,,108042,19565,THG
35,,SING,C6',HC61,no,N,35,,108042,19565,THG
36,,SING,C5',HC5,no,N,36,,108042,19565,THG
37,,SING,C11,N,no,N,37,,108042,19565,THG
38,,DOUB,C11,O11,no,N,38,,108042,19565,THG
39,,SING,N,CA,no,N,39,,108042,19565,THG
40,,SING,N,HN,no,N,40,,108042,19565,THG
41,,SING,CA,C,no,N,41,,108042,19565,THG
42,,SING,CA,CB,no,N,42,,108042,19565,THG
43,,SING,CA,HCA,no,N,43,,108042,19565,THG
44,,SING,C,OX2,no,N,44,,108042,19565,THG
45,,DOUB,C,OX1,no,N,45,,108042,19565,THG
46,,SING,OX2,HX2,no,N,46,,108042,19565,THG
47,,SING,CB,CG,no,N,47,,108042,19565,THG
48,,SING,CB,HCB1,no,N,48,,108042,19565,THG
49,,SING,CB,HCB2,no,N,49,,108042,19565,THG
50,,SING,CG,CD,no,N,50,,108042,19565,THG
51,,SING,CG,HCG1,no,N,51,,108042,19565,THG
52,,SING,CG,HCG2,no,N,52,,108042,19565,THG
53,,DOUB,CD,OE1,no,N,53,,108042,19565,THG
54,,SING,CD,OE2,no,N,54,,108042,19565,THG
55,,SING,OE2,HE2,no,N,55,,108042,19565,THG
56,,SING,N2,HN21,no,N,56,,108042,19565,THG
57,,SING,N2,HN22,no,N,57,,108042,19565,THG
1,,DOUB,PA,O1A,no,N,1,,108063,19566,NDP
2,,SING,PA,O2A,no,N,2,,108063,19566,NDP
3,,SING,PA,O5B,no,N,3,,108063,19566,NDP
4,,SING,PA,O3,no,N,4,,108063,19566,NDP
5,,SING,O2A,HOA2,no,N,5,,108063,19566,NDP
6,,SING,O5B,C5B,no,N,6,,108063,19566,NDP
7,,SING,C5B,C4B,no,N,7,,108063,19566,NDP
8,,SING,C5B,H51A,no,N,8,,108063,19566,NDP
9,,SING,C5B,H52A,no,N,9,,108063,19566,NDP
10,,SING,C4B,O4B,no,N,10,,108063,19566,NDP
11,,SING,C4B,C3B,no,N,11,,108063,19566,NDP
12,,SING,C4B,H4B,no,N,12,,108063,19566,NDP
13,,SING,O4B,C1B,no,N,13,,108063,19566,NDP
14,,SING,C3B,O3B,no,N,14,,108063,19566,NDP
15,,SING,C3B,C2B,no,N,15,,108063,19566,NDP
16,,SING,C3B,H3B,no,N,16,,108063,19566,NDP
17,,SING,O3B,HO3A,no,N,17,,108063,19566,NDP
18,,SING,C2B,O2B,no,N,18,,108063,19566,NDP
19,,SING,C2B,C1B,no,N,19,,108063,19566,NDP
20,,SING,C2B,H2B,no,N,20,,108063,19566,NDP
21,,SING,O2B,P2B,no,N,21,,108063,19566,NDP
22,,SING,C1B,N9A,no,N,22,,108063,19566,NDP
23,,SING,C1B,H1B,no,N,23,,108063,19566,NDP
24,,SING,N9A,C8A,yes,N,24,,108063,19566,NDP
25,,SING,N9A,C4A,yes,N,25,,108063,19566,NDP
26,,DOUB,C8A,N7A,yes,N,26,,108063,19566,NDP
27,,SING,C8A,H8A,no,N,27,,108063,19566,NDP
28,,SING,N7A,C5A,yes,N,28,,108063,19566,NDP
29,,SING,C5A,C6A,yes,N,29,,108063,19566,NDP
30,,DOUB,C5A,C4A,yes,N,30,,108063,19566,NDP
31,,SING,C6A,N6A,no,N,31,,108063,19566,NDP
32,,DOUB,C6A,N1A,yes,N,32,,108063,19566,NDP
33,,SING,N6A,H61A,no,N,33,,108063,19566,NDP
34,,SING,N6A,H62A,no,N,34,,108063,19566,NDP
35,,SING,N1A,C2A,yes,N,35,,108063,19566,NDP
36,,DOUB,C2A,N3A,yes,N,36,,108063,19566,NDP
37,,SING,C2A,H2A,no,N,37,,108063,19566,NDP
38,,SING,N3A,C4A,yes,N,38,,108063,19566,NDP
39,,SING,O3,PN,no,N,39,,108063,19566,NDP
40,,DOUB,PN,O1N,no,N,40,,108063,19566,NDP
41,,SING,PN,O2N,no,N,41,,108063,19566,NDP
42,,SING,PN,O5D,no,N,42,,108063,19566,NDP
43,,SING,O2N,H21N,no,N,43,,108063,19566,NDP
44,,SING,O5D,C5D,no,N,44,,108063,19566,NDP
45,,SING,C5D,C4D,no,N,45,,108063,19566,NDP
46,,SING,C5D,H51N,no,N,46,,108063,19566,NDP
47,,SING,C5D,H52N,no,N,47,,108063,19566,NDP
48,,SING,C4D,O4D,no,N,48,,108063,19566,NDP
49,,SING,C4D,C3D,no,N,49,,108063,19566,NDP
50,,SING,C4D,H4D,no,N,50,,108063,19566,NDP
51,,SING,O4D,C1D,no,N,51,,108063,19566,NDP
52,,SING,C3D,O3D,no,N,52,,108063,19566,NDP
53,,SING,C3D,C2D,no,N,53,,108063,19566,NDP
54,,SING,C3D,H3D,no,N,54,,108063,19566,NDP
55,,SING,O3D,HO3N,no,N,55,,108063,19566,NDP
56,,SING,C2D,O2D,no,N,56,,108063,19566,NDP
57,,SING,C2D,C1D,no,N,57,,108063,19566,NDP
58,,SING,C2D,H2D,no,N,58,,108063,19566,NDP
59,,SING,O2D,HO2N,no,N,59,,108063,19566,NDP
60,,SING,C1D,N1N,no,N,60,,108063,19566,NDP
61,,SING,C1D,H1D,no,N,61,,108063,19566,NDP
62,,SING,N1N,C2N,no,N,62,,108063,19566,NDP
63,,SING,N1N,C6N,no,N,63,,108063,19566,NDP
64,,DOUB,C2N,C3N,no,N,64,,108063,19566,NDP
65,,SING,C2N,H2N,no,N,65,,108063,19566,NDP
66,,SING,C3N,C7N,no,N,66,,108063,19566,NDP
67,,SING,C3N,C4N,no,N,67,,108063,19566,NDP
68,,DOUB,C7N,O7N,no,N,68,,108063,19566,NDP
69,,SING,C7N,N7N,no,N,69,,108063,19566,NDP
70,,SING,N7N,H71N,no,N,70,,108063,19566,NDP
71,,SING,N7N,H72N,no,N,71,,108063,19566,NDP
72,,SING,C4N,C5N,no,N,72,,108063,19566,NDP
73,,SING,C4N,H41N,no,N,73,,108063,19566,NDP
74,,SING,C4N,H42N,no,N,74,,108063,19566,NDP
75,,DOUB,C5N,C6N,no,N,75,,108063,19566,NDP
76,,SING,C5N,H5N,no,N,76,,108063,19566,NDP
77,,SING,C6N,H6N,no,N,77,,108063,19566,NDP
78,,DOUB,P2B,O1X,no,N,78,,108063,19566,NDP
79,,SING,P2B,O2X,no,N,79,,108063,19566,NDP
80,,SING,P2B,O3X,no,N,80,,108063,19566,NDP
81,,SING,O2X,HOP2,no,N,81,,108063,19566,NDP
82,,SING,O3X,HOP3,no,N,82,,108063,19566,NDP
1,,DOUB,PA,O1A,no,N,1,,108085,19567,NDP
2,,SING,PA,O2A,no,N,2,,108085,19567,NDP
3,,SING,PA,O5B,no,N,3,,108085,19567,NDP
4,,SING,PA,O3,no,N,4,,108085,19567,NDP
5,,SING,O2A,HOA2,no,N,5,,108085,19567,NDP
6,,SING,O5B,C5B,no,N,6,,108085,19567,NDP
7,,SING,C5B,C4B,no,N,7,,108085,19567,NDP
8,,SING,C5B,H51A,no,N,8,,108085,19567,NDP
9,,SING,C5B,H52A,no,N,9,,108085,19567,NDP
10,,SING,C4B,O4B,no,N,10,,108085,19567,NDP
11,,SING,C4B,C3B,no,N,11,,108085,19567,NDP
12,,SING,C4B,H4B,no,N,12,,108085,19567,NDP
13,,SING,O4B,C1B,no,N,13,,108085,19567,NDP
14,,SING,C3B,O3B,no,N,14,,108085,19567,NDP
15,,SING,C3B,C2B,no,N,15,,108085,19567,NDP
16,,SING,C3B,H3B,no,N,16,,108085,19567,NDP
17,,SING,O3B,HO3A,no,N,17,,108085,19567,NDP
18,,SING,C2B,O2B,no,N,18,,108085,19567,NDP
19,,SING,C2B,C1B,no,N,19,,108085,19567,NDP
20,,SING,C2B,H2B,no,N,20,,108085,19567,NDP
21,,SING,O2B,P2B,no,N,21,,108085,19567,NDP
22,,SING,C1B,N9A,no,N,22,,108085,19567,NDP
23,,SING,C1B,H1B,no,N,23,,108085,19567,NDP
24,,SING,N9A,C8A,yes,N,24,,108085,19567,NDP
25,,SING,N9A,C4A,yes,N,25,,108085,19567,NDP
26,,DOUB,C8A,N7A,yes,N,26,,108085,19567,NDP
27,,SING,C8A,H8A,no,N,27,,108085,19567,NDP
28,,SING,N7A,C5A,yes,N,28,,108085,19567,NDP
29,,SING,C5A,C6A,yes,N,29,,108085,19567,NDP
30,,DOUB,C5A,C4A,yes,N,30,,108085,19567,NDP
31,,SING,C6A,N6A,no,N,31,,108085,19567,NDP
32,,DOUB,C6A,N1A,yes,N,32,,108085,19567,NDP
33,,SING,N6A,H61A,no,N,33,,108085,19567,NDP
34,,SING,N6A,H62A,no,N,34,,108085,19567,NDP
35,,SING,N1A,C2A,yes,N,35,,108085,19567,NDP
36,,DOUB,C2A,N3A,yes,N,36,,108085,19567,NDP
37,,SING,C2A,H2A,no,N,37,,108085,19567,NDP
38,,SING,N3A,C4A,yes,N,38,,108085,19567,NDP
39,,SING,O3,PN,no,N,39,,108085,19567,NDP
40,,DOUB,PN,O1N,no,N,40,,108085,19567,NDP
41,,SING,PN,O2N,no,N,41,,108085,19567,NDP
42,,SING,PN,O5D,no,N,42,,108085,19567,NDP
43,,SING,O2N,H21N,no,N,43,,108085,19567,NDP
44,,SING,O5D,C5D,no,N,44,,108085,19567,NDP
45,,SING,C5D,C4D,no,N,45,,108085,19567,NDP
46,,SING,C5D,H51N,no,N,46,,108085,19567,NDP
47,,SING,C5D,H52N,no,N,47,,108085,19567,NDP
48,,SING,C4D,O4D,no,N,48,,108085,19567,NDP
49,,SING,C4D,C3D,no,N,49,,108085,19567,NDP
50,,SING,C4D,H4D,no,N,50,,108085,19567,NDP
51,,SING,O4D,C1D,no,N,51,,108085,19567,NDP
52,,SING,C3D,O3D,no,N,52,,108085,19567,NDP
1,,SING,N,CA,,,,,240393,6146,DHA_2
53,,SING,C3D,C2D,no,N,53,,108085,19567,NDP
54,,SING,C3D,H3D,no,N,54,,108085,19567,NDP
55,,SING,O3D,HO3N,no,N,55,,108085,19567,NDP
56,,SING,C2D,O2D,no,N,56,,108085,19567,NDP
57,,SING,C2D,C1D,no,N,57,,108085,19567,NDP
58,,SING,C2D,H2D,no,N,58,,108085,19567,NDP
59,,SING,O2D,HO2N,no,N,59,,108085,19567,NDP
60,,SING,C1D,N1N,no,N,60,,108085,19567,NDP
61,,SING,C1D,H1D,no,N,61,,108085,19567,NDP
62,,SING,N1N,C2N,no,N,62,,108085,19567,NDP
63,,SING,N1N,C6N,no,N,63,,108085,19567,NDP
64,,DOUB,C2N,C3N,no,N,64,,108085,19567,NDP
65,,SING,C2N,H2N,no,N,65,,108085,19567,NDP
66,,SING,C3N,C7N,no,N,66,,108085,19567,NDP
67,,SING,C3N,C4N,no,N,67,,108085,19567,NDP
68,,DOUB,C7N,O7N,no,N,68,,108085,19567,NDP
69,,SING,C7N,N7N,no,N,69,,108085,19567,NDP
70,,SING,N7N,H71N,no,N,70,,108085,19567,NDP
71,,SING,N7N,H72N,no,N,71,,108085,19567,NDP
72,,SING,C4N,C5N,no,N,72,,108085,19567,NDP
73,,SING,C4N,H41N,no,N,73,,108085,19567,NDP
74,,SING,C4N,H42N,no,N,74,,108085,19567,NDP
75,,DOUB,C5N,C6N,no,N,75,,108085,19567,NDP
76,,SING,C5N,H5N,no,N,76,,108085,19567,NDP
77,,SING,C6N,H6N,no,N,77,,108085,19567,NDP
78,,DOUB,P2B,O1X,no,N,78,,108085,19567,NDP
79,,SING,P2B,O2X,no,N,79,,108085,19567,NDP
80,,SING,P2B,O3X,no,N,80,,108085,19567,NDP
81,,SING,O2X,HOP2,no,N,81,,108085,19567,NDP
82,,SING,O3X,HOP3,no,N,82,,108085,19567,NDP
1,,SING,N1,C2,yes,N,1,,108086,19567,FOL
2,,SING,N1,C8A,yes,N,2,,108086,19567,FOL
3,,SING,N1,HN1,no,N,3,,108086,19567,FOL
4,,SING,C2,NA2,no,N,4,,108086,19567,FOL
5,,DOUB,C2,N3,yes,N,5,,108086,19567,FOL
6,,SING,NA2,HN21,no,N,6,,108086,19567,FOL
7,,SING,NA2,HN22,no,N,7,,108086,19567,FOL
8,,SING,N3,C4,yes,N,8,,108086,19567,FOL
9,,DOUB,C4,O4,no,N,9,,108086,19567,FOL
10,,SING,C4,C4A,yes,N,10,,108086,19567,FOL
11,,SING,C4A,N5,yes,N,11,,108086,19567,FOL
12,,DOUB,C4A,C8A,yes,N,12,,108086,19567,FOL
13,,DOUB,N5,C6,yes,N,13,,108086,19567,FOL
14,,SING,C6,C7,yes,N,14,,108086,19567,FOL
15,,SING,C6,C9,no,N,15,,108086,19567,FOL
16,,DOUB,C7,N8,yes,N,16,,108086,19567,FOL
17,,SING,C7,H7,no,N,17,,108086,19567,FOL
18,,SING,N8,C8A,yes,N,18,,108086,19567,FOL
19,,SING,C9,N10,no,N,19,,108086,19567,FOL
20,,SING,C9,H91,no,N,20,,108086,19567,FOL
21,,SING,C9,H92,no,N,21,,108086,19567,FOL
22,,SING,N10,C14,no,N,22,,108086,19567,FOL
23,,SING,N10,HN0,no,N,23,,108086,19567,FOL
24,,DOUB,C11,C12,yes,N,24,,108086,19567,FOL
25,,SING,C11,C16,yes,N,25,,108086,19567,FOL
26,,SING,C11,C,no,N,26,,108086,19567,FOL
27,,SING,C12,C13,yes,N,27,,108086,19567,FOL
28,,SING,C12,H12,no,N,28,,108086,19567,FOL
29,,DOUB,C13,C14,yes,N,29,,108086,19567,FOL
30,,SING,C13,H13,no,N,30,,108086,19567,FOL
31,,SING,C14,C15,yes,N,31,,108086,19567,FOL
32,,DOUB,C15,C16,yes,N,32,,108086,19567,FOL
33,,SING,C15,H15,no,N,33,,108086,19567,FOL
34,,SING,C16,H16,no,N,34,,108086,19567,FOL
35,,DOUB,C,O,no,N,35,,108086,19567,FOL
36,,SING,C,N,no,N,36,,108086,19567,FOL
37,,SING,N,CA,no,N,37,,108086,19567,FOL
38,,SING,N,HN,no,N,38,,108086,19567,FOL
39,,SING,CA,CB,no,N,39,,108086,19567,FOL
40,,SING,CA,CT,no,N,40,,108086,19567,FOL
41,,SING,CA,HA,no,N,41,,108086,19567,FOL
42,,SING,CB,CG,no,N,42,,108086,19567,FOL
43,,SING,CB,HB1,no,N,43,,108086,19567,FOL
44,,SING,CB,HB2,no,N,44,,108086,19567,FOL
45,,SING,CG,CD,no,N,45,,108086,19567,FOL
46,,SING,CG,HG1,no,N,46,,108086,19567,FOL
47,,SING,CG,HG2,no,N,47,,108086,19567,FOL
48,,DOUB,CD,OE1,no,N,48,,108086,19567,FOL
49,,SING,CD,OE2,no,N,49,,108086,19567,FOL
50,,SING,OE2,HOE2,no,N,50,,108086,19567,FOL
51,,DOUB,CT,O1,no,N,51,,108086,19567,FOL
52,,SING,CT,O2,no,N,52,,108086,19567,FOL
53,,SING,O2,HO2,no,N,53,,108086,19567,FOL
1,,SING,N,CA,no,N,1,,108255,19577,ABA
2,,SING,N,H,no,N,2,,108255,19577,ABA
3,,SING,N,HN2,no,N,3,,108255,19577,ABA
4,,SING,CA,C,no,N,4,,108255,19577,ABA
5,,SING,CA,CB,no,N,5,,108255,19577,ABA
6,,SING,CA,HA,no,N,6,,108255,19577,ABA
7,,DOUB,C,O,no,N,7,,108255,19577,ABA
8,,SING,C,OXT,no,N,8,,108255,19577,ABA
9,,SING,CB,CG,no,N,9,,108255,19577,ABA
10,,SING,CB,HB3,no,N,10,,108255,19577,ABA
11,,SING,CB,HB2,no,N,11,,108255,19577,ABA
12,,SING,CG,HG1,no,N,12,,108255,19577,ABA
13,,SING,CG,HG3,no,N,13,,108255,19577,ABA
14,,SING,CG,HG2,no,N,14,,108255,19577,ABA
15,,SING,OXT,HXT,no,N,15,,108255,19577,ABA
1,,SING,N,CA,no,N,1,,108274,19578,ABA
2,,SING,N,H,no,N,2,,108274,19578,ABA
3,,SING,N,HN2,no,N,3,,108274,19578,ABA
4,,SING,CA,C,no,N,4,,108274,19578,ABA
5,,SING,CA,CB,no,N,5,,108274,19578,ABA
6,,SING,CA,HA,no,N,6,,108274,19578,ABA
7,,DOUB,C,O,no,N,7,,108274,19578,ABA
8,,SING,C,OXT,no,N,8,,108274,19578,ABA
9,,SING,CB,CG,no,N,9,,108274,19578,ABA
10,,SING,CB,HB3,no,N,10,,108274,19578,ABA
11,,SING,CB,HB2,no,N,11,,108274,19578,ABA
12,,SING,CG,HG1,no,N,12,,108274,19578,ABA
13,,SING,CG,HG3,no,N,13,,108274,19578,ABA
14,,SING,CG,HG2,no,N,14,,108274,19578,ABA
15,,SING,OXT,HXT,no,N,15,,108274,19578,ABA
1,,DOUB,C,O,no,N,1,,108314,19580,ACE
2,,SING,C,CH3,no,N,2,,108314,19580,ACE
3,,SING,C,H,no,N,3,,108314,19580,ACE
4,,SING,CH3,H1,no,N,4,,108314,19580,ACE
5,,SING,CH3,H2,no,N,5,,108314,19580,ACE
6,,SING,CH3,H3,no,N,6,,108314,19580,ACE
1,,SING,N,HN1,no,N,1,,108315,19580,NH2
2,,SING,N,HN2,no,N,2,,108315,19580,NH2
1,,SING,N,CA,no,N,1,,108432,19587,ABA
2,,SING,N,H,no,N,2,,108432,19587,ABA
3,,SING,N,HN2,no,N,3,,108432,19587,ABA
4,,SING,CA,C,no,N,4,,108432,19587,ABA
5,,SING,CA,CB,no,N,5,,108432,19587,ABA
6,,SING,CA,HA,no,N,6,,108432,19587,ABA
7,,DOUB,C,O,no,N,7,,108432,19587,ABA
8,,SING,C,OXT,no,N,8,,108432,19587,ABA
9,,SING,CB,CG,no,N,9,,108432,19587,ABA
10,,SING,CB,HB3,no,N,10,,108432,19587,ABA
11,,SING,CB,HB2,no,N,11,,108432,19587,ABA
12,,SING,CG,HG1,no,N,12,,108432,19587,ABA
13,,SING,CG,HG3,no,N,13,,108432,19587,ABA
14,,SING,CG,HG2,no,N,14,,108432,19587,ABA
15,,SING,OXT,HXT,no,N,15,,108432,19587,ABA
1,,DOUB,C1,C2,yes,N,1,,108501,19592,XR2
2,,SING,C1,C11,yes,N,2,,108501,19592,XR2
3,,SING,C1,C,no,N,3,,108501,19592,XR2
4,,SING,C2,C3,yes,N,4,,108501,19592,XR2
5,,SING,C2,H2,no,N,5,,108501,19592,XR2
6,,DOUB,C3,C4,yes,N,6,,108501,19592,XR2
7,,SING,C3,H3,no,N,7,,108501,19592,XR2
8,,SING,C4,C12,yes,N,8,,108501,19592,XR2
9,,SING,C4,H4,no,N,9,,108501,19592,XR2
10,,SING,C12,C11,yes,N,10,,108501,19592,XR2
11,,DOUB,C12,N5,yes,N,11,,108501,19592,XR2
12,,DOUB,C11,N10,yes,N,12,,108501,19592,XR2
13,,SING,N5,C13,yes,N,13,,108501,19592,XR2
14,,SING,N10,C14,yes,N,14,,108501,19592,XR2
15,,SING,N10,H10,no,N,15,,108501,19592,XR2
16,,DOUB,C13,C14,yes,N,16,,108501,19592,XR2
17,,SING,C13,C6,yes,N,17,,108501,19592,XR2
18,,SING,C14,C9,yes,N,18,,108501,19592,XR2
19,,DOUB,C6,C7,yes,N,19,,108501,19592,XR2
20,,SING,C6,H6,no,N,20,,108501,19592,XR2
21,,SING,C7,C8,yes,N,21,,108501,19592,XR2
22,,SING,C7,H7,no,N,22,,108501,19592,XR2
23,,DOUB,C8,C9,yes,N,23,,108501,19592,XR2
24,,SING,C8,H8,no,N,24,,108501,19592,XR2
25,,SING,C9,C9A,no,N,25,,108501,19592,XR2
26,,SING,C9A,H91,no,N,26,,108501,19592,XR2
27,,SING,C9A,H92,no,N,27,,108501,19592,XR2
28,,SING,C9A,H93,no,N,28,,108501,19592,XR2
29,,DOUB,C,O,no,N,29,,108501,19592,XR2
30,,SING,C,N,no,N,30,,108501,19592,XR2
31,,SING,N,CA,no,N,31,,108501,19592,XR2
32,,SING,N,HN,no,N,32,,108501,19592,XR2
33,,SING,CA,CB,no,N,33,,108501,19592,XR2
34,,SING,CA,HA1,no,N,34,,108501,19592,XR2
35,,SING,CA,HA2,no,N,35,,108501,19592,XR2
36,,SING,CB,NG,no,N,36,,108501,19592,XR2
37,,SING,CB,HB1,no,N,37,,108501,19592,XR2
38,,SING,CB,HB2,no,N,38,,108501,19592,XR2
39,,SING,NG,CD,no,N,39,,108501,19592,XR2
40,,SING,NG,HG1,no,N,40,,108501,19592,XR2
41,,SING,NG,HG2,no,N,41,,108501,19592,XR2
42,,SING,CD,CD',no,N,42,,108501,19592,XR2
43,,SING,CD,HD1,no,N,43,,108501,19592,XR2
44,,SING,CD,HD2,no,N,44,,108501,19592,XR2
45,,SING,N',C',no,N,45,,108501,19592,XR2
46,,SING,N',CA',no,N,46,,108501,19592,XR2
47,,SING,N',HN',no,N,47,,108501,19592,XR2
48,,DOUB,C',O',no,N,48,,108501,19592,XR2
49,,SING,C',C1',no,N,49,,108501,19592,XR2
50,,DOUB,C1',C2',yes,N,50,,108501,19592,XR2
51,,SING,C1',CBX,yes,N,51,,108501,19592,XR2
52,,SING,C2',C3',yes,N,52,,108501,19592,XR2
53,,SING,C2',H2',no,N,53,,108501,19592,XR2
54,,DOUB,C3',C4',yes,N,54,,108501,19592,XR2
55,,SING,C3',H3',no,N,55,,108501,19592,XR2
56,,SING,C4',CCX,yes,N,56,,108501,19592,XR2
57,,SING,C4',H4',no,N,57,,108501,19592,XR2
58,,DOUB,CCX,N5',yes,N,58,,108501,19592,XR2
59,,SING,CCX,CBX,yes,N,59,,108501,19592,XR2
60,,SING,N5',CDX,yes,N,60,,108501,19592,XR2
61,,DOUB,CDX,CEX,yes,N,61,,108501,19592,XR2
62,,SING,CDX,C6',yes,N,62,,108501,19592,XR2
63,,SING,CEX,NAX,yes,N,63,,108501,19592,XR2
64,,SING,CEX,C9',yes,N,64,,108501,19592,XR2
65,,DOUB,NAX,CBX,yes,N,65,,108501,19592,XR2
66,,SING,NAX,H10',no,N,66,,108501,19592,XR2
67,,DOUB,C9',C8',yes,N,67,,108501,19592,XR2
68,,SING,C9',C9X,no,N,68,,108501,19592,XR2
69,,SING,C8',C7',yes,N,69,,108501,19592,XR2
2,,SING,N,H,,,,,240393,6146,DHA_2
70,,SING,C8',H8',no,N,70,,108501,19592,XR2
71,,DOUB,C7',C6',yes,N,71,,108501,19592,XR2
72,,SING,C7',H7',no,N,72,,108501,19592,XR2
73,,SING,C6',H6',no,N,73,,108501,19592,XR2
74,,SING,C9X,H91',no,N,74,,108501,19592,XR2
75,,SING,C9X,H92',no,N,75,,108501,19592,XR2
76,,SING,C9X,H93',no,N,76,,108501,19592,XR2
77,,SING,CA',CB',no,N,77,,108501,19592,XR2
78,,SING,CA',HA1',no,N,78,,108501,19592,XR2
79,,SING,CA',HA2',no,N,79,,108501,19592,XR2
80,,SING,CB',NG',no,N,80,,108501,19592,XR2
81,,SING,CB',HB1',no,N,81,,108501,19592,XR2
82,,SING,CB',HB2',no,N,82,,108501,19592,XR2
83,,SING,NG',CD',no,N,83,,108501,19592,XR2
84,,SING,NG',HG1',no,N,84,,108501,19592,XR2
85,,SING,NG',HG2',no,N,85,,108501,19592,XR2
86,,SING,CD',HD1',no,N,86,,108501,19592,XR2
87,,SING,CD',HD2',no,N,87,,108501,19592,XR2
1,,SING,N,HN1,no,N,1,,108520,19593,NH2
2,,SING,N,HN2,no,N,2,,108520,19593,NH2
1,,DOUB,C4,C3,yes,N,1,,108541,19594,PQ3
2,,SING,C4,C5,yes,N,2,,108541,19594,PQ3
3,,SING,C3,C2,yes,N,3,,108541,19594,PQ3
4,,DOUB,O1,C6,no,N,4,,108541,19594,PQ3
5,,SING,C9,N3,no,N,5,,108541,19594,PQ3
6,,SING,C6,C5,no,N,6,,108541,19594,PQ3
7,,SING,C6,N2,no,N,7,,108541,19594,PQ3
8,,DOUB,C5,N1,yes,N,8,,108541,19594,PQ3
9,,DOUB,C2,C1,yes,N,9,,108541,19594,PQ3
10,,SING,C2,C17,yes,N,10,,108541,19594,PQ3
11,,SING,C1,C1',yes,N,11,,108541,19594,PQ3
12,,DOUB,C8,N3,yes,N,12,,108541,19594,PQ3
13,,SING,C8,C7,yes,N,13,,108541,19594,PQ3
14,,SING,N3,C10,yes,N,14,,108541,19594,PQ3
15,,SING,N2,C7,no,N,15,,108541,19594,PQ3
16,,SING,N1,C17,yes,N,16,,108541,19594,PQ3
17,,DOUB,C17,C17',yes,N,17,,108541,19594,PQ3
18,,DOUB,C1',C2',yes,N,18,,108541,19594,PQ3
19,,DOUB,C7,C16,yes,N,19,,108541,19594,PQ3
20,,DOUB,C10,C11,yes,N,20,,108541,19594,PQ3
21,,SING,C10,C15,yes,N,21,,108541,19594,PQ3
22,,SING,C11,C12,yes,N,22,,108541,19594,PQ3
23,,SING,C2',C17',yes,N,23,,108541,19594,PQ3
24,,SING,C2',C3',yes,N,24,,108541,19594,PQ3
25,,SING,C17',N1',yes,N,25,,108541,19594,PQ3
26,,SING,C16,C15,yes,N,26,,108541,19594,PQ3
27,,DOUB,C15,C14,yes,N,27,,108541,19594,PQ3
28,,DOUB,C3',C4',yes,N,28,,108541,19594,PQ3
29,,DOUB,N1',C5',yes,N,29,,108541,19594,PQ3
30,,DOUB,C12,C13,yes,N,30,,108541,19594,PQ3
31,,SING,C14,C13,yes,N,31,,108541,19594,PQ3
32,,SING,C5',C4',yes,N,32,,108541,19594,PQ3
33,,SING,C5',C6',no,N,33,,108541,19594,PQ3
34,,SING,N2',C6',no,N,34,,108541,19594,PQ3
35,,SING,N2',C7',no,N,35,,108541,19594,PQ3
36,,DOUB,C6',O1',no,N,36,,108541,19594,PQ3
37,,DOUB,C16',C7',yes,N,37,,108541,19594,PQ3
38,,SING,C16',C15',yes,N,38,,108541,19594,PQ3
39,,SING,C7',C8',yes,N,39,,108541,19594,PQ3
40,,DOUB,C14',C15',yes,N,40,,108541,19594,PQ3
41,,SING,C14',C13',yes,N,41,,108541,19594,PQ3
42,,SING,C15',C10',yes,N,42,,108541,19594,PQ3
43,,DOUB,C8',N3',yes,N,43,,108541,19594,PQ3
44,,DOUB,C13',C12',yes,N,44,,108541,19594,PQ3
45,,SING,C10',N3',yes,N,45,,108541,19594,PQ3
46,,DOUB,C10',C11',yes,N,46,,108541,19594,PQ3
47,,SING,N3',C9',no,N,47,,108541,19594,PQ3
48,,SING,C12',C11',yes,N,48,,108541,19594,PQ3
49,,SING,C4,HH,no,N,49,,108541,19594,PQ3
50,,SING,C3,HJ,no,N,50,,108541,19594,PQ3
51,,SING,C1,HK,no,N,51,,108541,19594,PQ3
52,,SING,C9,HI1,no,N,52,,108541,19594,PQ3
53,,SING,C9,HI2,no,N,53,,108541,19594,PQ3
54,,SING,C9,HI3,no,N,54,,108541,19594,PQ3
55,,SING,C13,HE,no,N,55,,108541,19594,PQ3
56,,SING,C1',HK',no,N,56,,108541,19594,PQ3
57,,SING,C3',HJ',no,N,57,,108541,19594,PQ3
58,,SING,C4',HH',no,N,58,,108541,19594,PQ3
59,,SING,C12,HF,no,N,59,,108541,19594,PQ3
60,,SING,C16',HB',no,N,60,,108541,19594,PQ3
61,,SING,C8',HC',no,N,61,,108541,19594,PQ3
62,,SING,C14',HD',no,N,62,,108541,19594,PQ3
63,,SING,C11,HG,no,N,63,,108541,19594,PQ3
64,,SING,C11',HG',no,N,64,,108541,19594,PQ3
65,,SING,C13',HE',no,N,65,,108541,19594,PQ3
66,,SING,C12',HF',no,N,66,,108541,19594,PQ3
67,,SING,C14,HD,no,N,67,,108541,19594,PQ3
68,,SING,C8,HC,no,N,68,,108541,19594,PQ3
69,,SING,C16,HB,no,N,69,,108541,19594,PQ3
70,,SING,C9',HI2',no,N,70,,108541,19594,PQ3
71,,SING,C9',HI3',no,N,71,,108541,19594,PQ3
72,,SING,C9',HI1',no,N,72,,108541,19594,PQ3
73,,SING,N2,HA,no,N,73,,108541,19594,PQ3
74,,SING,N2',HA',no,N,74,,108541,19594,PQ3
1,,SING,N,HN1,no,N,1,,108688,19602,NH2
2,,SING,N,HN2,no,N,2,,108688,19602,NH2
1,,DOUB,C,O,no,N,1,,108689,19602,ACE
2,,SING,C,CH3,no,N,2,,108689,19602,ACE
3,,SING,C,H,no,N,3,,108689,19602,ACE
4,,SING,CH3,H1,no,N,4,,108689,19602,ACE
5,,SING,CH3,H2,no,N,5,,108689,19602,ACE
6,,SING,CH3,H3,no,N,6,,108689,19602,ACE
1,,DOUB,C22,C23,yes,N,1,,108814,19608,PKA
2,,SING,C22,C21,yes,N,2,,108814,19608,PKA
3,,SING,C23,C24,yes,N,3,,108814,19608,PKA
4,,DOUB,C21,C20,yes,N,4,,108814,19608,PKA
5,,SING,C24,CL,no,N,5,,108814,19608,PKA
6,,DOUB,C24,C19,yes,N,6,,108814,19608,PKA
7,,DOUB,C14,C15,yes,N,7,,108814,19608,PKA
8,,SING,C14,C13,yes,N,8,,108814,19608,PKA
9,,SING,C20,C19,yes,N,9,,108814,19608,PKA
10,,SING,C15,C16,yes,N,10,,108814,19608,PKA
11,,SING,C19,C17,no,N,11,,108814,19608,PKA
12,,DOUB,C13,C12,yes,N,12,,108814,19608,PKA
13,,DOUB,C16,C17,yes,N,13,,108814,19608,PKA
14,,SING,C16,C11,yes,N,14,,108814,19608,PKA
15,,SING,C17,N18,yes,N,15,,108814,19608,PKA
16,,SING,C12,C11,yes,N,16,,108814,19608,PKA
17,,DOUB,C11,C10,yes,N,17,,108814,19608,PKA
18,,DOUB,N18,C9,yes,N,18,,108814,19608,PKA
19,,SING,C10,C9,yes,N,19,,108814,19608,PKA
20,,SING,C9,C7,no,N,20,,108814,19608,PKA
21,,SING,C1,C2,no,N,21,,108814,19608,PKA
22,,SING,C3,C4,no,N,22,,108814,19608,PKA
23,,SING,C3,C2,no,N,23,,108814,19608,PKA
24,,SING,C3,N5,no,N,24,,108814,19608,PKA
25,,SING,C7,N5,no,N,25,,108814,19608,PKA
26,,DOUB,C7,O8,no,N,26,,108814,19608,PKA
27,,SING,N5,C6,no,N,27,,108814,19608,PKA
28,,SING,C1,H1C,no,N,28,,108814,19608,PKA
29,,SING,C1,H1A,no,N,29,,108814,19608,PKA
30,,SING,C1,H1B,no,N,30,,108814,19608,PKA
31,,SING,C2,H2A,no,N,31,,108814,19608,PKA
32,,SING,C2,H2B,no,N,32,,108814,19608,PKA
33,,SING,C3,H3,no,N,33,,108814,19608,PKA
34,,SING,C4,H4C,no,N,34,,108814,19608,PKA
35,,SING,C4,H4A,no,N,35,,108814,19608,PKA
36,,SING,C4,H4B,no,N,36,,108814,19608,PKA
37,,SING,C6,H6A,no,N,37,,108814,19608,PKA
38,,SING,C6,H6B,no,N,38,,108814,19608,PKA
39,,SING,C6,H6C,no,N,39,,108814,19608,PKA
40,,SING,C10,H10,no,N,40,,108814,19608,PKA
41,,SING,C12,H12,no,N,41,,108814,19608,PKA
42,,SING,C13,H13,no,N,42,,108814,19608,PKA
43,,SING,C14,H14,no,N,43,,108814,19608,PKA
44,,SING,C15,H15,no,N,44,,108814,19608,PKA
45,,SING,C23,H23,no,N,45,,108814,19608,PKA
46,,SING,C20,H20,no,N,46,,108814,19608,PKA
47,,SING,C21,H21,no,N,47,,108814,19608,PKA
48,,SING,C22,H22,no,N,48,,108814,19608,PKA
1,,SING,N,CA,no,N,1,,109008,19619,DBU
2,,SING,N,H,no,N,2,,109008,19619,DBU
3,,SING,N,H2,no,N,3,,109008,19619,DBU
4,,DOUB,CA,CB,no,Z,4,,109008,19619,DBU
5,,SING,CA,C,no,N,5,,109008,19619,DBU
6,,SING,CB,CG,no,N,6,,109008,19619,DBU
7,,SING,CB,HB,no,N,7,,109008,19619,DBU
8,,SING,CG,HG1,no,N,8,,109008,19619,DBU
9,,SING,CG,HG2,no,N,9,,109008,19619,DBU
10,,SING,CG,HG3,no,N,10,,109008,19619,DBU
11,,DOUB,C,O,no,N,11,,109008,19619,DBU
12,,SING,C,OXT,no,N,12,,109008,19619,DBU
13,,SING,OXT,HXT,no,N,13,,109008,19619,DBU
1,,SING,N,CA,no,N,1,,109009,19619,DAL
2,,SING,N,H,no,N,2,,109009,19619,DAL
3,,SING,N,H2,no,N,3,,109009,19619,DAL
4,,SING,CA,CB,no,N,4,,109009,19619,DAL
5,,SING,CA,C,no,N,5,,109009,19619,DAL
6,,SING,CA,HA,no,N,6,,109009,19619,DAL
7,,SING,CB,HB1,no,N,7,,109009,19619,DAL
8,,SING,CB,HB2,no,N,8,,109009,19619,DAL
9,,SING,CB,HB3,no,N,9,,109009,19619,DAL
10,,DOUB,C,O,no,N,10,,109009,19619,DAL
11,,SING,C,OXT,no,N,11,,109009,19619,DAL
12,,SING,OXT,HXT,no,N,12,,109009,19619,DAL
1,,SING,N,CA,no,N,1,,109010,19619,DHA
2,,SING,N,H,no,N,2,,109010,19619,DHA
3,,SING,N,H2,no,N,3,,109010,19619,DHA
4,,DOUB,CA,CB,no,N,4,,109010,19619,DHA
5,,SING,CA,C,no,N,5,,109010,19619,DHA
6,,SING,CB,HB1,no,N,6,,109010,19619,DHA
7,,SING,CB,HB2,no,N,7,,109010,19619,DHA
8,,DOUB,C,O,no,N,8,,109010,19619,DHA
9,,SING,C,OXT,no,N,9,,109010,19619,DHA
10,,SING,OXT,HXT,no,N,10,,109010,19619,DHA
1,,SING,N,CA,no,N,1,,109011,19619,DBB
2,,SING,CA,C,no,N,2,,109011,19619,DBB
3,,SING,CA,CB,no,N,3,,109011,19619,DBB
4,,DOUB,C,O,no,N,4,,109011,19619,DBB
5,,SING,CB,CG,no,N,5,,109011,19619,DBB
6,,SING,C,OXT,no,N,6,,109011,19619,DBB
7,,SING,N,H,no,N,7,,109011,19619,DBB
8,,SING,N,H1,no,N,8,,109011,19619,DBB
9,,SING,CA,HA,no,N,9,,109011,19619,DBB
10,,SING,CB,HB2,no,N,10,,109011,19619,DBB
11,,SING,CB,HB3,no,N,11,,109011,19619,DBB
12,,SING,CG,HG1,no,N,12,,109011,19619,DBB
13,,SING,CG,HG2,no,N,13,,109011,19619,DBB
14,,SING,CG,HG3,no,N,14,,109011,19619,DBB
15,,SING,OXT,HXT,no,N,15,,109011,19619,DBB
1,,SING,N,CA,no,N,1,,109012,19619,HYP
2,,SING,N,CD,no,N,2,,109012,19619,HYP
3,,SING,N,H,no,N,3,,109012,19619,HYP
4,,SING,CA,C,no,N,4,,109012,19619,HYP
5,,SING,CA,CB,no,N,5,,109012,19619,HYP
6,,SING,CA,HA,no,N,6,,109012,19619,HYP
7,,DOUB,C,O,no,N,7,,109012,19619,HYP
8,,SING,C,OXT,no,N,8,,109012,19619,HYP
9,,SING,CB,CG,no,N,9,,109012,19619,HYP
10,,SING,CB,HB2,no,N,10,,109012,19619,HYP
11,,SING,CB,HB3,no,N,11,,109012,19619,HYP
12,,SING,CG,CD,no,N,12,,109012,19619,HYP
13,,SING,CG,OD1,no,N,13,,109012,19619,HYP
14,,SING,CG,HG,no,N,14,,109012,19619,HYP
15,,SING,CD,HD22,no,N,15,,109012,19619,HYP
16,,SING,CD,HD23,no,N,16,,109012,19619,HYP
17,,SING,OD1,HD1,no,N,17,,109012,19619,HYP
18,,SING,OXT,HXT,no,N,18,,109012,19619,HYP
1,,SING,N,CA,no,N,1,,109013,19619,TEE
2,,SING,N,HN1,no,N,2,,109013,19619,TEE
3,,SING,N,HN2,no,N,3,,109013,19619,TEE
4,,DOUB,CB,CA,no,N,4,,109013,19619,TEE
5,,SING,CB,SG,no,N,5,,109013,19619,TEE
6,,SING,CB,HB2,no,N,6,,109013,19619,TEE
7,,SING,CA,HA,no,N,7,,109013,19619,TEE
8,,SING,SG,HS,no,N,8,,109013,19619,TEE
1,,DOUB,CH2,CZ2,yes,N,1,,109014,19619,5CW
2,,SING,CH2,CZ3,yes,N,2,,109014,19619,5CW
3,,SING,CL1,CZ3,no,N,3,,109014,19619,5CW
4,,SING,CZ2,CE2,yes,N,4,,109014,19619,5CW
5,,DOUB,CZ3,CE3,yes,N,5,,109014,19619,5CW
6,,SING,CE2,NE1,yes,N,6,,109014,19619,5CW
7,,DOUB,CE2,CD2,yes,N,7,,109014,19619,5CW
8,,SING,CE3,CD2,yes,N,8,,109014,19619,5CW
9,,SING,NE1,CD1,yes,N,9,,109014,19619,5CW
10,,SING,CD2,CG,yes,N,10,,109014,19619,5CW
11,,DOUB,CD1,CG,yes,N,11,,109014,19619,5CW
12,,SING,CG,CB,no,N,12,,109014,19619,5CW
13,,SING,CB,CA,no,N,13,,109014,19619,5CW
14,,SING,N,CA,no,N,14,,109014,19619,5CW
15,,SING,CA,C,no,N,15,,109014,19619,5CW
16,,DOUB,C,O,no,N,16,,109014,19619,5CW
17,,SING,N,H,no,N,17,,109014,19619,5CW
18,,SING,N,H2,no,N,18,,109014,19619,5CW
19,,SING,CA,HA,no,N,19,,109014,19619,5CW
20,,SING,CB,HB2,no,N,20,,109014,19619,5CW
21,,SING,CB,HB3,no,N,21,,109014,19619,5CW
22,,SING,CD1,HD1,no,N,22,,109014,19619,5CW
23,,SING,CE3,HE3,no,N,23,,109014,19619,5CW
24,,SING,NE1,HE1,no,N,24,,109014,19619,5CW
25,,SING,CZ2,HZ2,no,N,25,,109014,19619,5CW
26,,SING,CH2,HH2,no,N,26,,109014,19619,5CW
27,,SING,C,OXT,no,N,27,,109014,19619,5CW
28,,SING,OXT,HXT,no,N,28,,109014,19619,5CW
1,,DOUB,OP1,P,no,N,1,,109035,19620,EDI
2,,SING,C5',C4',no,N,2,,109035,19620,EDI
3,,SING,C5',O5',no,N,3,,109035,19620,EDI
4,,SING,P,O5',no,N,4,,109035,19620,EDI
5,,SING,P,OP2,no,N,5,,109035,19620,EDI
6,,SING,C4',O4',no,N,6,,109035,19620,EDI
7,,SING,C4',C3',no,N,7,,109035,19620,EDI
8,,SING,O4',C1',no,N,8,,109035,19620,EDI
9,,SING,C3',O3',no,N,9,,109035,19620,EDI
10,,SING,C3',C2',no,N,10,,109035,19620,EDI
11,,SING,C1',N9,no,N,11,,109035,19620,EDI
12,,SING,C1',C2',no,N,12,,109035,19620,EDI
13,,SING,N9,C8,yes,N,13,,109035,19620,EDI
14,,SING,N9,C4,yes,N,14,,109035,19620,EDI
15,,DOUB,C8,N7,yes,N,15,,109035,19620,EDI
16,,SING,N3,C4,no,N,16,,109035,19620,EDI
17,,DOUB,N3,C2,no,N,17,,109035,19620,EDI
18,,DOUB,C4,C5,yes,N,18,,109035,19620,EDI
19,,SING,C2,N1,no,N,19,,109035,19620,EDI
20,,SING,N7,C5,yes,N,20,,109035,19620,EDI
21,,SING,C5,C6,no,N,21,,109035,19620,EDI
22,,SING,N1,C6,no,N,22,,109035,19620,EDI
23,,SING,N1,C12,no,N,23,,109035,19620,EDI
24,,DOUB,C6,O6,no,N,24,,109035,19620,EDI
25,,SING,C12,C11,no,N,25,,109035,19620,EDI
26,,SING,P,OP3,no,N,26,,109035,19620,EDI
27,,SING,OP2,H1,no,N,27,,109035,19620,EDI
28,,SING,C5',H5',no,N,28,,109035,19620,EDI
29,,SING,C5',H5'',no,N,29,,109035,19620,EDI
30,,SING,C4',H4',no,N,30,,109035,19620,EDI
31,,SING,C3',H3',no,N,31,,109035,19620,EDI
32,,SING,O3',H3,no,N,32,,109035,19620,EDI
33,,SING,C2',H2',no,N,33,,109035,19620,EDI
34,,SING,C2',H2'',no,N,34,,109035,19620,EDI
35,,SING,C1',H1',no,N,35,,109035,19620,EDI
36,,SING,C8,H8,no,N,36,,109035,19620,EDI
37,,SING,C2,H2,no,N,37,,109035,19620,EDI
38,,SING,C11,H11,no,N,38,,109035,19620,EDI
39,,SING,C11,H12,no,N,39,,109035,19620,EDI
40,,SING,C12,H15,no,N,40,,109035,19620,EDI
41,,SING,C12,H14,no,N,41,,109035,19620,EDI
42,,SING,OP3,H5,no,N,42,,109035,19620,EDI
43,,SING,C11,I1,no,N,43,,109035,19620,EDI
1,,SING,FE1,S1,no,N,1,,109079,19622,FES
2,,SING,FE1,S2,no,N,2,,109079,19622,FES
3,,SING,FE2,S1,no,N,3,,109079,19622,FES
4,,SING,FE2,S2,no,N,4,,109079,19622,FES
1,,DOUB,CHA,C1A,no,Z,1,,109209,19629,CYC
2,,SING,CHA,C4D,no,N,2,,109209,19629,CYC
3,,SING,CHA,HHA,no,N,3,,109209,19629,CYC
4,,SING,NA,C1A,no,N,4,,109209,19629,CYC
5,,DOUB,NA,C4A,no,N,5,,109209,19629,CYC
6,,SING,C1A,C2A,no,N,6,,109209,19629,CYC
7,,DOUB,C2A,C3A,no,N,7,,109209,19629,CYC
8,,SING,C2A,CAA,no,N,8,,109209,19629,CYC
9,,SING,C3A,C4A,no,N,9,,109209,19629,CYC
10,,SING,C3A,CMA,no,N,10,,109209,19629,CYC
11,,SING,C4A,CHB,no,N,11,,109209,19629,CYC
12,,SING,CMA,HMA1,no,N,12,,109209,19629,CYC
13,,SING,CMA,HMA2,no,N,13,,109209,19629,CYC
14,,SING,CMA,HMA3,no,N,14,,109209,19629,CYC
15,,SING,CAA,CBA,no,N,15,,109209,19629,CYC
16,,SING,CAA,HAA1,no,N,16,,109209,19629,CYC
17,,SING,CAA,HAA2,no,N,17,,109209,19629,CYC
18,,SING,CBA,CGA,no,N,18,,109209,19629,CYC
19,,SING,CBA,HBA1,no,N,19,,109209,19629,CYC
20,,SING,CBA,HBA2,no,N,20,,109209,19629,CYC
21,,DOUB,CGA,O1A,no,N,21,,109209,19629,CYC
22,,SING,CGA,O2A,no,N,22,,109209,19629,CYC
23,,SING,O2A,H2A,no,N,23,,109209,19629,CYC
24,,DOUB,CHB,C1B,no,Z,24,,109209,19629,CYC
25,,SING,CHB,HHB,no,N,25,,109209,19629,CYC
26,,SING,NB,C1B,no,N,26,,109209,19629,CYC
27,,SING,NB,C4B,no,N,27,,109209,19629,CYC
28,,SING,NB,HB,no,N,28,,109209,19629,CYC
29,,SING,C1B,C2B,no,N,29,,109209,19629,CYC
30,,DOUB,C2B,C3B,no,N,30,,109209,19629,CYC
31,,SING,C2B,CMB,no,N,31,,109209,19629,CYC
32,,SING,C3B,C4B,no,N,32,,109209,19629,CYC
33,,SING,C3B,CAB,no,N,33,,109209,19629,CYC
34,,DOUB,C4B,OB,no,N,34,,109209,19629,CYC
35,,SING,CMB,HMB1,no,N,35,,109209,19629,CYC
36,,SING,CMB,HMB2,no,N,36,,109209,19629,CYC
37,,SING,CMB,HMB3,no,N,37,,109209,19629,CYC
38,,SING,CAB,CBB,no,N,38,,109209,19629,CYC
39,,SING,CAB,HAB1,no,N,39,,109209,19629,CYC
40,,SING,CAB,HAB2,no,N,40,,109209,19629,CYC
41,,SING,CBB,HBB1,no,N,41,,109209,19629,CYC
42,,SING,CBB,HBB2,no,N,42,,109209,19629,CYC
43,,SING,CBB,HBB3,no,N,43,,109209,19629,CYC
44,,SING,NC,C1C,no,N,44,,109209,19629,CYC
45,,SING,NC,C4C,no,N,45,,109209,19629,CYC
46,,SING,NC,HC,no,N,46,,109209,19629,CYC
47,,SING,C1C,C2C,no,N,47,,109209,19629,CYC
48,,DOUB,C1C,OC,no,N,48,,109209,19629,CYC
49,,SING,C2C,C3C,no,N,49,,109209,19629,CYC
50,,SING,C2C,CMC,no,N,50,,109209,19629,CYC
51,,SING,C2C,H2C,no,N,51,,109209,19629,CYC
52,,SING,C3C,C4C,no,N,52,,109209,19629,CYC
53,,SING,C3C,CAC,no,N,53,,109209,19629,CYC
54,,SING,C3C,H3C,no,N,54,,109209,19629,CYC
55,,DOUB,C4C,CHD,no,Z,55,,109209,19629,CYC
56,,SING,CMC,HMC1,no,N,56,,109209,19629,CYC
57,,SING,CMC,HMC2,no,N,57,,109209,19629,CYC
58,,SING,CMC,HMC3,no,N,58,,109209,19629,CYC
59,,SING,CAC,CBC,no,N,59,,109209,19629,CYC
60,,SING,CAC,HAC1,no,N,60,,109209,19629,CYC
61,,SING,CAC,HAC2,no,N,61,,109209,19629,CYC
62,,SING,CBC,HBC1,no,N,62,,109209,19629,CYC
63,,SING,CBC,HBC2,no,N,63,,109209,19629,CYC
64,,SING,CBC,HBC3,no,N,64,,109209,19629,CYC
65,,SING,CHD,C1D,no,N,65,,109209,19629,CYC
66,,SING,CHD,HHD,no,N,66,,109209,19629,CYC
67,,SING,ND,C1D,yes,N,67,,109209,19629,CYC
68,,SING,ND,C4D,yes,N,68,,109209,19629,CYC
69,,SING,ND,HD,no,N,69,,109209,19629,CYC
70,,DOUB,C1D,C2D,yes,N,70,,109209,19629,CYC
71,,SING,C2D,C3D,yes,N,71,,109209,19629,CYC
72,,SING,C2D,CMD,no,N,72,,109209,19629,CYC
73,,DOUB,C3D,C4D,yes,N,73,,109209,19629,CYC
74,,SING,C3D,CAD,no,N,74,,109209,19629,CYC
75,,SING,CMD,HMD1,no,N,75,,109209,19629,CYC
76,,SING,CMD,HMD2,no,N,76,,109209,19629,CYC
77,,SING,CMD,HMD3,no,N,77,,109209,19629,CYC
78,,SING,CAD,CBD,no,N,78,,109209,19629,CYC
79,,SING,CAD,HAD1,no,N,79,,109209,19629,CYC
80,,SING,CAD,HAD2,no,N,80,,109209,19629,CYC
81,,SING,CBD,CGD,no,N,81,,109209,19629,CYC
82,,SING,CBD,HBD1,no,N,82,,109209,19629,CYC
83,,SING,CBD,HBD2,no,N,83,,109209,19629,CYC
84,,DOUB,CGD,O1D,no,N,84,,109209,19629,CYC
85,,SING,CGD,O2D,no,N,85,,109209,19629,CYC
86,,SING,O2D,H2D,no,N,86,,109209,19629,CYC
1,,SING,FE,NA,no,N,1,,109328,19638,HEC
2,,SING,FE,NB,no,N,2,,109328,19638,HEC
3,,SING,FE,NC,no,N,3,,109328,19638,HEC
4,,SING,FE,ND,no,N,4,,109328,19638,HEC
5,,DOUB,CHA,C1A,no,N,5,,109328,19638,HEC
6,,SING,CHA,C4D,no,N,6,,109328,19638,HEC
7,,SING,CHA,HHA,no,N,7,,109328,19638,HEC
8,,DOUB,CHB,C4A,no,N,8,,109328,19638,HEC
9,,SING,CHB,C1B,no,N,9,,109328,19638,HEC
10,,SING,CHB,HHB,no,N,10,,109328,19638,HEC
11,,DOUB,CHC,C4B,no,N,11,,109328,19638,HEC
12,,SING,CHC,C1C,no,N,12,,109328,19638,HEC
13,,SING,CHC,HHC,no,N,13,,109328,19638,HEC
14,,DOUB,CHD,C4C,no,N,14,,109328,19638,HEC
15,,SING,CHD,C1D,no,N,15,,109328,19638,HEC
16,,SING,CHD,HHD,no,N,16,,109328,19638,HEC
17,,SING,NA,C1A,yes,N,17,,109328,19638,HEC
18,,SING,NA,C4A,yes,N,18,,109328,19638,HEC
19,,SING,C1A,C2A,yes,N,19,,109328,19638,HEC
20,,DOUB,C2A,C3A,yes,N,20,,109328,19638,HEC
21,,SING,C2A,CAA,no,N,21,,109328,19638,HEC
22,,SING,C3A,C4A,yes,N,22,,109328,19638,HEC
23,,SING,C3A,CMA,no,N,23,,109328,19638,HEC
24,,SING,CMA,HMA1,no,N,24,,109328,19638,HEC
25,,SING,CMA,HMA2,no,N,25,,109328,19638,HEC
26,,SING,CMA,HMA3,no,N,26,,109328,19638,HEC
27,,SING,CAA,CBA,no,N,27,,109328,19638,HEC
28,,SING,CAA,HAA1,no,N,28,,109328,19638,HEC
29,,SING,CAA,HAA2,no,N,29,,109328,19638,HEC
30,,SING,CBA,CGA,no,N,30,,109328,19638,HEC
31,,SING,CBA,HBA1,no,N,31,,109328,19638,HEC
32,,SING,CBA,HBA2,no,N,32,,109328,19638,HEC
33,,DOUB,CGA,O1A,no,N,33,,109328,19638,HEC
34,,SING,CGA,O2A,no,N,34,,109328,19638,HEC
35,,SING,O2A,H2A,no,N,35,,109328,19638,HEC
36,,SING,NB,C1B,yes,N,36,,109328,19638,HEC
37,,SING,NB,C4B,yes,N,37,,109328,19638,HEC
38,,DOUB,C1B,C2B,yes,N,38,,109328,19638,HEC
39,,SING,C2B,C3B,yes,N,39,,109328,19638,HEC
40,,SING,C2B,CMB,no,N,40,,109328,19638,HEC
41,,SING,C3B,C4B,yes,N,41,,109328,19638,HEC
42,,DOUB,C3B,CAB,no,E,42,,109328,19638,HEC
43,,SING,CMB,HMB1,no,N,43,,109328,19638,HEC
44,,SING,CMB,HMB2,no,N,44,,109328,19638,HEC
45,,SING,CMB,HMB3,no,N,45,,109328,19638,HEC
46,,SING,CAB,CBB,no,N,46,,109328,19638,HEC
47,,SING,CAB,HAB,no,N,47,,109328,19638,HEC
48,,SING,CBB,HBB1,no,N,48,,109328,19638,HEC
49,,SING,CBB,HBB2,no,N,49,,109328,19638,HEC
50,,SING,CBB,HBB3,no,N,50,,109328,19638,HEC
51,,SING,NC,C1C,yes,N,51,,109328,19638,HEC
52,,SING,NC,C4C,yes,N,52,,109328,19638,HEC
53,,DOUB,C1C,C2C,yes,N,53,,109328,19638,HEC
54,,SING,C2C,C3C,yes,N,54,,109328,19638,HEC
55,,SING,C2C,CMC,no,N,55,,109328,19638,HEC
56,,SING,C3C,C4C,yes,N,56,,109328,19638,HEC
57,,DOUB,C3C,CAC,no,E,57,,109328,19638,HEC
58,,SING,CMC,HMC1,no,N,58,,109328,19638,HEC
59,,SING,CMC,HMC2,no,N,59,,109328,19638,HEC
60,,SING,CMC,HMC3,no,N,60,,109328,19638,HEC
61,,SING,CAC,CBC,no,N,61,,109328,19638,HEC
62,,SING,CAC,HAC,no,N,62,,109328,19638,HEC
63,,SING,CBC,HBC1,no,N,63,,109328,19638,HEC
64,,SING,CBC,HBC2,no,N,64,,109328,19638,HEC
65,,SING,CBC,HBC3,no,N,65,,109328,19638,HEC
66,,SING,ND,C1D,yes,N,66,,109328,19638,HEC
67,,SING,ND,C4D,yes,N,67,,109328,19638,HEC
68,,DOUB,C1D,C2D,yes,N,68,,109328,19638,HEC
69,,SING,C2D,C3D,yes,N,69,,109328,19638,HEC
70,,SING,C2D,CMD,no,N,70,,109328,19638,HEC
71,,DOUB,C3D,C4D,yes,N,71,,109328,19638,HEC
72,,SING,C3D,CAD,no,N,72,,109328,19638,HEC
73,,SING,CMD,HMD1,no,N,73,,109328,19638,HEC
74,,SING,CMD,HMD2,no,N,74,,109328,19638,HEC
75,,SING,CMD,HMD3,no,N,75,,109328,19638,HEC
76,,SING,CAD,CBD,no,N,76,,109328,19638,HEC
77,,SING,CAD,HAD1,no,N,77,,109328,19638,HEC
78,,SING,CAD,HAD2,no,N,78,,109328,19638,HEC
79,,SING,CBD,CGD,no,N,79,,109328,19638,HEC
80,,SING,CBD,HBD1,no,N,80,,109328,19638,HEC
81,,SING,CBD,HBD2,no,N,81,,109328,19638,HEC
82,,DOUB,CGD,O1D,no,N,82,,109328,19638,HEC
83,,SING,CGD,O2D,no,N,83,,109328,19638,HEC
84,,SING,O2D,H2D,no,N,84,,109328,19638,HEC
1,,SING,N,CA,no,N,1,,109591,19655,PTR
2,,SING,N,H,no,N,2,,109591,19655,PTR
3,,SING,N,HN2,no,N,3,,109591,19655,PTR
4,,SING,CA,C,no,N,4,,109591,19655,PTR
5,,SING,CA,CB,no,N,5,,109591,19655,PTR
6,,SING,CA,HA,no,N,6,,109591,19655,PTR
7,,DOUB,C,O,no,N,7,,109591,19655,PTR
8,,SING,C,OXT,no,N,8,,109591,19655,PTR
9,,SING,OXT,HXT,no,N,9,,109591,19655,PTR
10,,SING,CB,CG,no,N,10,,109591,19655,PTR
11,,SING,CB,HB2,no,N,11,,109591,19655,PTR
12,,SING,CB,HB3,no,N,12,,109591,19655,PTR
13,,DOUB,CG,CD1,yes,N,13,,109591,19655,PTR
14,,SING,CG,CD2,yes,N,14,,109591,19655,PTR
15,,SING,CD1,CE1,yes,N,15,,109591,19655,PTR
16,,SING,CD1,HD1,no,N,16,,109591,19655,PTR
17,,DOUB,CD2,CE2,yes,N,17,,109591,19655,PTR
18,,SING,CD2,HD2,no,N,18,,109591,19655,PTR
19,,DOUB,CE1,CZ,yes,N,19,,109591,19655,PTR
20,,SING,CE1,HE1,no,N,20,,109591,19655,PTR
21,,SING,CE2,CZ,yes,N,21,,109591,19655,PTR
22,,SING,CE2,HE2,no,N,22,,109591,19655,PTR
23,,SING,CZ,OH,no,N,23,,109591,19655,PTR
24,,SING,OH,P,no,N,24,,109591,19655,PTR
25,,DOUB,P,O1P,no,N,25,,109591,19655,PTR
26,,SING,P,O2P,no,N,26,,109591,19655,PTR
27,,SING,P,O3P,no,N,27,,109591,19655,PTR
28,,SING,O2P,HO2P,no,N,28,,109591,19655,PTR
29,,SING,O3P,HO3P,no,N,29,,109591,19655,PTR
1,,SING,N,CA,no,N,1,,109610,19656,PTR
2,,SING,N,H,no,N,2,,109610,19656,PTR
3,,SING,N,HN2,no,N,3,,109610,19656,PTR
4,,SING,CA,C,no,N,4,,109610,19656,PTR
5,,SING,CA,CB,no,N,5,,109610,19656,PTR
6,,SING,CA,HA,no,N,6,,109610,19656,PTR
7,,DOUB,C,O,no,N,7,,109610,19656,PTR
8,,SING,C,OXT,no,N,8,,109610,19656,PTR
9,,SING,OXT,HXT,no,N,9,,109610,19656,PTR
10,,SING,CB,CG,no,N,10,,109610,19656,PTR
11,,SING,CB,HB2,no,N,11,,109610,19656,PTR
12,,SING,CB,HB3,no,N,12,,109610,19656,PTR
13,,DOUB,CG,CD1,yes,N,13,,109610,19656,PTR
14,,SING,CG,CD2,yes,N,14,,109610,19656,PTR
15,,SING,CD1,CE1,yes,N,15,,109610,19656,PTR
16,,SING,CD1,HD1,no,N,16,,109610,19656,PTR
17,,DOUB,CD2,CE2,yes,N,17,,109610,19656,PTR
18,,SING,CD2,HD2,no,N,18,,109610,19656,PTR
19,,DOUB,CE1,CZ,yes,N,19,,109610,19656,PTR
20,,SING,CE1,HE1,no,N,20,,109610,19656,PTR
21,,SING,CE2,CZ,yes,N,21,,109610,19656,PTR
22,,SING,CE2,HE2,no,N,22,,109610,19656,PTR
23,,SING,CZ,OH,no,N,23,,109610,19656,PTR
24,,SING,OH,P,no,N,24,,109610,19656,PTR
25,,DOUB,P,O1P,no,N,25,,109610,19656,PTR
26,,SING,P,O2P,no,N,26,,109610,19656,PTR
27,,SING,P,O3P,no,N,27,,109610,19656,PTR
28,,SING,O2P,HO2P,no,N,28,,109610,19656,PTR
29,,SING,O3P,HO3P,no,N,29,,109610,19656,PTR
1,,SING,OG,CG,no,N,1,,109664,19659,RBD
2,,SING,CD,CG,no,N,2,,109664,19659,RBD
3,,SING,CD,N6,no,N,3,,109664,19659,RBD
4,,SING,CG,CB,no,N,4,,109664,19659,RBD
5,,SING,CB,OB,no,N,5,,109664,19659,RBD
6,,SING,CB,CA,no,N,6,,109664,19659,RBD
7,,SING,N6,C6,no,N,7,,109664,19659,RBD
8,,SING,N6,CA,no,N,8,,109664,19659,RBD
9,,DOUB,C6,C5,yes,N,9,,109664,19659,RBD
10,,SING,C6,N1,yes,N,10,,109664,19659,RBD
11,,SING,N7,C5,yes,N,11,,109664,19659,RBD
12,,DOUB,N7,C8,yes,N,12,,109664,19659,RBD
13,,SING,C5,C4,yes,N,13,,109664,19659,RBD
14,,DOUB,N1,C2,yes,N,14,,109664,19659,RBD
15,,SING,C8,N9,yes,N,15,,109664,19659,RBD
16,,SING,C2',C1',no,N,16,,109664,19659,RBD
17,,SING,C2',C3',no,N,17,,109664,19659,RBD
18,,SING,C4,N9,yes,N,18,,109664,19659,RBD
19,,DOUB,C4,N3,yes,N,19,,109664,19659,RBD
20,,SING,C2,N3,yes,N,20,,109664,19659,RBD
21,,SING,N9,C1',no,N,21,,109664,19659,RBD
22,,SING,C1',O4',no,N,22,,109664,19659,RBD
23,,SING,O3',C3',no,N,23,,109664,19659,RBD
24,,SING,C3',C4',no,N,24,,109664,19659,RBD
25,,SING,O2P,P,no,N,25,,109664,19659,RBD
26,,SING,O4',C4',no,N,26,,109664,19659,RBD
27,,SING,O5',P,no,N,27,,109664,19659,RBD
28,,SING,O5',C5',no,N,28,,109664,19659,RBD
29,,SING,C4',C5',no,N,29,,109664,19659,RBD
30,,SING,P,O1P,no,N,30,,109664,19659,RBD
31,,SING,O1P,H1,no,N,31,,109664,19659,RBD
32,,SING,O2P,H3,no,N,32,,109664,19659,RBD
33,,SING,C5',H5'2,no,N,33,,109664,19659,RBD
34,,SING,C5',H5'1,no,N,34,,109664,19659,RBD
35,,SING,C4',H4',no,N,35,,109664,19659,RBD
36,,SING,C1',H1',no,N,36,,109664,19659,RBD
37,,SING,C8,H8,no,N,37,,109664,19659,RBD
38,,SING,CA,HA2,no,N,38,,109664,19659,RBD
39,,SING,CA,HA1,no,N,39,,109664,19659,RBD
40,,SING,CB,HB,no,N,40,,109664,19659,RBD
41,,SING,OB,HOB,no,N,41,,109664,19659,RBD
42,,SING,CG,HG,no,N,42,,109664,19659,RBD
43,,SING,OG,HOG,no,N,43,,109664,19659,RBD
44,,SING,CD,HD1,no,N,44,,109664,19659,RBD
45,,SING,CD,HD2,no,N,45,,109664,19659,RBD
46,,SING,C2,H2,no,N,46,,109664,19659,RBD
47,,SING,C3',H3',no,N,47,,109664,19659,RBD
48,,SING,C2',H2'1,no,N,48,,109664,19659,RBD
49,,SING,C2',H2'2,no,N,49,,109664,19659,RBD
50,,SING,O3',H4,no,N,50,,109664,19659,RBD
51,,SING,P,O3P,no,N,51,,109664,19659,RBD
52,,SING,P,H5,no,N,52,,109664,19659,RBD
53,,SING,O3P,H6,no,N,53,,109664,19659,RBD
1,,SING,OG,CG,no,N,1,,109707,19661,SDE
2,,SING,CD,CG,no,N,2,,109707,19661,SDE
3,,SING,CD,N6,no,N,3,,109707,19661,SDE
4,,SING,CG,CB,no,N,4,,109707,19661,SDE
5,,SING,O2P,P,no,N,5,,109707,19661,SDE
6,,DOUB,N7,C8,yes,N,6,,109707,19661,SDE
7,,SING,N7,C5,yes,N,7,,109707,19661,SDE
8,,SING,C8,N9,yes,N,8,,109707,19661,SDE
9,,SING,N6,C6,no,N,9,,109707,19661,SDE
10,,SING,N6,CA,no,N,10,,109707,19661,SDE
11,,SING,C2',C1',no,N,11,,109707,19661,SDE
12,,SING,C2',C3',no,N,12,,109707,19661,SDE
13,,DOUB,C5,C6,yes,N,13,,109707,19661,SDE
14,,SING,C5,C4,yes,N,14,,109707,19661,SDE
15,,SING,CB,OB,no,N,15,,109707,19661,SDE
16,,SING,CB,CA,no,N,16,,109707,19661,SDE
17,,SING,C6,N1,yes,N,17,,109707,19661,SDE
18,,SING,N9,C4,yes,N,18,,109707,19661,SDE
19,,SING,N9,C1',no,N,19,,109707,19661,SDE
20,,DOUB,C4,N3,yes,N,20,,109707,19661,SDE
21,,DOUB,N1,C2,yes,N,21,,109707,19661,SDE
22,,SING,C1',O4',no,N,22,,109707,19661,SDE
23,,SING,C3',O3',no,N,23,,109707,19661,SDE
24,,SING,C3',C4',no,N,24,,109707,19661,SDE
25,,SING,P,O5',no,N,25,,109707,19661,SDE
26,,SING,P,O1P,no,N,26,,109707,19661,SDE
27,,SING,N3,C2,yes,N,27,,109707,19661,SDE
28,,SING,O5',C5',no,N,28,,109707,19661,SDE
3,,DOUB,CA,CB,,,,,240393,6146,DHA_2
29,,SING,C4',O4',no,N,29,,109707,19661,SDE
30,,SING,C4',C5',no,N,30,,109707,19661,SDE
31,,SING,O1P,H1,no,N,31,,109707,19661,SDE
32,,SING,O2P,H3,no,N,32,,109707,19661,SDE
33,,SING,C5',H5'2,no,N,33,,109707,19661,SDE
34,,SING,C5',H5'1,no,N,34,,109707,19661,SDE
35,,SING,C4',H4',no,N,35,,109707,19661,SDE
36,,SING,C1',H1',no,N,36,,109707,19661,SDE
37,,SING,C8,H8,no,N,37,,109707,19661,SDE
38,,SING,CA,HA2,no,N,38,,109707,19661,SDE
39,,SING,CA,HA1,no,N,39,,109707,19661,SDE
40,,SING,CB,HB,no,N,40,,109707,19661,SDE
41,,SING,OB,HOB,no,N,41,,109707,19661,SDE
42,,SING,CG,HG,no,N,42,,109707,19661,SDE
43,,SING,OG,HOG,no,N,43,,109707,19661,SDE
44,,SING,CD,HD1,no,N,44,,109707,19661,SDE
45,,SING,CD,HD2,no,N,45,,109707,19661,SDE
46,,SING,C2,H2,no,N,46,,109707,19661,SDE
47,,SING,C3',H3',no,N,47,,109707,19661,SDE
48,,SING,C2',H2'2,no,N,48,,109707,19661,SDE
49,,SING,C2',H2'1,no,N,49,,109707,19661,SDE
50,,SING,O3',H4,no,N,50,,109707,19661,SDE
51,,SING,P,O3P,no,N,51,,109707,19661,SDE
52,,SING,P,H5,no,N,52,,109707,19661,SDE
53,,SING,O3P,H6,no,N,53,,109707,19661,SDE
1,,DOUB,O3,C13,no,N,1,,109779,19664,SFQ
2,,SING,C13,O4,no,N,2,,109779,19664,SFQ
3,,SING,C13,C8,no,N,3,,109779,19664,SFQ
4,,DOUB,C8,C9,yes,N,4,,109779,19664,SFQ
5,,SING,C8,C7,yes,N,5,,109779,19664,SFQ
6,,SING,C9,C10,yes,N,6,,109779,19664,SFQ
7,,DOUB,C10,C11,yes,N,7,,109779,19664,SFQ
8,,SING,C11,C12,yes,N,8,,109779,19664,SFQ
9,,DOUB,C12,C7,yes,N,9,,109779,19664,SFQ
10,,SING,C7,N1,no,N,10,,109779,19664,SFQ
11,,SING,N1,S1,no,N,11,,109779,19664,SFQ
12,,DOUB,S1,O1,no,N,12,,109779,19664,SFQ
13,,DOUB,S1,O2,no,N,13,,109779,19664,SFQ
14,,SING,S1,C4,no,N,14,,109779,19664,SFQ
15,,DOUB,C4,C2,yes,N,15,,109779,19664,SFQ
16,,SING,C4,C5,yes,N,16,,109779,19664,SFQ
17,,SING,C2,C1,yes,N,17,,109779,19664,SFQ
18,,DOUB,C1,C3,yes,N,18,,109779,19664,SFQ
19,,SING,C3,I1,no,N,19,,109779,19664,SFQ
20,,SING,C3,C6,yes,N,20,,109779,19664,SFQ
21,,DOUB,C6,C5,yes,N,21,,109779,19664,SFQ
22,,SING,O4,H1,no,N,22,,109779,19664,SFQ
23,,SING,C9,H9,no,N,23,,109779,19664,SFQ
24,,SING,C10,H10,no,N,24,,109779,19664,SFQ
25,,SING,C11,H11,no,N,25,,109779,19664,SFQ
26,,SING,C12,H12,no,N,26,,109779,19664,SFQ
27,,SING,N1,H14,no,N,27,,109779,19664,SFQ
28,,SING,C2,H2,no,N,28,,109779,19664,SFQ
29,,SING,C1,H13,no,N,29,,109779,19664,SFQ
30,,SING,C6,H6,no,N,30,,109779,19664,SFQ
31,,SING,C5,H5,no,N,31,,109779,19664,SFQ
1,,SING,N,CA,no,N,1,,110025,1968,NLE
2,,SING,N,H,no,N,2,,110025,1968,NLE
3,,SING,N,HN2,no,N,3,,110025,1968,NLE
4,,SING,CA,C,no,N,4,,110025,1968,NLE
5,,SING,CA,CB,no,N,5,,110025,1968,NLE
6,,SING,CA,HA,no,N,6,,110025,1968,NLE
7,,DOUB,C,O,no,N,7,,110025,1968,NLE
8,,SING,C,OXT,no,N,8,,110025,1968,NLE
9,,SING,OXT,HXT,no,N,9,,110025,1968,NLE
10,,SING,CB,CG,no,N,10,,110025,1968,NLE
11,,SING,CB,HB2,no,N,11,,110025,1968,NLE
12,,SING,CB,HB3,no,N,12,,110025,1968,NLE
13,,SING,CG,CD,no,N,13,,110025,1968,NLE
14,,SING,CG,HG2,no,N,14,,110025,1968,NLE
15,,SING,CG,HG3,no,N,15,,110025,1968,NLE
16,,SING,CD,CE,no,N,16,,110025,1968,NLE
17,,SING,CD,HD2,no,N,17,,110025,1968,NLE
18,,SING,CD,HD3,no,N,18,,110025,1968,NLE
19,,SING,CE,HE1,no,N,19,,110025,1968,NLE
20,,SING,CE,HE2,no,N,20,,110025,1968,NLE
21,,SING,CE,HE3,no,N,21,,110025,1968,NLE
1,,SING,C1,C2,no,N,1,,110109,19683,entity_GLC
2,,SING,C1,O1,no,N,2,,110109,19683,entity_GLC
3,,SING,C1,O5,no,N,3,,110109,19683,entity_GLC
4,,SING,C1,H1,no,N,4,,110109,19683,entity_GLC
5,,SING,C2,C3,no,N,5,,110109,19683,entity_GLC
6,,SING,C2,O2,no,N,6,,110109,19683,entity_GLC
7,,SING,C2,H2,no,N,7,,110109,19683,entity_GLC
8,,SING,C3,C4,no,N,8,,110109,19683,entity_GLC
9,,SING,C3,O3,no,N,9,,110109,19683,entity_GLC
10,,SING,C3,H3,no,N,10,,110109,19683,entity_GLC
11,,SING,C4,C5,no,N,11,,110109,19683,entity_GLC
12,,SING,C4,O4,no,N,12,,110109,19683,entity_GLC
13,,SING,C4,H4,no,N,13,,110109,19683,entity_GLC
14,,SING,C5,C6,no,N,14,,110109,19683,entity_GLC
15,,SING,C5,O5,no,N,15,,110109,19683,entity_GLC
16,,SING,C5,H5,no,N,16,,110109,19683,entity_GLC
17,,SING,C6,O6,no,N,17,,110109,19683,entity_GLC
18,,SING,C6,H61,no,N,18,,110109,19683,entity_GLC
19,,SING,C6,H62,no,N,19,,110109,19683,entity_GLC
20,,SING,O1,HO1,no,N,20,,110109,19683,entity_GLC
21,,SING,O2,HO2,no,N,21,,110109,19683,entity_GLC
22,,SING,O3,HO3,no,N,22,,110109,19683,entity_GLC
23,,SING,O4,HO4,no,N,23,,110109,19683,entity_GLC
24,,SING,O6,HO6,no,N,24,,110109,19683,entity_GLC
1,,SING,O,H1,no,N,1,,110244,19692,HOH
2,,SING,O,H2,no,N,2,,110244,19692,HOH
1,,DOUB,C7,C6,yes,N,1,,110310,19695,2QL
2,,SING,C7,C20,yes,N,2,,110310,19695,2QL
3,,SING,C6,C5,yes,N,3,,110310,19695,2QL
4,,DOUB,C8,C20,yes,N,4,,110310,19695,2QL
5,,SING,C8,C9,yes,N,5,,110310,19695,2QL
6,,SING,C20,C21,yes,N,6,,110310,19695,2QL
7,,DOUB,C5,C22,yes,N,7,,110310,19695,2QL
8,,DOUB,C9,C17,yes,N,8,,110310,19695,2QL
9,,SING,C21,C22,yes,N,9,,110310,19695,2QL
10,,DOUB,C21,C18,yes,N,10,,110310,19695,2QL
11,,SING,C22,C23,yes,N,11,,110310,19695,2QL
12,,SING,C17,C18,yes,N,12,,110310,19695,2QL
13,,SING,C17,C10,yes,N,13,,110310,19695,2QL
14,,SING,C18,C19,yes,N,14,,110310,19695,2QL
15,,DOUB,C23,C4,yes,N,15,,110310,19695,2QL
16,,SING,C23,C24,yes,N,16,,110310,19695,2QL
17,,SING,C4,C3,yes,N,17,,110310,19695,2QL
18,,DOUB,C10,C16,yes,N,18,,110310,19695,2QL
19,,SING,C19,C24,yes,N,19,,110310,19695,2QL
20,,DOUB,C19,C15,yes,N,20,,110310,19695,2QL
21,,DOUB,C24,C1,yes,N,21,,110310,19695,2QL
22,,DOUB,C3,C2,yes,N,22,,110310,19695,2QL
23,,SING,C16,C15,yes,N,23,,110310,19695,2QL
24,,SING,C16,C11,no,N,24,,110310,19695,2QL
25,,SING,C15,C14,no,N,25,,110310,19695,2QL
26,,SING,C1,C2,yes,N,26,,110310,19695,2QL
27,,SING,C11,O11,no,N,27,,110310,19695,2QL
28,,SING,C11,C12,no,N,28,,110310,19695,2QL
29,,SING,O13,C13,no,N,29,,110310,19695,2QL
30,,SING,C14,C13,no,N,30,,110310,19695,2QL
31,,SING,C13,C12,no,N,31,,110310,19695,2QL
32,,SING,C12,O12,no,N,32,,110310,19695,2QL
33,,SING,C14,H14,no,N,33,,110310,19695,2QL
34,,SING,C14,H15,no,N,34,,110310,19695,2QL
35,,SING,C13,H13,no,N,35,,110310,19695,2QL
36,,SING,O13,HO13,no,N,36,,110310,19695,2QL
37,,SING,C12,H12,no,N,37,,110310,19695,2QL
38,,SING,O12,HO12,no,N,38,,110310,19695,2QL
39,,SING,C11,H11,no,N,39,,110310,19695,2QL
40,,SING,O11,HO11,no,N,40,,110310,19695,2QL
41,,SING,C10,H10,no,N,41,,110310,19695,2QL
42,,SING,C9,H9,no,N,42,,110310,19695,2QL
43,,SING,C8,H8,no,N,43,,110310,19695,2QL
44,,SING,C7,H7,no,N,44,,110310,19695,2QL
45,,SING,C6,H6,no,N,45,,110310,19695,2QL
46,,SING,C5,H5,no,N,46,,110310,19695,2QL
47,,SING,C4,H4,no,N,47,,110310,19695,2QL
48,,SING,C3,H3,no,N,48,,110310,19695,2QL
49,,SING,C2,H2,no,N,49,,110310,19695,2QL
50,,SING,C1,H1,no,N,50,,110310,19695,2QL
1,,DOUB,C7,C6,yes,N,1,,110330,19696,2QL
2,,SING,C7,C20,yes,N,2,,110330,19696,2QL
3,,SING,C6,C5,yes,N,3,,110330,19696,2QL
4,,DOUB,C8,C20,yes,N,4,,110330,19696,2QL
5,,SING,C8,C9,yes,N,5,,110330,19696,2QL
6,,SING,C20,C21,yes,N,6,,110330,19696,2QL
7,,DOUB,C5,C22,yes,N,7,,110330,19696,2QL
8,,DOUB,C9,C17,yes,N,8,,110330,19696,2QL
9,,SING,C21,C22,yes,N,9,,110330,19696,2QL
10,,DOUB,C21,C18,yes,N,10,,110330,19696,2QL
11,,SING,C22,C23,yes,N,11,,110330,19696,2QL
12,,SING,C17,C18,yes,N,12,,110330,19696,2QL
13,,SING,C17,C10,yes,N,13,,110330,19696,2QL
14,,SING,C18,C19,yes,N,14,,110330,19696,2QL
15,,DOUB,C23,C4,yes,N,15,,110330,19696,2QL
16,,SING,C23,C24,yes,N,16,,110330,19696,2QL
17,,SING,C4,C3,yes,N,17,,110330,19696,2QL
18,,DOUB,C10,C16,yes,N,18,,110330,19696,2QL
19,,SING,C19,C24,yes,N,19,,110330,19696,2QL
20,,DOUB,C19,C15,yes,N,20,,110330,19696,2QL
21,,DOUB,C24,C1,yes,N,21,,110330,19696,2QL
22,,DOUB,C3,C2,yes,N,22,,110330,19696,2QL
23,,SING,C16,C15,yes,N,23,,110330,19696,2QL
24,,SING,C16,C11,no,N,24,,110330,19696,2QL
25,,SING,C15,C14,no,N,25,,110330,19696,2QL
26,,SING,C1,C2,yes,N,26,,110330,19696,2QL
27,,SING,C11,O11,no,N,27,,110330,19696,2QL
28,,SING,C11,C12,no,N,28,,110330,19696,2QL
29,,SING,O13,C13,no,N,29,,110330,19696,2QL
30,,SING,C14,C13,no,N,30,,110330,19696,2QL
31,,SING,C13,C12,no,N,31,,110330,19696,2QL
32,,SING,C12,O12,no,N,32,,110330,19696,2QL
33,,SING,C14,H14,no,N,33,,110330,19696,2QL
34,,SING,C14,H15,no,N,34,,110330,19696,2QL
35,,SING,C13,H13,no,N,35,,110330,19696,2QL
36,,SING,O13,HO13,no,N,36,,110330,19696,2QL
37,,SING,C12,H12,no,N,37,,110330,19696,2QL
38,,SING,O12,HO12,no,N,38,,110330,19696,2QL
39,,SING,C11,H11,no,N,39,,110330,19696,2QL
40,,SING,O11,HO11,no,N,40,,110330,19696,2QL
41,,SING,C10,H10,no,N,41,,110330,19696,2QL
42,,SING,C9,H9,no,N,42,,110330,19696,2QL
43,,SING,C8,H8,no,N,43,,110330,19696,2QL
44,,SING,C7,H7,no,N,44,,110330,19696,2QL
45,,SING,C6,H6,no,N,45,,110330,19696,2QL
46,,SING,C5,H5,no,N,46,,110330,19696,2QL
47,,SING,C4,H4,no,N,47,,110330,19696,2QL
48,,SING,C3,H3,no,N,48,,110330,19696,2QL
49,,SING,C2,H2,no,N,49,,110330,19696,2QL
50,,SING,C1,H1,no,N,50,,110330,19696,2QL
1,,SING,N1,C2,no,N,1,,110367,19698,PRF
2,,SING,N1,C6,no,N,2,,110367,19698,PRF
3,,SING,N1,H91,no,N,3,,110367,19698,PRF
4,,DOUB,C2,N3,no,N,4,,110367,19698,PRF
5,,SING,C2,N2,no,N,5,,110367,19698,PRF
6,,SING,N3,C4,no,N,6,,110367,19698,PRF
7,,DOUB,C4,C5,yes,N,7,,110367,19698,PRF
8,,SING,C4,N9,yes,N,8,,110367,19698,PRF
9,,SING,C5,C6,no,N,9,,110367,19698,PRF
10,,SING,C5,C7,yes,N,10,,110367,19698,PRF
11,,DOUB,C6,O6,no,N,11,,110367,19698,PRF
12,,SING,C7,C10,no,N,12,,110367,19698,PRF
13,,DOUB,C7,C8,yes,N,13,,110367,19698,PRF
14,,SING,C10,N11,no,N,14,,110367,19698,PRF
15,,SING,C10,H101,no,N,15,,110367,19698,PRF
16,,SING,C10,H102,no,N,16,,110367,19698,PRF
17,,SING,N11,H111,no,N,17,,110367,19698,PRF
18,,SING,N11,H112,no,N,18,,110367,19698,PRF
19,,SING,C8,N9,yes,N,19,,110367,19698,PRF
20,,SING,C8,H81,no,N,20,,110367,19698,PRF
21,,SING,N9,HN91,no,N,21,,110367,19698,PRF
22,,SING,N2,HN21,no,N,22,,110367,19698,PRF
23,,SING,N2,HN22,no,N,23,,110367,19698,PRF
1,,SING,FE1,S1,no,N,1,,110730,19717,FES
2,,SING,FE1,S2,no,N,2,,110730,19717,FES
3,,SING,FE2,S1,no,N,3,,110730,19717,FES
4,,SING,FE2,S2,no,N,4,,110730,19717,FES
1,,SING,FE1,S1,no,N,1,,110752,19718,FES
2,,SING,FE1,S2,no,N,2,,110752,19718,FES
3,,SING,FE2,S1,no,N,3,,110752,19718,FES
4,,SING,FE2,S2,no,N,4,,110752,19718,FES
1,,SING,N1,C2,yes,N,1,,110929,19727,KET
2,,DOUB,N1,C6,yes,N,2,,110929,19727,KET
3,,SING,N1,HN1,no,N,3,,110929,19727,KET
4,,SING,C2,C2A,no,N,4,,110929,19727,KET
5,,DOUB,C2,C3,yes,N,5,,110929,19727,KET
6,,SING,C2A,H2A1,no,N,6,,110929,19727,KET
7,,SING,C2A,H2A2,no,N,7,,110929,19727,KET
8,,SING,C2A,H2A3,no,N,8,,110929,19727,KET
9,,SING,C3,O3,no,N,9,,110929,19727,KET
10,,SING,C3,C4,yes,N,10,,110929,19727,KET
11,,SING,O3,HO3,no,N,11,,110929,19727,KET
12,,SING,C4,C4A,no,N,12,,110929,19727,KET
13,,DOUB,C4,C5,yes,N,13,,110929,19727,KET
14,,DOUB,C4A,N,no,N,14,,110929,19727,KET
15,,SING,C4A,H4A,no,N,15,,110929,19727,KET
16,,SING,C5,C6,yes,N,16,,110929,19727,KET
17,,SING,C5,C5A,no,N,17,,110929,19727,KET
18,,SING,C6,H6,no,N,18,,110929,19727,KET
19,,SING,C5A,OP4,no,N,19,,110929,19727,KET
20,,SING,C5A,H5A1,no,N,20,,110929,19727,KET
21,,SING,C5A,H5A2,no,N,21,,110929,19727,KET
22,,SING,OP4,P,no,N,22,,110929,19727,KET
23,,DOUB,P,OP1,no,N,23,,110929,19727,KET
24,,SING,P,OP2,no,N,24,,110929,19727,KET
25,,SING,P,OP3,no,N,25,,110929,19727,KET
26,,SING,OP2,HOP2,no,N,26,,110929,19727,KET
27,,SING,OP3,HOP3,no,N,27,,110929,19727,KET
28,,SING,N,CA,no,N,28,,110929,19727,KET
29,,SING,CA,CB,no,N,29,,110929,19727,KET
30,,SING,CA,C,no,N,30,,110929,19727,KET
31,,SING,CA,HA,no,N,31,,110929,19727,KET
32,,SING,CB,CG,no,N,32,,110929,19727,KET
33,,SING,CB,HB1,no,N,33,,110929,19727,KET
34,,SING,CB,HB2,no,N,34,,110929,19727,KET
35,,DOUB,CG,OD1,no,N,35,,110929,19727,KET
36,,SING,CG,OD2,no,N,36,,110929,19727,KET
37,,SING,OD2,HD2,no,N,37,,110929,19727,KET
38,,DOUB,C,O,no,N,38,,110929,19727,KET
39,,SING,C,OXT,no,N,39,,110929,19727,KET
40,,SING,OXT,HXT,no,N,40,,110929,19727,KET
1,,DOUB,OH,CH,no,N,1,,111137,19738,ALY
2,,SING,CH,CH3,no,N,2,,111137,19738,ALY
3,,SING,CH,NZ,no,N,3,,111137,19738,ALY
4,,SING,CH3,HH31,no,N,4,,111137,19738,ALY
5,,SING,CH3,HH32,no,N,5,,111137,19738,ALY
6,,SING,CH3,HH33,no,N,6,,111137,19738,ALY
7,,SING,NZ,CE,no,N,7,,111137,19738,ALY
8,,SING,NZ,HZ,no,N,8,,111137,19738,ALY
9,,SING,CE,CD,no,N,9,,111137,19738,ALY
10,,SING,CE,HE3,no,N,10,,111137,19738,ALY
11,,SING,CE,HE2,no,N,11,,111137,19738,ALY
12,,SING,CD,CG,no,N,12,,111137,19738,ALY
13,,SING,CD,HD3,no,N,13,,111137,19738,ALY
14,,SING,CD,HD2,no,N,14,,111137,19738,ALY
15,,SING,CG,CB,no,N,15,,111137,19738,ALY
16,,SING,CG,HG3,no,N,16,,111137,19738,ALY
17,,SING,CG,HG2,no,N,17,,111137,19738,ALY
18,,SING,CB,CA,no,N,18,,111137,19738,ALY
19,,SING,CB,HB3,no,N,19,,111137,19738,ALY
20,,SING,CB,HB2,no,N,20,,111137,19738,ALY
21,,SING,CA,N,no,N,21,,111137,19738,ALY
22,,SING,CA,C,no,N,22,,111137,19738,ALY
23,,SING,CA,HCA,no,N,23,,111137,19738,ALY
24,,SING,N,H,no,N,24,,111137,19738,ALY
25,,SING,N,H2,no,N,25,,111137,19738,ALY
26,,DOUB,C,O,no,N,26,,111137,19738,ALY
27,,SING,C,OXT,no,N,27,,111137,19738,ALY
28,,SING,OXT,HXT,no,N,28,,111137,19738,ALY
1,,SING,CHA,C1A,yes,N,1,,111178,19740,HEM
2,,DOUB,CHA,C4D,yes,N,2,,111178,19740,HEM
3,,SING,CHA,HHA,no,N,3,,111178,19740,HEM
4,,SING,CHB,C4A,yes,N,4,,111178,19740,HEM
5,,DOUB,CHB,C1B,yes,N,5,,111178,19740,HEM
6,,SING,CHB,HHB,no,N,6,,111178,19740,HEM
7,,SING,CHC,C4B,yes,N,7,,111178,19740,HEM
8,,DOUB,CHC,C1C,yes,N,8,,111178,19740,HEM
9,,SING,CHC,HHC,no,N,9,,111178,19740,HEM
10,,DOUB,CHD,C4C,yes,N,10,,111178,19740,HEM
11,,SING,CHD,C1D,yes,N,11,,111178,19740,HEM
12,,SING,CHD,HHD,no,N,12,,111178,19740,HEM
13,,DOUB,C1A,C2A,yes,N,13,,111178,19740,HEM
14,,SING,C1A,NA,yes,N,14,,111178,19740,HEM
15,,SING,C2A,C3A,yes,N,15,,111178,19740,HEM
16,,SING,C2A,CAA,no,N,16,,111178,19740,HEM
17,,DOUB,C3A,C4A,yes,N,17,,111178,19740,HEM
18,,SING,C3A,CMA,no,N,18,,111178,19740,HEM
19,,SING,C4A,NA,yes,N,19,,111178,19740,HEM
20,,SING,CMA,HMA,no,N,20,,111178,19740,HEM
21,,SING,CMA,HMAA,no,N,21,,111178,19740,HEM
22,,SING,CMA,HMAB,no,N,22,,111178,19740,HEM
23,,SING,CAA,CBA,no,N,23,,111178,19740,HEM
24,,SING,CAA,HAA,no,N,24,,111178,19740,HEM
25,,SING,CAA,HAAA,no,N,25,,111178,19740,HEM
26,,SING,CBA,CGA,no,N,26,,111178,19740,HEM
27,,SING,CBA,HBA,no,N,27,,111178,19740,HEM
28,,SING,CBA,HBAA,no,N,28,,111178,19740,HEM
29,,DOUB,CGA,O1A,no,N,29,,111178,19740,HEM
30,,SING,CGA,O2A,no,N,30,,111178,19740,HEM
31,,SING,C1B,C2B,no,N,31,,111178,19740,HEM
32,,SING,C1B,NB,yes,N,32,,111178,19740,HEM
33,,DOUB,C2B,C3B,yes,N,33,,111178,19740,HEM
34,,SING,C2B,CMB,yes,N,34,,111178,19740,HEM
35,,SING,C3B,C4B,no,N,35,,111178,19740,HEM
36,,SING,C3B,CAB,yes,N,36,,111178,19740,HEM
37,,DOUB,C4B,NB,no,N,37,,111178,19740,HEM
38,,SING,CMB,HMB,yes,N,38,,111178,19740,HEM
39,,SING,CMB,HMBA,no,N,39,,111178,19740,HEM
40,,SING,CMB,HMBB,no,N,40,,111178,19740,HEM
41,,DOUB,CAB,CBB,no,N,41,,111178,19740,HEM
42,,SING,CAB,HAB,no,N,42,,111178,19740,HEM
43,,SING,CBB,HBB,no,N,43,,111178,19740,HEM
44,,SING,CBB,HBBA,no,N,44,,111178,19740,HEM
45,,SING,C1C,C2C,no,N,45,,111178,19740,HEM
46,,SING,C1C,NC,yes,N,46,,111178,19740,HEM
47,,DOUB,C2C,C3C,yes,N,47,,111178,19740,HEM
48,,SING,C2C,CMC,yes,N,48,,111178,19740,HEM
49,,SING,C3C,C4C,no,N,49,,111178,19740,HEM
50,,SING,C3C,CAC,yes,N,50,,111178,19740,HEM
51,,SING,C4C,NC,no,N,51,,111178,19740,HEM
52,,SING,CMC,HMC,yes,N,52,,111178,19740,HEM
53,,SING,CMC,HMCA,no,N,53,,111178,19740,HEM
54,,SING,CMC,HMCB,no,N,54,,111178,19740,HEM
55,,DOUB,CAC,CBC,no,N,55,,111178,19740,HEM
56,,SING,CAC,HAC,no,N,56,,111178,19740,HEM
57,,SING,CBC,HBC,no,N,57,,111178,19740,HEM
58,,SING,CBC,HBCA,no,N,58,,111178,19740,HEM
59,,SING,C1D,C2D,no,N,59,,111178,19740,HEM
60,,DOUB,C1D,ND,yes,N,60,,111178,19740,HEM
61,,DOUB,C2D,C3D,yes,N,61,,111178,19740,HEM
62,,SING,C2D,CMD,yes,N,62,,111178,19740,HEM
63,,SING,C3D,C4D,no,N,63,,111178,19740,HEM
64,,SING,C3D,CAD,yes,N,64,,111178,19740,HEM
65,,SING,C4D,ND,no,N,65,,111178,19740,HEM
66,,SING,CMD,HMD,yes,N,66,,111178,19740,HEM
67,,SING,CMD,HMDA,no,N,67,,111178,19740,HEM
68,,SING,CMD,HMDB,no,N,68,,111178,19740,HEM
69,,SING,CAD,CBD,no,N,69,,111178,19740,HEM
70,,SING,CAD,HAD,no,N,70,,111178,19740,HEM
71,,SING,CAD,HADA,no,N,71,,111178,19740,HEM
72,,SING,CBD,CGD,no,N,72,,111178,19740,HEM
73,,SING,CBD,HBD,no,N,73,,111178,19740,HEM
74,,SING,CBD,HBDA,no,N,74,,111178,19740,HEM
75,,DOUB,CGD,O1D,no,N,75,,111178,19740,HEM
76,,SING,CGD,O2D,no,N,76,,111178,19740,HEM
77,,SING,O2A,H2A,no,N,77,,111178,19740,HEM
78,,SING,O2D,H2D,no,N,78,,111178,19740,HEM
79,,SING,FE,NA,no,N,79,,111178,19740,HEM
80,,SING,FE,NB,no,N,80,,111178,19740,HEM
81,,SING,FE,NC,no,N,81,,111178,19740,HEM
82,,SING,FE,ND,no,N,82,,111178,19740,HEM
1,,SING,C1,C2,no,N,1,,111179,19740,CAM
2,,SING,C1,C6,no,N,2,,111179,19740,CAM
3,,SING,C1,C7,no,N,3,,111179,19740,CAM
4,,SING,C1,C10,no,N,4,,111179,19740,CAM
5,,DOUB,C2,O,no,N,5,,111179,19740,CAM
6,,SING,C2,C3,no,N,6,,111179,19740,CAM
7,,SING,C3,C4,no,N,7,,111179,19740,CAM
8,,SING,C3,H31,no,N,8,,111179,19740,CAM
9,,SING,C3,H32,no,N,9,,111179,19740,CAM
10,,SING,C4,C5,no,N,10,,111179,19740,CAM
11,,SING,C4,C7,no,N,11,,111179,19740,CAM
12,,SING,C4,H4,no,N,12,,111179,19740,CAM
13,,SING,C5,C6,no,N,13,,111179,19740,CAM
14,,SING,C5,H51,no,N,14,,111179,19740,CAM
15,,SING,C5,H52,no,N,15,,111179,19740,CAM
16,,SING,C6,H61,no,N,16,,111179,19740,CAM
17,,SING,C6,H62,no,N,17,,111179,19740,CAM
18,,SING,C7,C8,no,N,18,,111179,19740,CAM
19,,SING,C7,C9,no,N,19,,111179,19740,CAM
20,,SING,C8,H81,no,N,20,,111179,19740,CAM
21,,SING,C8,H82,no,N,21,,111179,19740,CAM
22,,SING,C8,H83,no,N,22,,111179,19740,CAM
23,,SING,C9,H91,no,N,23,,111179,19740,CAM
24,,SING,C9,H92,no,N,24,,111179,19740,CAM
25,,SING,C9,H93,no,N,25,,111179,19740,CAM
26,,SING,C10,H101,no,N,26,,111179,19740,CAM
27,,SING,C10,H102,no,N,27,,111179,19740,CAM
28,,SING,C10,H103,no,N,28,,111179,19740,CAM
1,,TRIP,C,N,no,N,1,,111180,19740,CYN
1,,DOUB,C1,O1,no,N,1,,111219,19742,CIR
2,,SING,C1,O2,no,N,2,,111219,19742,CIR
3,,SING,C1,C2,no,N,3,,111219,19742,CIR
4,,SING,O2,HO2,no,N,4,,111219,19742,CIR
5,,SING,C2,N2,no,N,5,,111219,19742,CIR
6,,SING,C2,C3,no,N,6,,111219,19742,CIR
7,,SING,C2,H2,no,N,7,,111219,19742,CIR
8,,SING,N2,HN21,no,N,8,,111219,19742,CIR
9,,SING,N2,HN22,no,N,9,,111219,19742,CIR
10,,SING,C3,C4,no,N,10,,111219,19742,CIR
11,,SING,C3,H31,no,N,11,,111219,19742,CIR
12,,SING,C3,H32,no,N,12,,111219,19742,CIR
13,,SING,C4,C5,no,N,13,,111219,19742,CIR
14,,SING,C4,H41,no,N,14,,111219,19742,CIR
15,,SING,C4,H42,no,N,15,,111219,19742,CIR
16,,SING,C5,N6,no,N,16,,111219,19742,CIR
17,,SING,C5,H51,no,N,17,,111219,19742,CIR
18,,SING,C5,H52,no,N,18,,111219,19742,CIR
19,,SING,N6,C7,no,N,19,,111219,19742,CIR
20,,SING,N6,HN6,no,N,20,,111219,19742,CIR
21,,DOUB,C7,O7,no,N,21,,111219,19742,CIR
22,,SING,C7,N8,no,N,22,,111219,19742,CIR
23,,SING,N8,HN81,no,N,23,,111219,19742,CIR
24,,SING,N8,HN82,no,N,24,,111219,19742,CIR
1,,DOUB,C1,O1,no,N,1,,111249,19744,CIR
2,,SING,C1,O2,no,N,2,,111249,19744,CIR
3,,SING,C1,C2,no,N,3,,111249,19744,CIR
4,,SING,O2,HO2,no,N,4,,111249,19744,CIR
5,,SING,C2,N2,no,N,5,,111249,19744,CIR
6,,SING,C2,C3,no,N,6,,111249,19744,CIR
7,,SING,C2,H2,no,N,7,,111249,19744,CIR
8,,SING,N2,HN21,no,N,8,,111249,19744,CIR
9,,SING,N2,HN22,no,N,9,,111249,19744,CIR
10,,SING,C3,C4,no,N,10,,111249,19744,CIR
11,,SING,C3,H31,no,N,11,,111249,19744,CIR
12,,SING,C3,H32,no,N,12,,111249,19744,CIR
13,,SING,C4,C5,no,N,13,,111249,19744,CIR
14,,SING,C4,H41,no,N,14,,111249,19744,CIR
15,,SING,C4,H42,no,N,15,,111249,19744,CIR
16,,SING,C5,N6,no,N,16,,111249,19744,CIR
17,,SING,C5,H51,no,N,17,,111249,19744,CIR
18,,SING,C5,H52,no,N,18,,111249,19744,CIR
19,,SING,N6,C7,no,N,19,,111249,19744,CIR
20,,SING,N6,HN6,no,N,20,,111249,19744,CIR
21,,DOUB,C7,O7,no,N,21,,111249,19744,CIR
22,,SING,C7,N8,no,N,22,,111249,19744,CIR
23,,SING,N8,HN81,no,N,23,,111249,19744,CIR
24,,SING,N8,HN82,no,N,24,,111249,19744,CIR
1,,SING,C2,C3,no,N,1,,111321,19748,BGC
2,,SING,C2,C1,no,N,2,,111321,19748,BGC
3,,SING,C2,O2,no,N,3,,111321,19748,BGC
4,,SING,C2,H2,no,N,4,,111321,19748,BGC
5,,SING,C3,C4,no,N,5,,111321,19748,BGC
6,,SING,C3,O3,no,N,6,,111321,19748,BGC
7,,SING,C3,H3,no,N,7,,111321,19748,BGC
8,,SING,C4,C5,no,N,8,,111321,19748,BGC
9,,SING,C4,O4,no,N,9,,111321,19748,BGC
10,,SING,C4,H4,no,N,10,,111321,19748,BGC
11,,SING,C5,C6,no,N,11,,111321,19748,BGC
12,,SING,C5,O5,no,N,12,,111321,19748,BGC
13,,SING,C5,H5,no,N,13,,111321,19748,BGC
14,,SING,C6,O6,no,N,14,,111321,19748,BGC
15,,SING,C6,H6C1,no,N,15,,111321,19748,BGC
16,,SING,C6,H6C2,no,N,16,,111321,19748,BGC
17,,SING,C1,O1,no,N,17,,111321,19748,BGC
18,,SING,C1,O5,no,N,18,,111321,19748,BGC
19,,SING,C1,H1,no,N,19,,111321,19748,BGC
20,,SING,O1,HA,no,N,20,,111321,19748,BGC
21,,SING,O2,HB,no,N,21,,111321,19748,BGC
22,,SING,O3,HC,no,N,22,,111321,19748,BGC
23,,SING,O4,HD,no,N,23,,111321,19748,BGC
24,,SING,O6,H6,no,N,24,,111321,19748,BGC
1,,SING,C1,C2,no,N,1,,111322,19748,GAL
2,,SING,C1,O1,no,N,2,,111322,19748,GAL
3,,SING,C1,O5,no,N,3,,111322,19748,GAL
4,,SING,C1,H1,no,N,4,,111322,19748,GAL
5,,SING,C2,C3,no,N,5,,111322,19748,GAL
6,,SING,C2,O2,no,N,6,,111322,19748,GAL
7,,SING,C2,H2,no,N,7,,111322,19748,GAL
8,,SING,C3,C4,no,N,8,,111322,19748,GAL
9,,SING,C3,O3,no,N,9,,111322,19748,GAL
10,,SING,C3,H3,no,N,10,,111322,19748,GAL
11,,SING,C4,C5,no,N,11,,111322,19748,GAL
12,,SING,C4,O4,no,N,12,,111322,19748,GAL
13,,SING,C4,H4,no,N,13,,111322,19748,GAL
14,,SING,C5,C6,no,N,14,,111322,19748,GAL
15,,SING,C5,O5,no,N,15,,111322,19748,GAL
16,,SING,C5,H5,no,N,16,,111322,19748,GAL
17,,SING,C6,O6,no,N,17,,111322,19748,GAL
18,,SING,C6,H61,no,N,18,,111322,19748,GAL
19,,SING,C6,H62,no,N,19,,111322,19748,GAL
20,,SING,O1,HO1,no,N,20,,111322,19748,GAL
21,,SING,O2,HO2,no,N,21,,111322,19748,GAL
22,,SING,O3,HO3,no,N,22,,111322,19748,GAL
23,,SING,O4,HO4,no,N,23,,111322,19748,GAL
24,,SING,O6,HO6,no,N,24,,111322,19748,GAL
1,,SING,C1,C2,no,N,1,,111323,19748,FUC
2,,SING,C1,O1,no,N,2,,111323,19748,FUC
3,,SING,C1,O5,no,N,3,,111323,19748,FUC
4,,SING,C1,H1,no,N,4,,111323,19748,FUC
5,,SING,C2,C3,no,N,5,,111323,19748,FUC
6,,SING,C2,O2,no,N,6,,111323,19748,FUC
7,,SING,C2,H2,no,N,7,,111323,19748,FUC
8,,SING,C3,C4,no,N,8,,111323,19748,FUC
9,,SING,C3,O3,no,N,9,,111323,19748,FUC
10,,SING,C3,H3,no,N,10,,111323,19748,FUC
11,,SING,C4,C5,no,N,11,,111323,19748,FUC
12,,SING,C4,O4,no,N,12,,111323,19748,FUC
13,,SING,C4,H4,no,N,13,,111323,19748,FUC
14,,SING,C5,C6,no,N,14,,111323,19748,FUC
15,,SING,C5,O5,no,N,15,,111323,19748,FUC
16,,SING,C5,H5,no,N,16,,111323,19748,FUC
17,,SING,C6,H61,no,N,17,,111323,19748,FUC
18,,SING,C6,H62,no,N,18,,111323,19748,FUC
19,,SING,C6,H63,no,N,19,,111323,19748,FUC
20,,SING,O1,HO1,no,N,20,,111323,19748,FUC
21,,SING,O2,HO2,no,N,21,,111323,19748,FUC
22,,SING,O3,HO3,no,N,22,,111323,19748,FUC
23,,SING,O4,HO4,no,N,23,,111323,19748,FUC
1,,DOUB,C,O,no,N,1,,111526,19759,ACE
2,,SING,C,CH3,no,N,2,,111526,19759,ACE
3,,SING,C,H,no,N,3,,111526,19759,ACE
4,,SING,CH3,H1,no,N,4,,111526,19759,ACE
5,,SING,CH3,H2,no,N,5,,111526,19759,ACE
6,,SING,CH3,H3,no,N,6,,111526,19759,ACE
1,,SING,N,HN1,no,N,1,,111527,19759,NH2
2,,SING,N,HN2,no,N,2,,111527,19759,NH2
1,,SING,O,C5,no,N,1,,111528,19759,A2G
2,,SING,C1,O,no,N,2,,111528,19759,A2G
3,,SING,C1,C2,no,N,3,,111528,19759,A2G
4,,SING,C1,H1,no,N,4,,111528,19759,A2G
5,,SING,O1,C1,no,N,5,,111528,19759,A2G
6,,SING,O1,HO1,no,N,6,,111528,19759,A2G
7,,SING,C2,C3,no,N,7,,111528,19759,A2G
8,,SING,C2,H2,no,N,8,,111528,19759,A2G
9,,SING,N2,C2,no,N,9,,111528,19759,A2G
10,,SING,N2,HN2,no,N,10,,111528,19759,A2G
11,,SING,C3,C4,no,N,11,,111528,19759,A2G
12,,SING,C3,O3,no,N,12,,111528,19759,A2G
13,,SING,C3,H3,no,N,13,,111528,19759,A2G
14,,SING,O3,HO3,no,N,14,,111528,19759,A2G
15,,SING,C4,O4,no,N,15,,111528,19759,A2G
16,,SING,C4,H4,no,N,16,,111528,19759,A2G
17,,SING,O4,HO4,no,N,17,,111528,19759,A2G
18,,SING,C5,C4,no,N,18,,111528,19759,A2G
19,,SING,C5,C6,no,N,19,,111528,19759,A2G
20,,SING,C5,H5,no,N,20,,111528,19759,A2G
21,,SING,C6,O6,no,N,21,,111528,19759,A2G
22,,SING,C6,H6,no,N,22,,111528,19759,A2G
23,,SING,C7,N2,no,N,23,,111528,19759,A2G
24,,DOUB,O7,C7,no,N,24,,111528,19759,A2G
25,,SING,C8,C7,no,N,25,,111528,19759,A2G
26,,SING,C8,H8,no,N,26,,111528,19759,A2G
27,,SING,C8,H8A,no,N,27,,111528,19759,A2G
28,,SING,C8,H8B,no,N,28,,111528,19759,A2G
29,,SING,C6,H14,no,N,29,,111528,19759,A2G
30,,SING,O6,H15,no,N,30,,111528,19759,A2G
1,,TRIP,C,N,no,N,1,,111549,19763,CYN
1,,SING,CHA,C1A,yes,N,1,,111550,19763,HEM
2,,DOUB,CHA,C4D,yes,N,2,,111550,19763,HEM
3,,SING,CHA,HHA,no,N,3,,111550,19763,HEM
4,,SING,CHB,C4A,yes,N,4,,111550,19763,HEM
5,,DOUB,CHB,C1B,yes,N,5,,111550,19763,HEM
6,,SING,CHB,HHB,no,N,6,,111550,19763,HEM
7,,SING,CHC,C4B,yes,N,7,,111550,19763,HEM
8,,DOUB,CHC,C1C,yes,N,8,,111550,19763,HEM
9,,SING,CHC,HHC,no,N,9,,111550,19763,HEM
10,,DOUB,CHD,C4C,yes,N,10,,111550,19763,HEM
11,,SING,CHD,C1D,yes,N,11,,111550,19763,HEM
12,,SING,CHD,HHD,no,N,12,,111550,19763,HEM
13,,DOUB,C1A,C2A,yes,N,13,,111550,19763,HEM
14,,SING,C1A,NA,yes,N,14,,111550,19763,HEM
15,,SING,C2A,C3A,yes,N,15,,111550,19763,HEM
16,,SING,C2A,CAA,no,N,16,,111550,19763,HEM
17,,DOUB,C3A,C4A,yes,N,17,,111550,19763,HEM
18,,SING,C3A,CMA,no,N,18,,111550,19763,HEM
19,,SING,C4A,NA,yes,N,19,,111550,19763,HEM
20,,SING,CMA,HMA,no,N,20,,111550,19763,HEM
21,,SING,CMA,HMAA,no,N,21,,111550,19763,HEM
22,,SING,CMA,HMAB,no,N,22,,111550,19763,HEM
23,,SING,CAA,CBA,no,N,23,,111550,19763,HEM
24,,SING,CAA,HAA,no,N,24,,111550,19763,HEM
25,,SING,CAA,HAAA,no,N,25,,111550,19763,HEM
26,,SING,CBA,CGA,no,N,26,,111550,19763,HEM
27,,SING,CBA,HBA,no,N,27,,111550,19763,HEM
28,,SING,CBA,HBAA,no,N,28,,111550,19763,HEM
29,,DOUB,CGA,O1A,no,N,29,,111550,19763,HEM
30,,SING,CGA,O2A,no,N,30,,111550,19763,HEM
31,,SING,C1B,C2B,no,N,31,,111550,19763,HEM
32,,SING,C1B,NB,yes,N,32,,111550,19763,HEM
33,,DOUB,C2B,C3B,yes,N,33,,111550,19763,HEM
34,,SING,C2B,CMB,yes,N,34,,111550,19763,HEM
35,,SING,C3B,C4B,no,N,35,,111550,19763,HEM
36,,SING,C3B,CAB,yes,N,36,,111550,19763,HEM
37,,DOUB,C4B,NB,no,N,37,,111550,19763,HEM
38,,SING,CMB,HMB,yes,N,38,,111550,19763,HEM
39,,SING,CMB,HMBA,no,N,39,,111550,19763,HEM
40,,SING,CMB,HMBB,no,N,40,,111550,19763,HEM
41,,DOUB,CAB,CBB,no,N,41,,111550,19763,HEM
42,,SING,CAB,HAB,no,N,42,,111550,19763,HEM
43,,SING,CBB,HBB,no,N,43,,111550,19763,HEM
44,,SING,CBB,HBBA,no,N,44,,111550,19763,HEM
45,,SING,C1C,C2C,no,N,45,,111550,19763,HEM
46,,SING,C1C,NC,yes,N,46,,111550,19763,HEM
47,,DOUB,C2C,C3C,yes,N,47,,111550,19763,HEM
48,,SING,C2C,CMC,yes,N,48,,111550,19763,HEM
49,,SING,C3C,C4C,no,N,49,,111550,19763,HEM
50,,SING,C3C,CAC,yes,N,50,,111550,19763,HEM
51,,SING,C4C,NC,no,N,51,,111550,19763,HEM
52,,SING,CMC,HMC,yes,N,52,,111550,19763,HEM
53,,SING,CMC,HMCA,no,N,53,,111550,19763,HEM
54,,SING,CMC,HMCB,no,N,54,,111550,19763,HEM
55,,DOUB,CAC,CBC,no,N,55,,111550,19763,HEM
56,,SING,CAC,HAC,no,N,56,,111550,19763,HEM
57,,SING,CBC,HBC,no,N,57,,111550,19763,HEM
58,,SING,CBC,HBCA,no,N,58,,111550,19763,HEM
59,,SING,C1D,C2D,no,N,59,,111550,19763,HEM
60,,DOUB,C1D,ND,yes,N,60,,111550,19763,HEM
61,,DOUB,C2D,C3D,yes,N,61,,111550,19763,HEM
62,,SING,C2D,CMD,yes,N,62,,111550,19763,HEM
63,,SING,C3D,C4D,no,N,63,,111550,19763,HEM
64,,SING,C3D,CAD,yes,N,64,,111550,19763,HEM
65,,SING,C4D,ND,no,N,65,,111550,19763,HEM
66,,SING,CMD,HMD,yes,N,66,,111550,19763,HEM
67,,SING,CMD,HMDA,no,N,67,,111550,19763,HEM
68,,SING,CMD,HMDB,no,N,68,,111550,19763,HEM
69,,SING,CAD,CBD,no,N,69,,111550,19763,HEM
70,,SING,CAD,HAD,no,N,70,,111550,19763,HEM
71,,SING,CAD,HADA,no,N,71,,111550,19763,HEM
72,,SING,CBD,CGD,no,N,72,,111550,19763,HEM
73,,SING,CBD,HBD,no,N,73,,111550,19763,HEM
74,,SING,CBD,HBDA,no,N,74,,111550,19763,HEM
75,,DOUB,CGD,O1D,no,N,75,,111550,19763,HEM
76,,SING,CGD,O2D,no,N,76,,111550,19763,HEM
77,,SING,O2A,H2A,no,N,77,,111550,19763,HEM
78,,SING,O2D,H2D,no,N,78,,111550,19763,HEM
79,,SING,FE,NA,no,N,79,,111550,19763,HEM
80,,SING,FE,NB,no,N,80,,111550,19763,HEM
81,,SING,FE,NC,no,N,81,,111550,19763,HEM
82,,SING,FE,ND,no,N,82,,111550,19763,HEM
1,,TRIP,C,N,no,N,1,,112390,19819,CYN
1,,SING,FE,NA,no,N,1,,112426,19822,DHE
2,,SING,FE,NB,no,N,2,,112426,19822,DHE
3,,SING,FE,NC,no,N,3,,112426,19822,DHE
4,,SING,FE,ND,no,N,4,,112426,19822,DHE
5,,DOUB,CHA,C1A,yes,N,5,,112426,19822,DHE
6,,SING,CHA,C4D,yes,N,6,,112426,19822,DHE
7,,SING,CHA,HHA,no,N,7,,112426,19822,DHE
8,,DOUB,CHB,C4A,yes,N,8,,112426,19822,DHE
9,,SING,CHB,C1B,yes,N,9,,112426,19822,DHE
10,,SING,CHB,HHB,no,N,10,,112426,19822,DHE
11,,DOUB,CHC,C4B,yes,N,11,,112426,19822,DHE
12,,SING,CHC,C1C,yes,N,12,,112426,19822,DHE
13,,SING,CHC,HHC,no,N,13,,112426,19822,DHE
14,,DOUB,CHD,C4C,yes,N,14,,112426,19822,DHE
15,,SING,CHD,C1D,yes,N,15,,112426,19822,DHE
16,,SING,CHD,HHD,no,N,16,,112426,19822,DHE
17,,SING,NA,C1A,yes,N,17,,112426,19822,DHE
18,,SING,NA,C4A,yes,N,18,,112426,19822,DHE
19,,SING,C1A,C2A,yes,N,19,,112426,19822,DHE
20,,DOUB,C2A,C3A,yes,N,20,,112426,19822,DHE
21,,SING,C2A,CAA,no,N,21,,112426,19822,DHE
22,,SING,C3A,C4A,yes,N,22,,112426,19822,DHE
23,,SING,C3A,CMA,no,N,23,,112426,19822,DHE
24,,SING,CMA,HMA1,no,N,24,,112426,19822,DHE
25,,SING,CMA,HMA2,no,N,25,,112426,19822,DHE
26,,SING,CMA,HMA3,no,N,26,,112426,19822,DHE
27,,SING,CAA,CBA,no,N,27,,112426,19822,DHE
28,,SING,CAA,HAA1,no,N,28,,112426,19822,DHE
29,,SING,CAA,HAA2,no,N,29,,112426,19822,DHE
30,,SING,CBA,CGA,no,N,30,,112426,19822,DHE
31,,SING,CBA,HBA1,no,N,31,,112426,19822,DHE
32,,SING,CBA,HBA2,no,N,32,,112426,19822,DHE
33,,DOUB,CGA,O1A,no,N,33,,112426,19822,DHE
34,,SING,CGA,O2A,no,N,34,,112426,19822,DHE
35,,SING,O2A,H2A,no,N,35,,112426,19822,DHE
36,,DOUB,NB,C1B,yes,N,36,,112426,19822,DHE
37,,SING,NB,C4B,yes,N,37,,112426,19822,DHE
38,,SING,C1B,C2B,no,N,38,,112426,19822,DHE
39,,DOUB,C2B,OMB,no,N,39,,112426,19822,DHE
40,,SING,C2B,C3B,no,N,40,,112426,19822,DHE
41,,SING,C3B,CGB,no,N,41,,112426,19822,DHE
42,,SING,C3B,CAB,no,N,42,,112426,19822,DHE
43,,SING,C3B,C4B,no,N,43,,112426,19822,DHE
44,,SING,CGB,HGB1,no,N,44,,112426,19822,DHE
45,,SING,CGB,HGB2,no,N,45,,112426,19822,DHE
46,,SING,CGB,HGB3,no,N,46,,112426,19822,DHE
47,,SING,CAB,CBB,no,N,47,,112426,19822,DHE
48,,SING,CAB,HAB1,no,N,48,,112426,19822,DHE
49,,SING,CAB,HAB2,no,N,49,,112426,19822,DHE
50,,DOUB,CBB,O1B,no,N,50,,112426,19822,DHE
51,,SING,CBB,O2B,no,N,51,,112426,19822,DHE
52,,SING,O2B,H2B,no,N,52,,112426,19822,DHE
53,,DOUB,NC,C1C,yes,N,53,,112426,19822,DHE
54,,SING,NC,C4C,yes,N,54,,112426,19822,DHE
55,,SING,C1C,C2C,no,N,55,,112426,19822,DHE
56,,DOUB,C2C,OMC,no,N,56,,112426,19822,DHE
57,,SING,C2C,C3C,no,N,57,,112426,19822,DHE
58,,SING,C3C,CGC,no,N,58,,112426,19822,DHE
59,,SING,C3C,CAC,no,N,59,,112426,19822,DHE
60,,SING,C3C,C4C,no,N,60,,112426,19822,DHE
61,,SING,CGC,HGC1,no,N,61,,112426,19822,DHE
62,,SING,CGC,HGC2,no,N,62,,112426,19822,DHE
63,,SING,CGC,HGC3,no,N,63,,112426,19822,DHE
64,,SING,CAC,CBC,no,N,64,,112426,19822,DHE
65,,SING,CAC,HAC1,no,N,65,,112426,19822,DHE
66,,SING,CAC,HAC2,no,N,66,,112426,19822,DHE
67,,DOUB,CBC,O1C,no,N,67,,112426,19822,DHE
68,,SING,CBC,O2C,no,N,68,,112426,19822,DHE
69,,SING,O2C,H2C,no,N,69,,112426,19822,DHE
70,,SING,ND,C1D,yes,N,70,,112426,19822,DHE
71,,SING,ND,C4D,yes,N,71,,112426,19822,DHE
72,,DOUB,C1D,C2D,yes,N,72,,112426,19822,DHE
73,,SING,C2D,C3D,yes,N,73,,112426,19822,DHE
74,,SING,C2D,CMD,no,N,74,,112426,19822,DHE
75,,DOUB,C3D,C4D,yes,N,75,,112426,19822,DHE
76,,SING,C3D,CAD,no,N,76,,112426,19822,DHE
77,,SING,CMD,HMD1,no,N,77,,112426,19822,DHE
78,,SING,CMD,HMD2,no,N,78,,112426,19822,DHE
79,,SING,CMD,HMD3,no,N,79,,112426,19822,DHE
80,,SING,CAD,CBD,no,N,80,,112426,19822,DHE
81,,SING,CAD,HAD1,no,N,81,,112426,19822,DHE
82,,SING,CAD,HAD2,no,N,82,,112426,19822,DHE
83,,SING,CBD,CGD,no,N,83,,112426,19822,DHE
84,,SING,CBD,HBD1,no,N,84,,112426,19822,DHE
85,,SING,CBD,HBD2,no,N,85,,112426,19822,DHE
86,,DOUB,CGD,O1D,no,N,86,,112426,19822,DHE
87,,SING,CGD,O2D,no,N,87,,112426,19822,DHE
88,,SING,O2D,H2D,no,N,88,,112426,19822,DHE
1,,SING,C19,C23,no,N,1,,112492,19826,2W7
2,,SING,C19,C17,no,N,2,,112492,19826,2W7
3,,SING,C23,C25,no,N,3,,112492,19826,2W7
4,,SING,C23,C24,no,N,4,,112492,19826,2W7
5,,SING,C25,C20,no,N,5,,112492,19826,2W7
6,,SING,C24,C14,no,N,6,,112492,19826,2W7
7,,SING,C17,C16,no,N,7,,112492,19826,2W7
8,,SING,C17,C18,no,N,8,,112492,19826,2W7
9,,SING,C16,C20,no,N,9,,112492,19826,2W7
10,,SING,C20,C26,no,N,10,,112492,19826,2W7
11,,DOUB,O3,C13,no,N,11,,112492,19826,2W7
12,,SING,C18,C14,no,N,12,,112492,19826,2W7
13,,SING,C14,C26,no,N,13,,112492,19826,2W7
14,,SING,C14,N4,no,N,14,,112492,19826,2W7
15,,SING,C13,N4,no,N,15,,112492,19826,2W7
16,,SING,C13,C12,no,N,16,,112492,19826,2W7
17,,SING,C12,N3,no,N,17,,112492,19826,2W7
18,,SING,N3,C11,no,N,18,,112492,19826,2W7
19,,DOUB,C9,C8,yes,N,19,,112492,19826,2W7
20,,SING,C9,C10,yes,N,20,,112492,19826,2W7
21,,SING,C8,C7,yes,N,21,,112492,19826,2W7
22,,SING,C11,C10,no,N,22,,112492,19826,2W7
23,,DOUB,C11,O2,no,N,23,,112492,19826,2W7
24,,DOUB,C10,C5,yes,N,24,,112492,19826,2W7
25,,DOUB,C7,C6,yes,N,25,,112492,19826,2W7
26,,SING,C5,C6,yes,N,26,,112492,19826,2W7
27,,SING,C5,S2,no,N,27,,112492,19826,2W7
28,,SING,S2,H1,no,N,28,,112492,19826,2W7
29,,SING,C6,H6,no,N,29,,112492,19826,2W7
30,,SING,C7,H7,no,N,30,,112492,19826,2W7
31,,SING,C8,H8,no,N,31,,112492,19826,2W7
32,,SING,C9,H9,no,N,32,,112492,19826,2W7
33,,SING,N3,H3,no,N,33,,112492,19826,2W7
34,,SING,C12,H122,no,N,34,,112492,19826,2W7
35,,SING,C12,H121,no,N,35,,112492,19826,2W7
36,,SING,N4,H4,no,N,36,,112492,19826,2W7
37,,SING,C18,HZ12,no,N,37,,112492,19826,2W7
38,,SING,C18,HZ11,no,N,38,,112492,19826,2W7
39,,SING,C17,HY1,no,N,39,,112492,19826,2W7
40,,SING,C19,HX22,no,N,40,,112492,19826,2W7
41,,SING,C19,HX21,no,N,41,,112492,19826,2W7
42,,SING,C23,HY3,no,N,42,,112492,19826,2W7
43,,SING,C24,HZ21,no,N,43,,112492,19826,2W7
44,,SING,C24,HZ22,no,N,44,,112492,19826,2W7
45,,SING,C25,HX31,no,N,45,,112492,19826,2W7
46,,SING,C25,HX32,no,N,46,,112492,19826,2W7
47,,SING,C20,HY2,no,N,47,,112492,19826,2W7
48,,SING,C26,HZ32,no,N,48,,112492,19826,2W7
49,,SING,C26,HZ31,no,N,49,,112492,19826,2W7
50,,SING,C16,HX12,no,N,50,,112492,19826,2W7
51,,SING,C16,HX11,no,N,51,,112492,19826,2W7
1,,SING,C,O,no,N,1,,112809,19843,GCH
2,,SING,C,C1,no,N,2,,112809,19843,GCH
3,,SING,C,C5,no,N,3,,112809,19843,GCH
4,,SING,C,H12,no,N,4,,112809,19843,GCH
5,,SING,O,H1,no,N,5,,112809,19843,GCH
6,,SING,C1,C2,no,N,6,,112809,19843,GCH
7,,SING,C1,H10,no,N,7,,112809,19843,GCH
8,,SING,C1,H11,no,N,8,,112809,19843,GCH
9,,SING,C2,C3,no,N,9,,112809,19843,GCH
10,,SING,C2,C7,no,N,10,,112809,19843,GCH
11,,SING,C2,H9,no,N,11,,112809,19843,GCH
12,,SING,C3,C4,no,N,12,,112809,19843,GCH
13,,SING,C3,C6,no,N,13,,112809,19843,GCH
14,,SING,C3,C10,no,N,14,,112809,19843,GCH
15,,SING,C4,C5,no,N,15,,112809,19843,GCH
16,,SING,C4,H4,no,N,16,,112809,19843,GCH
17,,SING,C4,H5,no,N,17,,112809,19843,GCH
18,,SING,C5,H2,no,N,18,,112809,19843,GCH
19,,SING,C5,H3,no,N,19,,112809,19843,GCH
20,,SING,C6,H6,no,N,20,,112809,19843,GCH
21,,SING,C6,H7,no,N,21,,112809,19843,GCH
22,,SING,C6,H8,no,N,22,,112809,19843,GCH
23,,SING,C7,C8,no,N,23,,112809,19843,GCH
24,,SING,C7,H17,no,N,24,,112809,19843,GCH
25,,SING,C7,H18,no,N,25,,112809,19843,GCH
26,,SING,C8,O1,no,N,26,,112809,19843,GCH
27,,SING,C8,C9,no,N,27,,112809,19843,GCH
28,,SING,C8,H16,no,N,28,,112809,19843,GCH
29,,SING,O1,H13,no,N,29,,112809,19843,GCH
30,,SING,C9,C10,no,N,30,,112809,19843,GCH
31,,SING,C9,C14,no,N,31,,112809,19843,GCH
32,,SING,C9,H15,no,N,32,,112809,19843,GCH
33,,SING,C10,C11,no,N,33,,112809,19843,GCH
34,,SING,C10,H14,no,N,34,,112809,19843,GCH
35,,SING,C11,C12,no,N,35,,112809,19843,GCH
36,,SING,C11,H41,no,N,36,,112809,19843,GCH
37,,SING,C11,H42,no,N,37,,112809,19843,GCH
38,,SING,C12,C13,no,N,38,,112809,19843,GCH
39,,SING,C12,O3,no,N,39,,112809,19843,GCH
40,,SING,C12,H40,no,N,40,,112809,19843,GCH
41,,SING,C13,C14,no,N,41,,112809,19843,GCH
42,,SING,C13,C17,no,N,42,,112809,19843,GCH
43,,SING,C13,C23,no,N,43,,112809,19843,GCH
44,,SING,C14,C15,no,N,44,,112809,19843,GCH
45,,SING,C14,H35,no,N,45,,112809,19843,GCH
46,,SING,C15,C16,no,N,46,,112809,19843,GCH
47,,SING,C15,H33,no,N,47,,112809,19843,GCH
48,,SING,C15,H34,no,N,48,,112809,19843,GCH
49,,SING,C16,C17,no,N,49,,112809,19843,GCH
50,,SING,C16,H31,no,N,50,,112809,19843,GCH
51,,SING,C16,H32,no,N,51,,112809,19843,GCH
52,,SING,C17,C18,no,N,52,,112809,19843,GCH
53,,SING,C17,H30,no,N,53,,112809,19843,GCH
54,,SING,C18,C19,no,N,54,,112809,19843,GCH
55,,SING,C18,C20,no,N,55,,112809,19843,GCH
56,,SING,C18,H29,no,N,56,,112809,19843,GCH
57,,SING,C19,H19,no,N,57,,112809,19843,GCH
58,,SING,C19,H20,no,N,58,,112809,19843,GCH
59,,SING,C19,H21,no,N,59,,112809,19843,GCH
60,,SING,C20,C21,no,N,60,,112809,19843,GCH
61,,SING,C20,H27,no,N,61,,112809,19843,GCH
62,,SING,C20,H28,no,N,62,,112809,19843,GCH
63,,SING,C21,C22,no,N,63,,112809,19843,GCH
64,,SING,C21,H25,no,N,64,,112809,19843,GCH
65,,SING,C21,H26,no,N,65,,112809,19843,GCH
66,,SING,C22,N,no,N,66,,112809,19843,GCH
67,,DOUB,C22,O2,no,N,67,,112809,19843,GCH
68,,SING,N,CA,no,N,68,,112809,19843,GCH
69,,SING,N,H24,no,N,69,,112809,19843,GCH
70,,SING,CA,C24,no,N,70,,112809,19843,GCH
71,,SING,CA,H22,no,N,71,,112809,19843,GCH
72,,SING,CA,H23,no,N,72,,112809,19843,GCH
73,,SING,C23,H36,no,N,73,,112809,19843,GCH
74,,SING,C23,H37,no,N,74,,112809,19843,GCH
75,,SING,C23,H38,no,N,75,,112809,19843,GCH
76,,SING,O3,H39,no,N,76,,112809,19843,GCH
77,,SING,C24,O4,no,N,77,,112809,19843,GCH
78,,DOUB,C24,O5,no,N,78,,112809,19843,GCH
79,,SING,O4,H43,no,N,79,,112809,19843,GCH
1,,SING,C1,C2,no,N,1,,112810,19843,CHO
2,,SING,C1,C10,no,N,2,,112810,19843,CHO
3,,SING,C1,H11,no,N,3,,112810,19843,CHO
4,,SING,C1,H12,no,N,4,,112810,19843,CHO
5,,SING,C2,C3,no,N,5,,112810,19843,CHO
6,,SING,C2,H21,no,N,6,,112810,19843,CHO
7,,SING,C2,H22,no,N,7,,112810,19843,CHO
8,,SING,C3,O3,no,N,8,,112810,19843,CHO
9,,SING,C3,C4,no,N,9,,112810,19843,CHO
10,,SING,C3,H3,no,N,10,,112810,19843,CHO
11,,SING,O3,HO3,no,N,11,,112810,19843,CHO
12,,SING,C4,C5,no,N,12,,112810,19843,CHO
13,,SING,C4,H41,no,N,13,,112810,19843,CHO
14,,SING,C4,H42,no,N,14,,112810,19843,CHO
15,,SING,C5,C6,no,N,15,,112810,19843,CHO
16,,SING,C5,C10,no,N,16,,112810,19843,CHO
17,,SING,C5,H5,no,N,17,,112810,19843,CHO
18,,SING,C6,C7,no,N,18,,112810,19843,CHO
19,,SING,C6,H61,no,N,19,,112810,19843,CHO
20,,SING,C6,H62,no,N,20,,112810,19843,CHO
21,,SING,C7,O7,no,N,21,,112810,19843,CHO
22,,SING,C7,C8,no,N,22,,112810,19843,CHO
23,,SING,C7,H7,no,N,23,,112810,19843,CHO
24,,SING,O7,HO7,no,N,24,,112810,19843,CHO
25,,SING,C8,C9,no,N,25,,112810,19843,CHO
26,,SING,C8,C14,no,N,26,,112810,19843,CHO
27,,SING,C8,H8,no,N,27,,112810,19843,CHO
28,,SING,C9,C10,no,N,28,,112810,19843,CHO
29,,SING,C9,C11,no,N,29,,112810,19843,CHO
30,,SING,C9,H9,no,N,30,,112810,19843,CHO
31,,SING,C10,C19,no,N,31,,112810,19843,CHO
32,,SING,C11,C12,no,N,32,,112810,19843,CHO
33,,SING,C11,H111,no,N,33,,112810,19843,CHO
34,,SING,C11,H112,no,N,34,,112810,19843,CHO
35,,SING,C12,C13,no,N,35,,112810,19843,CHO
36,,SING,C12,H121,no,N,36,,112810,19843,CHO
37,,SING,C12,H122,no,N,37,,112810,19843,CHO
38,,SING,C13,C14,no,N,38,,112810,19843,CHO
39,,SING,C13,C17,no,N,39,,112810,19843,CHO
40,,SING,C13,C18,no,N,40,,112810,19843,CHO
41,,SING,C14,C15,no,N,41,,112810,19843,CHO
42,,SING,C14,H14,no,N,42,,112810,19843,CHO
43,,SING,C15,C16,no,N,43,,112810,19843,CHO
44,,SING,C15,H151,no,N,44,,112810,19843,CHO
45,,SING,C15,H152,no,N,45,,112810,19843,CHO
46,,SING,C16,C17,no,N,46,,112810,19843,CHO
47,,SING,C16,H161,no,N,47,,112810,19843,CHO
4,,SING,CA,C,,,,,240393,6146,DHA_2
48,,SING,C16,H162,no,N,48,,112810,19843,CHO
49,,SING,C17,C20,no,N,49,,112810,19843,CHO
50,,SING,C17,H17,no,N,50,,112810,19843,CHO
51,,SING,C18,H181,no,N,51,,112810,19843,CHO
52,,SING,C18,H182,no,N,52,,112810,19843,CHO
53,,SING,C18,H183,no,N,53,,112810,19843,CHO
54,,SING,C19,H191,no,N,54,,112810,19843,CHO
55,,SING,C19,H192,no,N,55,,112810,19843,CHO
56,,SING,C19,H193,no,N,56,,112810,19843,CHO
57,,SING,C20,C21,no,N,57,,112810,19843,CHO
58,,SING,C20,C22,no,N,58,,112810,19843,CHO
59,,SING,C20,H20,no,N,59,,112810,19843,CHO
60,,SING,C21,H211,no,N,60,,112810,19843,CHO
61,,SING,C21,H212,no,N,61,,112810,19843,CHO
62,,SING,C21,H213,no,N,62,,112810,19843,CHO
63,,SING,C22,C23,no,N,63,,112810,19843,CHO
64,,SING,C22,H221,no,N,64,,112810,19843,CHO
65,,SING,C22,H222,no,N,65,,112810,19843,CHO
66,,SING,C23,C24,no,N,66,,112810,19843,CHO
67,,SING,C23,H231,no,N,67,,112810,19843,CHO
68,,SING,C23,H232,no,N,68,,112810,19843,CHO
69,,DOUB,C24,O24,no,N,69,,112810,19843,CHO
70,,SING,C24,N25,no,N,70,,112810,19843,CHO
71,,SING,N25,C26,no,N,71,,112810,19843,CHO
72,,SING,N25,HN,no,N,72,,112810,19843,CHO
73,,SING,C26,C27,no,N,73,,112810,19843,CHO
74,,SING,C26,H261,no,N,74,,112810,19843,CHO
75,,SING,C26,H262,no,N,75,,112810,19843,CHO
76,,DOUB,C27,OT1,no,N,76,,112810,19843,CHO
77,,SING,C27,OT2,no,N,77,,112810,19843,CHO
78,,SING,OT2,HOT,no,N,78,,112810,19843,CHO
1,,SING,C3A,C3,no,N,1,,113003,19853,FAG
2,,SING,C3A,C4A,no,N,2,,113003,19853,FAG
3,,DOUB,C3A,CBA,no,N,3,,113003,19853,FAG
4,,SING,C3,C2A,no,N,4,,113003,19853,FAG
5,,SING,C3,H31,no,N,5,,113003,19853,FAG
6,,SING,C3,H32,no,N,6,,113003,19853,FAG
7,,SING,C2A,C1,no,N,7,,113003,19853,FAG
8,,SING,C2A,H2A1,no,N,8,,113003,19853,FAG
9,,SING,C2A,H2A2,no,N,9,,113003,19853,FAG
10,,DOUB,C1,O1,no,N,10,,113003,19853,FAG
11,,SING,C1,CBA,no,N,11,,113003,19853,FAG
12,,DOUB,P,O1P,no,N,12,,113003,19853,FAG
13,,SING,P,O2P,no,N,13,,113003,19853,FAG
14,,SING,P,O5',no,N,14,,113003,19853,FAG
15,,SING,O2P,HOP2,no,N,15,,113003,19853,FAG
16,,SING,O5',C5',no,N,16,,113003,19853,FAG
17,,SING,C5',C4',no,N,17,,113003,19853,FAG
18,,SING,C5',H5'1,no,N,18,,113003,19853,FAG
19,,SING,C5',H5'2,no,N,19,,113003,19853,FAG
20,,SING,C4',O4',no,N,20,,113003,19853,FAG
21,,SING,C4',C3',no,N,21,,113003,19853,FAG
22,,SING,C4',H4',no,N,22,,113003,19853,FAG
23,,SING,O4',C1',no,N,23,,113003,19853,FAG
24,,SING,C1',N9,no,N,24,,113003,19853,FAG
25,,SING,C1',C2',no,N,25,,113003,19853,FAG
26,,SING,C1',H1',no,N,26,,113003,19853,FAG
27,,SING,N9,C4,no,N,27,,113003,19853,FAG
28,,SING,N9,HN9,no,N,28,,113003,19853,FAG
29,,SING,C4,N3,no,N,29,,113003,19853,FAG
30,,DOUB,C4,C5,no,N,30,,113003,19853,FAG
31,,DOUB,N3,C2,no,N,31,,113003,19853,FAG
32,,SING,C2,N2,no,N,32,,113003,19853,FAG
33,,SING,C2,N1,no,N,33,,113003,19853,FAG
34,,SING,N2,HN21,no,N,34,,113003,19853,FAG
35,,SING,N2,HN22,no,N,35,,113003,19853,FAG
36,,SING,N1,C6,no,N,36,,113003,19853,FAG
37,,SING,N1,H1,no,N,37,,113003,19853,FAG
38,,DOUB,C6,O6,no,N,38,,113003,19853,FAG
39,,SING,C6,C5,no,N,39,,113003,19853,FAG
40,,SING,C5,N7,no,N,40,,113003,19853,FAG
41,,SING,N7,C8,no,N,41,,113003,19853,FAG
42,,SING,N7,C8A,no,N,42,,113003,19853,FAG
43,,DOUB,C8,O8,no,N,43,,113003,19853,FAG
44,,SING,C8,H8,no,N,44,,113003,19853,FAG
45,,SING,C2',C3',no,N,45,,113003,19853,FAG
46,,SING,C2',H2'1,no,N,46,,113003,19853,FAG
47,,SING,C2',H2'2,no,N,47,,113003,19853,FAG
48,,SING,C3',O3',no,N,48,,113003,19853,FAG
49,,SING,C3',H3',no,N,49,,113003,19853,FAG
50,,SING,O3',HO3',no,N,50,,113003,19853,FAG
51,,SING,C8A,C9,no,N,51,,113003,19853,FAG
52,,SING,C8A,O7,no,N,52,,113003,19853,FAG
53,,SING,C8A,H8A,no,N,53,,113003,19853,FAG
54,,SING,C9,O9,no,N,54,,113003,19853,FAG
55,,SING,C9,C9A,no,N,55,,113003,19853,FAG
56,,SING,C9,H9,no,N,56,,113003,19853,FAG
57,,SING,O9,HO9,no,N,57,,113003,19853,FAG
58,,SING,C9A,C9B,no,N,58,,113003,19853,FAG
59,,SING,C9A,C6A,no,N,59,,113003,19853,FAG
60,,SING,C9A,H9A,no,N,60,,113003,19853,FAG
61,,DOUB,C9B,C5M,yes,N,61,,113003,19853,FAG
62,,SING,C9B,CAA,yes,N,62,,113003,19853,FAG
63,,SING,O7,C6A,no,N,63,,113003,19853,FAG
64,,SING,C6A,O6A,no,N,64,,113003,19853,FAG
65,,SING,C6A,H6A,no,N,65,,113003,19853,FAG
66,,SING,O6A,C5M,no,N,66,,113003,19853,FAG
67,,SING,C5M,C5B,yes,N,67,,113003,19853,FAG
68,,DOUB,C5B,C4B,yes,N,68,,113003,19853,FAG
69,,SING,C5B,H5B,no,N,69,,113003,19853,FAG
70,,SING,C4B,O4,no,N,70,,113003,19853,FAG
71,,SING,C4B,C4A,yes,N,71,,113003,19853,FAG
72,,SING,O4,CM,no,N,72,,113003,19853,FAG
73,,SING,CM,HM1,no,N,73,,113003,19853,FAG
74,,SING,CM,HM2,no,N,74,,113003,19853,FAG
75,,SING,CM,HM3,no,N,75,,113003,19853,FAG
76,,DOUB,C4A,CAA,yes,N,76,,113003,19853,FAG
77,,SING,CAA,O10,no,N,77,,113003,19853,FAG
78,,SING,O10,C11,no,N,78,,113003,19853,FAG
79,,DOUB,C11,O11,no,N,79,,113003,19853,FAG
80,,SING,C11,CBA,no,N,80,,113003,19853,FAG
81,,SING,P,O3P,no,N,81,,113003,19853,FAG
82,,SING,O3P,HOP3,no,N,82,,113003,19853,FAG
1,,SING,CD2,CG,no,N,1,,113064,19856,I4G
2,,SING,OXT,C,no,N,2,,113064,19856,I4G
3,,SING,CB,CG,no,N,3,,113064,19856,I4G
4,,SING,CB,N,no,N,4,,113064,19856,I4G
5,,SING,CG,CD1,no,N,5,,113064,19856,I4G
6,,SING,N,CA,no,N,6,,113064,19856,I4G
7,,DOUB,C,O,no,N,7,,113064,19856,I4G
8,,SING,C,CA,no,N,8,,113064,19856,I4G
9,,SING,N,H2,no,N,9,,113064,19856,I4G
10,,SING,CB,HB2,no,N,10,,113064,19856,I4G
11,,SING,CB,HB3,no,N,11,,113064,19856,I4G
12,,SING,CG,HG,no,N,12,,113064,19856,I4G
13,,SING,CD1,HD13,no,N,13,,113064,19856,I4G
14,,SING,CD1,HD11,no,N,14,,113064,19856,I4G
15,,SING,CD1,HD12,no,N,15,,113064,19856,I4G
16,,SING,CD2,HD23,no,N,16,,113064,19856,I4G
17,,SING,CD2,HD22,no,N,17,,113064,19856,I4G
18,,SING,CD2,HD21,no,N,18,,113064,19856,I4G
19,,SING,CA,HA2,no,N,19,,113064,19856,I4G
20,,SING,CA,HA3,no,N,20,,113064,19856,I4G
21,,SING,OXT,HXT,no,N,21,,113064,19856,I4G
1,,SING,N,HN1,no,N,1,,113065,19856,NH2
2,,SING,N,HN2,no,N,2,,113065,19856,NH2
1,,SING,N,CA,no,N,1,,113087,19857,PTR
2,,SING,N,H,no,N,2,,113087,19857,PTR
3,,SING,N,HN2,no,N,3,,113087,19857,PTR
4,,SING,CA,C,no,N,4,,113087,19857,PTR
5,,SING,CA,CB,no,N,5,,113087,19857,PTR
6,,SING,CA,HA,no,N,6,,113087,19857,PTR
7,,DOUB,C,O,no,N,7,,113087,19857,PTR
8,,SING,C,OXT,no,N,8,,113087,19857,PTR
9,,SING,OXT,HXT,no,N,9,,113087,19857,PTR
10,,SING,CB,CG,no,N,10,,113087,19857,PTR
11,,SING,CB,HB2,no,N,11,,113087,19857,PTR
12,,SING,CB,HB3,no,N,12,,113087,19857,PTR
13,,DOUB,CG,CD1,yes,N,13,,113087,19857,PTR
14,,SING,CG,CD2,yes,N,14,,113087,19857,PTR
15,,SING,CD1,CE1,yes,N,15,,113087,19857,PTR
16,,SING,CD1,HD1,no,N,16,,113087,19857,PTR
17,,DOUB,CD2,CE2,yes,N,17,,113087,19857,PTR
18,,SING,CD2,HD2,no,N,18,,113087,19857,PTR
19,,DOUB,CE1,CZ,yes,N,19,,113087,19857,PTR
20,,SING,CE1,HE1,no,N,20,,113087,19857,PTR
21,,SING,CE2,CZ,yes,N,21,,113087,19857,PTR
22,,SING,CE2,HE2,no,N,22,,113087,19857,PTR
23,,SING,CZ,OH,no,N,23,,113087,19857,PTR
24,,SING,OH,P,no,N,24,,113087,19857,PTR
25,,DOUB,P,O1P,no,N,25,,113087,19857,PTR
26,,SING,P,O2P,no,N,26,,113087,19857,PTR
27,,SING,P,O3P,no,N,27,,113087,19857,PTR
28,,SING,O2P,HO2P,no,N,28,,113087,19857,PTR
29,,SING,O3P,HO3P,no,N,29,,113087,19857,PTR
1,,SING,N,CA,no,N,1,,113088,19857,TPO
2,,SING,N,H,no,N,2,,113088,19857,TPO
3,,SING,N,H2,no,N,3,,113088,19857,TPO
4,,SING,CA,CB,no,N,4,,113088,19857,TPO
5,,SING,CA,C,no,N,5,,113088,19857,TPO
6,,SING,CA,HA,no,N,6,,113088,19857,TPO
7,,SING,CB,CG2,no,N,7,,113088,19857,TPO
8,,SING,CB,OG1,no,N,8,,113088,19857,TPO
9,,SING,CB,HB,no,N,9,,113088,19857,TPO
10,,SING,CG2,HG21,no,N,10,,113088,19857,TPO
11,,SING,CG2,HG22,no,N,11,,113088,19857,TPO
12,,SING,CG2,HG23,no,N,12,,113088,19857,TPO
13,,SING,OG1,P,no,N,13,,113088,19857,TPO
14,,DOUB,P,O1P,no,N,14,,113088,19857,TPO
15,,SING,P,O2P,no,N,15,,113088,19857,TPO
16,,SING,P,O3P,no,N,16,,113088,19857,TPO
17,,SING,O2P,HOP2,no,N,17,,113088,19857,TPO
18,,SING,O3P,HOP3,no,N,18,,113088,19857,TPO
19,,DOUB,C,O,no,N,19,,113088,19857,TPO
20,,SING,C,OXT,no,N,20,,113088,19857,TPO
21,,SING,OXT,HXT,no,N,21,,113088,19857,TPO
1,,SING,N,CA,no,N,1,,113112,19858,TPO
2,,SING,N,H,no,N,2,,113112,19858,TPO
3,,SING,N,H2,no,N,3,,113112,19858,TPO
4,,SING,CA,CB,no,N,4,,113112,19858,TPO
5,,SING,CA,C,no,N,5,,113112,19858,TPO
6,,SING,CA,HA,no,N,6,,113112,19858,TPO
7,,SING,CB,CG2,no,N,7,,113112,19858,TPO
8,,SING,CB,OG1,no,N,8,,113112,19858,TPO
9,,SING,CB,HB,no,N,9,,113112,19858,TPO
10,,SING,CG2,HG21,no,N,10,,113112,19858,TPO
11,,SING,CG2,HG22,no,N,11,,113112,19858,TPO
12,,SING,CG2,HG23,no,N,12,,113112,19858,TPO
13,,SING,OG1,P,no,N,13,,113112,19858,TPO
14,,DOUB,P,O1P,no,N,14,,113112,19858,TPO
15,,SING,P,O2P,no,N,15,,113112,19858,TPO
16,,SING,P,O3P,no,N,16,,113112,19858,TPO
17,,SING,O2P,HOP2,no,N,17,,113112,19858,TPO
18,,SING,O3P,HOP3,no,N,18,,113112,19858,TPO
19,,DOUB,C,O,no,N,19,,113112,19858,TPO
20,,SING,C,OXT,no,N,20,,113112,19858,TPO
21,,SING,OXT,HXT,no,N,21,,113112,19858,TPO
1,,SING,C3A,C3,no,N,1,,113174,19861,FAG
2,,SING,C3A,C4A,no,N,2,,113174,19861,FAG
3,,DOUB,C3A,CBA,no,N,3,,113174,19861,FAG
4,,SING,C3,C2A,no,N,4,,113174,19861,FAG
5,,SING,C3,H31,no,N,5,,113174,19861,FAG
6,,SING,C3,H32,no,N,6,,113174,19861,FAG
7,,SING,C2A,C1,no,N,7,,113174,19861,FAG
8,,SING,C2A,H2A1,no,N,8,,113174,19861,FAG
9,,SING,C2A,H2A2,no,N,9,,113174,19861,FAG
10,,DOUB,C1,O1,no,N,10,,113174,19861,FAG
11,,SING,C1,CBA,no,N,11,,113174,19861,FAG
12,,DOUB,P,O1P,no,N,12,,113174,19861,FAG
13,,SING,P,O2P,no,N,13,,113174,19861,FAG
14,,SING,P,O5',no,N,14,,113174,19861,FAG
15,,SING,O2P,HOP2,no,N,15,,113174,19861,FAG
16,,SING,O5',C5',no,N,16,,113174,19861,FAG
17,,SING,C5',C4',no,N,17,,113174,19861,FAG
18,,SING,C5',H5'1,no,N,18,,113174,19861,FAG
19,,SING,C5',H5'2,no,N,19,,113174,19861,FAG
20,,SING,C4',O4',no,N,20,,113174,19861,FAG
21,,SING,C4',C3',no,N,21,,113174,19861,FAG
22,,SING,C4',H4',no,N,22,,113174,19861,FAG
23,,SING,O4',C1',no,N,23,,113174,19861,FAG
24,,SING,C1',N9,no,N,24,,113174,19861,FAG
25,,SING,C1',C2',no,N,25,,113174,19861,FAG
26,,SING,C1',H1',no,N,26,,113174,19861,FAG
27,,SING,N9,C4,no,N,27,,113174,19861,FAG
28,,SING,N9,HN9,no,N,28,,113174,19861,FAG
29,,SING,C4,N3,no,N,29,,113174,19861,FAG
30,,DOUB,C4,C5,no,N,30,,113174,19861,FAG
31,,DOUB,N3,C2,no,N,31,,113174,19861,FAG
32,,SING,C2,N2,no,N,32,,113174,19861,FAG
33,,SING,C2,N1,no,N,33,,113174,19861,FAG
34,,SING,N2,HN21,no,N,34,,113174,19861,FAG
35,,SING,N2,HN22,no,N,35,,113174,19861,FAG
36,,SING,N1,C6,no,N,36,,113174,19861,FAG
37,,SING,N1,H1,no,N,37,,113174,19861,FAG
38,,DOUB,C6,O6,no,N,38,,113174,19861,FAG
39,,SING,C6,C5,no,N,39,,113174,19861,FAG
40,,SING,C5,N7,no,N,40,,113174,19861,FAG
41,,SING,N7,C8,no,N,41,,113174,19861,FAG
42,,SING,N7,C8A,no,N,42,,113174,19861,FAG
43,,DOUB,C8,O8,no,N,43,,113174,19861,FAG
44,,SING,C8,H8,no,N,44,,113174,19861,FAG
45,,SING,C2',C3',no,N,45,,113174,19861,FAG
46,,SING,C2',H2'1,no,N,46,,113174,19861,FAG
47,,SING,C2',H2'2,no,N,47,,113174,19861,FAG
48,,SING,C3',O3',no,N,48,,113174,19861,FAG
49,,SING,C3',H3',no,N,49,,113174,19861,FAG
50,,SING,O3',HO3',no,N,50,,113174,19861,FAG
51,,SING,C8A,C9,no,N,51,,113174,19861,FAG
52,,SING,C8A,O7,no,N,52,,113174,19861,FAG
53,,SING,C8A,H8A,no,N,53,,113174,19861,FAG
54,,SING,C9,O9,no,N,54,,113174,19861,FAG
55,,SING,C9,C9A,no,N,55,,113174,19861,FAG
56,,SING,C9,H9,no,N,56,,113174,19861,FAG
57,,SING,O9,HO9,no,N,57,,113174,19861,FAG
58,,SING,C9A,C9B,no,N,58,,113174,19861,FAG
59,,SING,C9A,C6A,no,N,59,,113174,19861,FAG
60,,SING,C9A,H9A,no,N,60,,113174,19861,FAG
61,,DOUB,C9B,C5M,yes,N,61,,113174,19861,FAG
62,,SING,C9B,CAA,yes,N,62,,113174,19861,FAG
63,,SING,O7,C6A,no,N,63,,113174,19861,FAG
64,,SING,C6A,O6A,no,N,64,,113174,19861,FAG
65,,SING,C6A,H6A,no,N,65,,113174,19861,FAG
66,,SING,O6A,C5M,no,N,66,,113174,19861,FAG
67,,SING,C5M,C5B,yes,N,67,,113174,19861,FAG
68,,DOUB,C5B,C4B,yes,N,68,,113174,19861,FAG
69,,SING,C5B,H5B,no,N,69,,113174,19861,FAG
70,,SING,C4B,O4,no,N,70,,113174,19861,FAG
71,,SING,C4B,C4A,yes,N,71,,113174,19861,FAG
72,,SING,O4,CM,no,N,72,,113174,19861,FAG
73,,SING,CM,HM1,no,N,73,,113174,19861,FAG
74,,SING,CM,HM2,no,N,74,,113174,19861,FAG
75,,SING,CM,HM3,no,N,75,,113174,19861,FAG
76,,DOUB,C4A,CAA,yes,N,76,,113174,19861,FAG
77,,SING,CAA,O10,no,N,77,,113174,19861,FAG
78,,SING,O10,C11,no,N,78,,113174,19861,FAG
79,,DOUB,C11,O11,no,N,79,,113174,19861,FAG
80,,SING,C11,CBA,no,N,80,,113174,19861,FAG
81,,SING,P,O3P,no,N,81,,113174,19861,FAG
82,,SING,O3P,HOP3,no,N,82,,113174,19861,FAG
1,,SING,C3A,C3,no,N,1,,113193,19862,FAG
2,,SING,C3A,C4A,no,N,2,,113193,19862,FAG
3,,DOUB,C3A,CBA,no,N,3,,113193,19862,FAG
4,,SING,C3,C2A,no,N,4,,113193,19862,FAG
5,,SING,C3,H31,no,N,5,,113193,19862,FAG
6,,SING,C3,H32,no,N,6,,113193,19862,FAG
7,,SING,C2A,C1,no,N,7,,113193,19862,FAG
8,,SING,C2A,H2A1,no,N,8,,113193,19862,FAG
9,,SING,C2A,H2A2,no,N,9,,113193,19862,FAG
10,,DOUB,C1,O1,no,N,10,,113193,19862,FAG
11,,SING,C1,CBA,no,N,11,,113193,19862,FAG
12,,DOUB,P,O1P,no,N,12,,113193,19862,FAG
13,,SING,P,O2P,no,N,13,,113193,19862,FAG
14,,SING,P,O5',no,N,14,,113193,19862,FAG
15,,SING,O2P,HOP2,no,N,15,,113193,19862,FAG
16,,SING,O5',C5',no,N,16,,113193,19862,FAG
17,,SING,C5',C4',no,N,17,,113193,19862,FAG
5,,SING,CB,HB2,,,,,240393,6146,DHA_2
18,,SING,C5',H5'1,no,N,18,,113193,19862,FAG
19,,SING,C5',H5'2,no,N,19,,113193,19862,FAG
20,,SING,C4',O4',no,N,20,,113193,19862,FAG
21,,SING,C4',C3',no,N,21,,113193,19862,FAG
22,,SING,C4',H4',no,N,22,,113193,19862,FAG
23,,SING,O4',C1',no,N,23,,113193,19862,FAG
24,,SING,C1',N9,no,N,24,,113193,19862,FAG
25,,SING,C1',C2',no,N,25,,113193,19862,FAG
26,,SING,C1',H1',no,N,26,,113193,19862,FAG
27,,SING,N9,C4,no,N,27,,113193,19862,FAG
28,,SING,N9,HN9,no,N,28,,113193,19862,FAG
29,,SING,C4,N3,no,N,29,,113193,19862,FAG
30,,DOUB,C4,C5,no,N,30,,113193,19862,FAG
31,,DOUB,N3,C2,no,N,31,,113193,19862,FAG
32,,SING,C2,N2,no,N,32,,113193,19862,FAG
33,,SING,C2,N1,no,N,33,,113193,19862,FAG
34,,SING,N2,HN21,no,N,34,,113193,19862,FAG
35,,SING,N2,HN22,no,N,35,,113193,19862,FAG
36,,SING,N1,C6,no,N,36,,113193,19862,FAG
37,,SING,N1,H1,no,N,37,,113193,19862,FAG
38,,DOUB,C6,O6,no,N,38,,113193,19862,FAG
39,,SING,C6,C5,no,N,39,,113193,19862,FAG
40,,SING,C5,N7,no,N,40,,113193,19862,FAG
41,,SING,N7,C8,no,N,41,,113193,19862,FAG
42,,SING,N7,C8A,no,N,42,,113193,19862,FAG
43,,DOUB,C8,O8,no,N,43,,113193,19862,FAG
44,,SING,C8,H8,no,N,44,,113193,19862,FAG
45,,SING,C2',C3',no,N,45,,113193,19862,FAG
46,,SING,C2',H2'1,no,N,46,,113193,19862,FAG
47,,SING,C2',H2'2,no,N,47,,113193,19862,FAG
48,,SING,C3',O3',no,N,48,,113193,19862,FAG
49,,SING,C3',H3',no,N,49,,113193,19862,FAG
50,,SING,O3',HO3',no,N,50,,113193,19862,FAG
51,,SING,C8A,C9,no,N,51,,113193,19862,FAG
52,,SING,C8A,O7,no,N,52,,113193,19862,FAG
53,,SING,C8A,H8A,no,N,53,,113193,19862,FAG
54,,SING,C9,O9,no,N,54,,113193,19862,FAG
55,,SING,C9,C9A,no,N,55,,113193,19862,FAG
56,,SING,C9,H9,no,N,56,,113193,19862,FAG
57,,SING,O9,HO9,no,N,57,,113193,19862,FAG
58,,SING,C9A,C9B,no,N,58,,113193,19862,FAG
59,,SING,C9A,C6A,no,N,59,,113193,19862,FAG
60,,SING,C9A,H9A,no,N,60,,113193,19862,FAG
61,,DOUB,C9B,C5M,yes,N,61,,113193,19862,FAG
62,,SING,C9B,CAA,yes,N,62,,113193,19862,FAG
63,,SING,O7,C6A,no,N,63,,113193,19862,FAG
64,,SING,C6A,O6A,no,N,64,,113193,19862,FAG
65,,SING,C6A,H6A,no,N,65,,113193,19862,FAG
66,,SING,O6A,C5M,no,N,66,,113193,19862,FAG
67,,SING,C5M,C5B,yes,N,67,,113193,19862,FAG
68,,DOUB,C5B,C4B,yes,N,68,,113193,19862,FAG
69,,SING,C5B,H5B,no,N,69,,113193,19862,FAG
70,,SING,C4B,O4,no,N,70,,113193,19862,FAG
71,,SING,C4B,C4A,yes,N,71,,113193,19862,FAG
72,,SING,O4,CM,no,N,72,,113193,19862,FAG
73,,SING,CM,HM1,no,N,73,,113193,19862,FAG
74,,SING,CM,HM2,no,N,74,,113193,19862,FAG
75,,SING,CM,HM3,no,N,75,,113193,19862,FAG
76,,DOUB,C4A,CAA,yes,N,76,,113193,19862,FAG
77,,SING,CAA,O10,no,N,77,,113193,19862,FAG
78,,SING,O10,C11,no,N,78,,113193,19862,FAG
79,,DOUB,C11,O11,no,N,79,,113193,19862,FAG
80,,SING,C11,CBA,no,N,80,,113193,19862,FAG
81,,SING,P,O3P,no,N,81,,113193,19862,FAG
82,,SING,O3P,HOP3,no,N,82,,113193,19862,FAG
1,,SING,C3A,C3,no,N,1,,113212,19863,FAG
2,,SING,C3A,C4A,no,N,2,,113212,19863,FAG
3,,DOUB,C3A,CBA,no,N,3,,113212,19863,FAG
4,,SING,C3,C2A,no,N,4,,113212,19863,FAG
5,,SING,C3,H31,no,N,5,,113212,19863,FAG
6,,SING,C3,H32,no,N,6,,113212,19863,FAG
7,,SING,C2A,C1,no,N,7,,113212,19863,FAG
8,,SING,C2A,H2A1,no,N,8,,113212,19863,FAG
9,,SING,C2A,H2A2,no,N,9,,113212,19863,FAG
10,,DOUB,C1,O1,no,N,10,,113212,19863,FAG
11,,SING,C1,CBA,no,N,11,,113212,19863,FAG
12,,DOUB,P,O1P,no,N,12,,113212,19863,FAG
13,,SING,P,O2P,no,N,13,,113212,19863,FAG
14,,SING,P,O5',no,N,14,,113212,19863,FAG
15,,SING,O2P,HOP2,no,N,15,,113212,19863,FAG
16,,SING,O5',C5',no,N,16,,113212,19863,FAG
17,,SING,C5',C4',no,N,17,,113212,19863,FAG
18,,SING,C5',H5'1,no,N,18,,113212,19863,FAG
19,,SING,C5',H5'2,no,N,19,,113212,19863,FAG
20,,SING,C4',O4',no,N,20,,113212,19863,FAG
21,,SING,C4',C3',no,N,21,,113212,19863,FAG
22,,SING,C4',H4',no,N,22,,113212,19863,FAG
23,,SING,O4',C1',no,N,23,,113212,19863,FAG
24,,SING,C1',N9,no,N,24,,113212,19863,FAG
25,,SING,C1',C2',no,N,25,,113212,19863,FAG
26,,SING,C1',H1',no,N,26,,113212,19863,FAG
27,,SING,N9,C4,no,N,27,,113212,19863,FAG
28,,SING,N9,HN9,no,N,28,,113212,19863,FAG
29,,SING,C4,N3,no,N,29,,113212,19863,FAG
30,,DOUB,C4,C5,no,N,30,,113212,19863,FAG
31,,DOUB,N3,C2,no,N,31,,113212,19863,FAG
32,,SING,C2,N2,no,N,32,,113212,19863,FAG
33,,SING,C2,N1,no,N,33,,113212,19863,FAG
34,,SING,N2,HN21,no,N,34,,113212,19863,FAG
35,,SING,N2,HN22,no,N,35,,113212,19863,FAG
36,,SING,N1,C6,no,N,36,,113212,19863,FAG
37,,SING,N1,H1,no,N,37,,113212,19863,FAG
38,,DOUB,C6,O6,no,N,38,,113212,19863,FAG
39,,SING,C6,C5,no,N,39,,113212,19863,FAG
40,,SING,C5,N7,no,N,40,,113212,19863,FAG
41,,SING,N7,C8,no,N,41,,113212,19863,FAG
42,,SING,N7,C8A,no,N,42,,113212,19863,FAG
43,,DOUB,C8,O8,no,N,43,,113212,19863,FAG
44,,SING,C8,H8,no,N,44,,113212,19863,FAG
45,,SING,C2',C3',no,N,45,,113212,19863,FAG
46,,SING,C2',H2'1,no,N,46,,113212,19863,FAG
47,,SING,C2',H2'2,no,N,47,,113212,19863,FAG
48,,SING,C3',O3',no,N,48,,113212,19863,FAG
49,,SING,C3',H3',no,N,49,,113212,19863,FAG
50,,SING,O3',HO3',no,N,50,,113212,19863,FAG
51,,SING,C8A,C9,no,N,51,,113212,19863,FAG
52,,SING,C8A,O7,no,N,52,,113212,19863,FAG
53,,SING,C8A,H8A,no,N,53,,113212,19863,FAG
54,,SING,C9,O9,no,N,54,,113212,19863,FAG
55,,SING,C9,C9A,no,N,55,,113212,19863,FAG
56,,SING,C9,H9,no,N,56,,113212,19863,FAG
57,,SING,O9,HO9,no,N,57,,113212,19863,FAG
58,,SING,C9A,C9B,no,N,58,,113212,19863,FAG
59,,SING,C9A,C6A,no,N,59,,113212,19863,FAG
60,,SING,C9A,H9A,no,N,60,,113212,19863,FAG
61,,DOUB,C9B,C5M,yes,N,61,,113212,19863,FAG
62,,SING,C9B,CAA,yes,N,62,,113212,19863,FAG
63,,SING,O7,C6A,no,N,63,,113212,19863,FAG
64,,SING,C6A,O6A,no,N,64,,113212,19863,FAG
65,,SING,C6A,H6A,no,N,65,,113212,19863,FAG
66,,SING,O6A,C5M,no,N,66,,113212,19863,FAG
67,,SING,C5M,C5B,yes,N,67,,113212,19863,FAG
68,,DOUB,C5B,C4B,yes,N,68,,113212,19863,FAG
69,,SING,C5B,H5B,no,N,69,,113212,19863,FAG
70,,SING,C4B,O4,no,N,70,,113212,19863,FAG
71,,SING,C4B,C4A,yes,N,71,,113212,19863,FAG
72,,SING,O4,CM,no,N,72,,113212,19863,FAG
73,,SING,CM,HM1,no,N,73,,113212,19863,FAG
74,,SING,CM,HM2,no,N,74,,113212,19863,FAG
75,,SING,CM,HM3,no,N,75,,113212,19863,FAG
76,,DOUB,C4A,CAA,yes,N,76,,113212,19863,FAG
77,,SING,CAA,O10,no,N,77,,113212,19863,FAG
78,,SING,O10,C11,no,N,78,,113212,19863,FAG
79,,DOUB,C11,O11,no,N,79,,113212,19863,FAG
80,,SING,C11,CBA,no,N,80,,113212,19863,FAG
81,,SING,P,O3P,no,N,81,,113212,19863,FAG
82,,SING,O3P,HOP3,no,N,82,,113212,19863,FAG
1,,DOUB,P,OP1,no,N,1,,113213,19863,7GU
2,,SING,P,OP2,no,N,2,,113213,19863,7GU
3,,SING,P,O5',no,N,3,,113213,19863,7GU
4,,SING,P,OP3,no,N,4,,113213,19863,7GU
5,,SING,OP2,HOP2,no,N,5,,113213,19863,7GU
6,,SING,O5',C5',no,N,6,,113213,19863,7GU
7,,SING,N9,C4,yes,N,7,,113213,19863,7GU
8,,SING,N9,C8,yes,N,8,,113213,19863,7GU
9,,SING,N9,C1',no,N,9,,113213,19863,7GU
10,,SING,C4,N3,no,N,10,,113213,19863,7GU
11,,DOUB,C4,C5,yes,N,11,,113213,19863,7GU
12,,DOUB,N3,C2,no,N,12,,113213,19863,7GU
13,,SING,C2,N2,no,N,13,,113213,19863,7GU
14,,SING,C2,N1,no,N,14,,113213,19863,7GU
15,,SING,N2,HN21,no,N,15,,113213,19863,7GU
16,,SING,N2,HN22,no,N,16,,113213,19863,7GU
17,,SING,N1,C6,no,N,17,,113213,19863,7GU
18,,SING,N1,HN1,no,N,18,,113213,19863,7GU
19,,DOUB,C6,O6,no,N,19,,113213,19863,7GU
20,,SING,C6,C5,no,N,20,,113213,19863,7GU
21,,SING,C5,C7,yes,N,21,,113213,19863,7GU
22,,DOUB,C7,C8,yes,N,22,,113213,19863,7GU
23,,SING,C7,H7,no,N,23,,113213,19863,7GU
24,,SING,C8,H8,no,N,24,,113213,19863,7GU
25,,SING,C2',C1',no,N,25,,113213,19863,7GU
26,,SING,C2',C3',no,N,26,,113213,19863,7GU
27,,SING,C2',H2',no,N,27,,113213,19863,7GU
28,,SING,C2',H2'',no,N,28,,113213,19863,7GU
29,,SING,C5',C4',no,N,29,,113213,19863,7GU
30,,SING,C5',H5',no,N,30,,113213,19863,7GU
31,,SING,C5',H5'',no,N,31,,113213,19863,7GU
32,,SING,C4',O4',no,N,32,,113213,19863,7GU
33,,SING,C4',C3',no,N,33,,113213,19863,7GU
34,,SING,C4',H4',no,N,34,,113213,19863,7GU
35,,SING,O4',C1',no,N,35,,113213,19863,7GU
36,,SING,C1',H1',no,N,36,,113213,19863,7GU
37,,SING,C3',O3',no,N,37,,113213,19863,7GU
38,,SING,C3',H3',no,N,38,,113213,19863,7GU
39,,SING,O3',HO3',no,N,39,,113213,19863,7GU
40,,SING,OP3,HOP3,no,N,40,,113213,19863,7GU
1,,DOUB,P,OP1,no,N,1,,113364,19873,H2U
2,,SING,P,OP2,no,N,2,,113364,19873,H2U
3,,SING,P,OP3,no,N,3,,113364,19873,H2U
4,,SING,P,O5',no,N,4,,113364,19873,H2U
5,,SING,OP2,HOP2,no,N,5,,113364,19873,H2U
6,,SING,OP3,HOP3,no,N,6,,113364,19873,H2U
7,,SING,O5',C5',no,N,7,,113364,19873,H2U
8,,SING,C5',C4',no,N,8,,113364,19873,H2U
9,,SING,C5',H5',no,N,9,,113364,19873,H2U
10,,SING,C5',H5'',no,N,10,,113364,19873,H2U
11,,SING,C4',O4',no,N,11,,113364,19873,H2U
12,,SING,C4',C3',no,N,12,,113364,19873,H2U
13,,SING,C4',H4',no,N,13,,113364,19873,H2U
14,,SING,O4',C1',no,N,14,,113364,19873,H2U
15,,SING,C3',O3',no,N,15,,113364,19873,H2U
16,,SING,C3',C2',no,N,16,,113364,19873,H2U
17,,SING,C3',H3',no,N,17,,113364,19873,H2U
18,,SING,O3',HO3',no,N,18,,113364,19873,H2U
19,,SING,C1',C2',no,N,19,,113364,19873,H2U
20,,SING,C1',N1,no,N,20,,113364,19873,H2U
21,,SING,C1',H1',no,N,21,,113364,19873,H2U
22,,SING,C2',O2',no,N,22,,113364,19873,H2U
23,,SING,C2',H2',no,N,23,,113364,19873,H2U
24,,SING,O2',HO2',no,N,24,,113364,19873,H2U
25,,SING,N1,C2,no,N,25,,113364,19873,H2U
26,,SING,N1,C6,no,N,26,,113364,19873,H2U
27,,DOUB,C2,O2,no,N,27,,113364,19873,H2U
28,,SING,C2,N3,no,N,28,,113364,19873,H2U
29,,SING,N3,C4,no,N,29,,113364,19873,H2U
30,,SING,N3,HN3,no,N,30,,113364,19873,H2U
31,,DOUB,C4,O4,no,N,31,,113364,19873,H2U
32,,SING,C4,C5,no,N,32,,113364,19873,H2U
33,,SING,C5,C6,no,N,33,,113364,19873,H2U
34,,SING,C5,H51,no,N,34,,113364,19873,H2U
35,,SING,C5,H52,no,N,35,,113364,19873,H2U
36,,SING,C6,H61,no,N,36,,113364,19873,H2U
37,,SING,C6,H62,no,N,37,,113364,19873,H2U
1,,SING,N,CA,no,N,1,,113474,19880,PCA
2,,SING,N,CD,no,N,2,,113474,19880,PCA
3,,SING,N,H,no,N,3,,113474,19880,PCA
4,,SING,CA,CB,no,N,4,,113474,19880,PCA
5,,SING,CA,C,no,N,5,,113474,19880,PCA
6,,SING,CA,HA,no,N,6,,113474,19880,PCA
7,,SING,CB,CG,no,N,7,,113474,19880,PCA
8,,SING,CB,HB2,no,N,8,,113474,19880,PCA
9,,SING,CB,HB3,no,N,9,,113474,19880,PCA
10,,SING,CG,CD,no,N,10,,113474,19880,PCA
11,,SING,CG,HG2,no,N,11,,113474,19880,PCA
12,,SING,CG,HG3,no,N,12,,113474,19880,PCA
13,,DOUB,CD,OE,no,N,13,,113474,19880,PCA
14,,DOUB,C,O,no,N,14,,113474,19880,PCA
15,,SING,C,OXT,no,N,15,,113474,19880,PCA
16,,SING,OXT,HXT,no,N,16,,113474,19880,PCA
1,,SING,CD2,CG,no,N,1,,113521,19882,I4G
2,,SING,OXT,C,no,N,2,,113521,19882,I4G
3,,SING,CB,CG,no,N,3,,113521,19882,I4G
4,,SING,CB,N,no,N,4,,113521,19882,I4G
5,,SING,CG,CD1,no,N,5,,113521,19882,I4G
6,,SING,N,CA,no,N,6,,113521,19882,I4G
7,,DOUB,C,O,no,N,7,,113521,19882,I4G
8,,SING,C,CA,no,N,8,,113521,19882,I4G
9,,SING,N,H2,no,N,9,,113521,19882,I4G
10,,SING,CB,HB2,no,N,10,,113521,19882,I4G
11,,SING,CB,HB3,no,N,11,,113521,19882,I4G
12,,SING,CG,HG,no,N,12,,113521,19882,I4G
13,,SING,CD1,HD13,no,N,13,,113521,19882,I4G
14,,SING,CD1,HD11,no,N,14,,113521,19882,I4G
15,,SING,CD1,HD12,no,N,15,,113521,19882,I4G
16,,SING,CD2,HD23,no,N,16,,113521,19882,I4G
17,,SING,CD2,HD22,no,N,17,,113521,19882,I4G
18,,SING,CD2,HD21,no,N,18,,113521,19882,I4G
19,,SING,CA,HA2,no,N,19,,113521,19882,I4G
20,,SING,CA,HA3,no,N,20,,113521,19882,I4G
21,,SING,OXT,HXT,no,N,21,,113521,19882,I4G
1,,SING,N,HN1,no,N,1,,113522,19882,NH2
2,,SING,N,HN2,no,N,2,,113522,19882,NH2
1,,SING,CD2,CG,no,N,1,,113541,19883,I4G
2,,SING,OXT,C,no,N,2,,113541,19883,I4G
3,,SING,CB,CG,no,N,3,,113541,19883,I4G
4,,SING,CB,N,no,N,4,,113541,19883,I4G
5,,SING,CG,CD1,no,N,5,,113541,19883,I4G
6,,SING,N,CA,no,N,6,,113541,19883,I4G
7,,DOUB,C,O,no,N,7,,113541,19883,I4G
8,,SING,C,CA,no,N,8,,113541,19883,I4G
9,,SING,N,H2,no,N,9,,113541,19883,I4G
10,,SING,CB,HB2,no,N,10,,113541,19883,I4G
11,,SING,CB,HB3,no,N,11,,113541,19883,I4G
12,,SING,CG,HG,no,N,12,,113541,19883,I4G
13,,SING,CD1,HD13,no,N,13,,113541,19883,I4G
14,,SING,CD1,HD11,no,N,14,,113541,19883,I4G
15,,SING,CD1,HD12,no,N,15,,113541,19883,I4G
16,,SING,CD2,HD23,no,N,16,,113541,19883,I4G
17,,SING,CD2,HD22,no,N,17,,113541,19883,I4G
18,,SING,CD2,HD21,no,N,18,,113541,19883,I4G
19,,SING,CA,HA2,no,N,19,,113541,19883,I4G
20,,SING,CA,HA3,no,N,20,,113541,19883,I4G
21,,SING,OXT,HXT,no,N,21,,113541,19883,I4G
1,,SING,N,HN1,no,N,1,,113542,19883,NH2
2,,SING,N,HN2,no,N,2,,113542,19883,NH2
1,,SING,C21,C20,no,N,1,,113623,19888,3BF
2,,SING,C28,C20,no,N,2,,113623,19888,3BF
3,,SING,C20,C17,no,N,3,,113623,19888,3BF
4,,SING,C11,N11,no,N,4,,113623,19888,3BF
5,,SING,S16,C17,yes,N,5,,113623,19888,3BF
6,,SING,S16,C15,yes,N,6,,113623,19888,3BF
7,,DOUB,O12,C14,no,N,7,,113623,19888,3BF
8,,DOUB,C17,C18,yes,N,8,,113623,19888,3BF
9,,SING,N11,C10,yes,N,9,,113623,19888,3BF
10,,SING,N11,C12,yes,N,10,,113623,19888,3BF
11,,SING,C29,N26,no,N,11,,113623,19888,3BF
12,,SING,C14,C12,no,N,12,,113623,19888,3BF
13,,SING,C14,N14,no,N,13,,113623,19888,3BF
14,,DOUB,O22,C22,no,N,14,,113623,19888,3BF
15,,SING,C18,C22,no,N,15,,113623,19888,3BF
16,,SING,C18,N19,yes,N,16,,113623,19888,3BF
17,,SING,C15,N14,no,N,17,,113623,19888,3BF
18,,DOUB,C15,N19,yes,N,18,,113623,19888,3BF
19,,DOUB,C10,C9,yes,N,19,,113623,19888,3BF
20,,DOUB,C12,C13,yes,N,20,,113623,19888,3BF
21,,SING,C22,N22,no,N,21,,113623,19888,3BF
6,,SING,CB,HB3,,,,,240393,6146,DHA_2
22,,SING,N26,C27,no,N,22,,113623,19888,3BF
23,,SING,N26,C25,no,N,23,,113623,19888,3BF
24,,SING,C9,C13,yes,N,24,,113623,19888,3BF
25,,SING,C9,N8,no,N,25,,113623,19888,3BF
26,,SING,C25,C24,no,N,26,,113623,19888,3BF
27,,DOUB,O7,C7,no,N,27,,113623,19888,3BF
28,,SING,N22,C23,no,N,28,,113623,19888,3BF
29,,SING,N8,C7,no,N,29,,113623,19888,3BF
30,,SING,C7,C6,no,N,30,,113623,19888,3BF
31,,SING,C23,C24,no,N,31,,113623,19888,3BF
32,,SING,C5,N5,no,N,32,,113623,19888,3BF
33,,SING,C6,N5,yes,N,33,,113623,19888,3BF
34,,DOUB,C6,N6,yes,N,34,,113623,19888,3BF
35,,SING,N5,C4,yes,N,35,,113623,19888,3BF
36,,SING,N6,C3,yes,N,36,,113623,19888,3BF
37,,DOUB,C4,C3,yes,N,37,,113623,19888,3BF
38,,SING,C3,N2,no,N,38,,113623,19888,3BF
39,,SING,N2,C1',no,N,39,,113623,19888,3BF
40,,DOUB,O1',C1',no,N,40,,113623,19888,3BF
41,,SING,C1',C1,no,N,41,,113623,19888,3BF
42,,SING,N2,H2,no,N,42,,113623,19888,3BF
43,,SING,C4,H4,no,N,43,,113623,19888,3BF
44,,SING,N8,H8,no,N,44,,113623,19888,3BF
45,,SING,C10,H10,no,N,45,,113623,19888,3BF
46,,SING,C11,H111,no,N,46,,113623,19888,3BF
47,,SING,C11,H112,no,N,47,,113623,19888,3BF
48,,SING,C11,H113,no,N,48,,113623,19888,3BF
49,,SING,C1,H102,no,N,49,,113623,19888,3BF
50,,SING,C1,H101,no,N,50,,113623,19888,3BF
51,,SING,C1,H103,no,N,51,,113623,19888,3BF
52,,SING,C5,H53,no,N,52,,113623,19888,3BF
53,,SING,C5,H51,no,N,53,,113623,19888,3BF
54,,SING,C5,H52,no,N,54,,113623,19888,3BF
55,,SING,C13,H13,no,N,55,,113623,19888,3BF
56,,SING,N14,H14,no,N,56,,113623,19888,3BF
57,,SING,C20,H20,no,N,57,,113623,19888,3BF
58,,SING,C21,H212,no,N,58,,113623,19888,3BF
59,,SING,C21,H211,no,N,59,,113623,19888,3BF
60,,SING,C21,H213,no,N,60,,113623,19888,3BF
61,,SING,C28,H283,no,N,61,,113623,19888,3BF
62,,SING,C28,H281,no,N,62,,113623,19888,3BF
63,,SING,C28,H282,no,N,63,,113623,19888,3BF
64,,SING,N22,H22,no,N,64,,113623,19888,3BF
65,,SING,C23,H232,no,N,65,,113623,19888,3BF
66,,SING,C23,H231,no,N,66,,113623,19888,3BF
67,,SING,C24,H242,no,N,67,,113623,19888,3BF
68,,SING,C24,H241,no,N,68,,113623,19888,3BF
69,,SING,C25,H251,no,N,69,,113623,19888,3BF
70,,SING,C25,H252,no,N,70,,113623,19888,3BF
71,,SING,C29,H291,no,N,71,,113623,19888,3BF
72,,SING,C29,H293,no,N,72,,113623,19888,3BF
73,,SING,C29,H292,no,N,73,,113623,19888,3BF
74,,SING,C27,H273,no,N,74,,113623,19888,3BF
75,,SING,C27,H272,no,N,75,,113623,19888,3BF
76,,SING,C27,H271,no,N,76,,113623,19888,3BF
77,,SING,N26,H26,no,N,77,,113623,19888,3BF
1,,SING,C34,N33,no,N,1,,113643,19889,3B5
2,,SING,C27,C25,no,N,2,,113643,19889,3B5
3,,SING,C35,N33,no,N,3,,113643,19889,3B5
4,,SING,C32,N33,no,N,4,,113643,19889,3B5
5,,SING,C32,C31,no,N,5,,113643,19889,3B5
6,,DOUB,O28,C28,no,N,6,,113643,19889,3B5
7,,SING,C25,C26,no,N,7,,113643,19889,3B5
8,,SING,C25,C24,no,N,8,,113643,19889,3B5
9,,SING,C31,C30,no,N,9,,113643,19889,3B5
10,,SING,C30,N29,no,N,10,,113643,19889,3B5
11,,SING,C28,N29,no,N,11,,113643,19889,3B5
12,,SING,C28,C23,no,N,12,,113643,19889,3B5
13,,DOUB,C24,C23,yes,N,13,,113643,19889,3B5
14,,SING,C24,S22,yes,N,14,,113643,19889,3B5
15,,SING,C23,N22,yes,N,15,,113643,19889,3B5
16,,SING,S22,C22,yes,N,16,,113643,19889,3B5
17,,DOUB,N22,C22,yes,N,17,,113643,19889,3B5
18,,SING,C22,N21,no,N,18,,113643,19889,3B5
19,,DOUB,O20,C20,no,N,19,,113643,19889,3B5
20,,SING,N21,C20,no,N,20,,113643,19889,3B5
21,,SING,C20,C17,no,N,21,,113643,19889,3B5
22,,SING,C19,N19,no,N,22,,113643,19889,3B5
23,,SING,C17,N19,yes,N,23,,113643,19889,3B5
24,,DOUB,C17,C16,yes,N,24,,113643,19889,3B5
25,,SING,N19,C18,yes,N,25,,113643,19889,3B5
26,,SING,C16,C15,yes,N,26,,113643,19889,3B5
27,,DOUB,C18,C15,yes,N,27,,113643,19889,3B5
28,,SING,C15,N14,no,N,28,,113643,19889,3B5
29,,SING,N14,C13,no,N,29,,113643,19889,3B5
30,,DOUB,C13,O13,no,N,30,,113643,19889,3B5
31,,SING,C13,C10,no,N,31,,113643,19889,3B5
32,,DOUB,C10,C9,yes,N,32,,113643,19889,3B5
33,,SING,C10,N12,yes,N,33,,113643,19889,3B5
34,,SING,C9,C8,yes,N,34,,113643,19889,3B5
35,,SING,N12,C12,no,N,35,,113643,19889,3B5
36,,SING,N12,C11,yes,N,36,,113643,19889,3B5
37,,DOUB,C8,C11,yes,N,37,,113643,19889,3B5
38,,SING,C8,N7,no,N,38,,113643,19889,3B5
39,,SING,N7,C6,no,N,39,,113643,19889,3B5
40,,DOUB,C6,O6,no,N,40,,113643,19889,3B5
41,,SING,C6,C4,no,N,41,,113643,19889,3B5
42,,DOUB,C5,C4,yes,N,42,,113643,19889,3B5
43,,SING,C5,N1,yes,N,43,,113643,19889,3B5
44,,SING,C4,C3,yes,N,44,,113643,19889,3B5
45,,DOUB,N1,C1,yes,N,45,,113643,19889,3B5
46,,DOUB,C3,C2,yes,N,46,,113643,19889,3B5
47,,SING,C1,C2,yes,N,47,,113643,19889,3B5
48,,SING,C3,H3,no,N,48,,113643,19889,3B5
49,,SING,C1,H1,no,N,49,,113643,19889,3B5
50,,SING,C5,H5,no,N,50,,113643,19889,3B5
51,,SING,C11,H11,no,N,51,,113643,19889,3B5
52,,SING,C12,H123,no,N,52,,113643,19889,3B5
53,,SING,C12,H121,no,N,53,,113643,19889,3B5
54,,SING,C12,H122,no,N,54,,113643,19889,3B5
55,,SING,N21,H21,no,N,55,,113643,19889,3B5
56,,SING,C25,H25,no,N,56,,113643,19889,3B5
57,,SING,C27,H273,no,N,57,,113643,19889,3B5
58,,SING,C27,H271,no,N,58,,113643,19889,3B5
59,,SING,C27,H272,no,N,59,,113643,19889,3B5
60,,SING,C32,H322,no,N,60,,113643,19889,3B5
61,,SING,C32,H321,no,N,61,,113643,19889,3B5
62,,SING,C31,H312,no,N,62,,113643,19889,3B5
63,,SING,C31,H311,no,N,63,,113643,19889,3B5
64,,SING,C19,H193,no,N,64,,113643,19889,3B5
65,,SING,C19,H192,no,N,65,,113643,19889,3B5
66,,SING,C19,H191,no,N,66,,113643,19889,3B5
67,,SING,C34,H341,no,N,67,,113643,19889,3B5
68,,SING,C34,H342,no,N,68,,113643,19889,3B5
69,,SING,C34,H343,no,N,69,,113643,19889,3B5
70,,SING,C35,H353,no,N,70,,113643,19889,3B5
71,,SING,C35,H352,no,N,71,,113643,19889,3B5
72,,SING,C35,H351,no,N,72,,113643,19889,3B5
73,,SING,C30,H302,no,N,73,,113643,19889,3B5
74,,SING,C30,H301,no,N,74,,113643,19889,3B5
75,,SING,N29,H29,no,N,75,,113643,19889,3B5
76,,SING,C26,H263,no,N,76,,113643,19889,3B5
77,,SING,C26,H261,no,N,77,,113643,19889,3B5
78,,SING,C26,H262,no,N,78,,113643,19889,3B5
79,,SING,C18,H18,no,N,79,,113643,19889,3B5
80,,SING,C16,H16,no,N,80,,113643,19889,3B5
81,,SING,N14,H14,no,N,81,,113643,19889,3B5
82,,SING,C9,H9,no,N,82,,113643,19889,3B5
83,,SING,N7,H7,no,N,83,,113643,19889,3B5
84,,SING,C2,H2,no,N,84,,113643,19889,3B5
85,,SING,N33,H33,no,N,85,,113643,19889,3B5
1,,DOUB,C,O,no,N,1,,113761,19902,ACE
2,,SING,C,CH3,no,N,2,,113761,19902,ACE
3,,SING,C,H,no,N,3,,113761,19902,ACE
4,,SING,CH3,H1,no,N,4,,113761,19902,ACE
5,,SING,CH3,H2,no,N,5,,113761,19902,ACE
6,,SING,CH3,H3,no,N,6,,113761,19902,ACE
1,,DOUB,C,O,no,N,1,,113908,19911,ACE
2,,SING,C,CH3,no,N,2,,113908,19911,ACE
3,,SING,C,H,no,N,3,,113908,19911,ACE
4,,SING,CH3,H1,no,N,4,,113908,19911,ACE
5,,SING,CH3,H2,no,N,5,,113908,19911,ACE
6,,SING,CH3,H3,no,N,6,,113908,19911,ACE
1,,SING,N,HN1,no,N,1,,113909,19911,NH2
2,,SING,N,HN2,no,N,2,,113909,19911,NH2
1,,DOUB,CD,CC,no,N,1,,113927,19912,6HB
2,,SING,CC,CB,no,N,2,,113927,19912,6HB
3,,SING,OB,CB,no,N,3,,113927,19912,6HB
4,,SING,CB,CA,no,N,4,,113927,19912,6HB
5,,SING,CA,N6,no,N,5,,113927,19912,6HB
6,,SING,N6,C6,no,N,6,,113927,19912,6HB
7,,SING,C2',C3',no,N,7,,113927,19912,6HB
8,,SING,C2',C1',no,N,8,,113927,19912,6HB
9,,DOUB,C6,N1,yes,N,9,,113927,19912,6HB
10,,SING,C6,C5,yes,N,10,,113927,19912,6HB
11,,SING,N1,C2,yes,N,11,,113927,19912,6HB
12,,SING,N7,C5,yes,N,12,,113927,19912,6HB
13,,DOUB,N7,C8,yes,N,13,,113927,19912,6HB
14,,DOUB,C5,C4,yes,N,14,,113927,19912,6HB
15,,SING,OP2,P,no,N,15,,113927,19912,6HB
16,,DOUB,C2,N3,yes,N,16,,113927,19912,6HB
17,,SING,C8,N9,yes,N,17,,113927,19912,6HB
18,,SING,C4,N3,yes,N,18,,113927,19912,6HB
19,,SING,C4,N9,yes,N,19,,113927,19912,6HB
20,,SING,N9,C1',no,N,20,,113927,19912,6HB
21,,SING,C3',O3',no,N,21,,113927,19912,6HB
22,,SING,C3',C4',no,N,22,,113927,19912,6HB
23,,SING,C1',O4',no,N,23,,113927,19912,6HB
24,,SING,O5',P,no,N,24,,113927,19912,6HB
25,,SING,O5',C5',no,N,25,,113927,19912,6HB
26,,DOUB,P,OP1,no,N,26,,113927,19912,6HB
27,,SING,C4',O4',no,N,27,,113927,19912,6HB
28,,SING,C4',C5',no,N,28,,113927,19912,6HB
29,,SING,OP2,H3,no,N,29,,113927,19912,6HB
30,,SING,C5',H5'',no,N,30,,113927,19912,6HB
31,,SING,C5',H5',no,N,31,,113927,19912,6HB
32,,SING,C4',H4',no,N,32,,113927,19912,6HB
33,,SING,C1',H1',no,N,33,,113927,19912,6HB
34,,SING,C8,H8,no,N,34,,113927,19912,6HB
35,,SING,N6,HN,no,N,35,,113927,19912,6HB
36,,SING,CA,HA1,no,N,36,,113927,19912,6HB
37,,SING,CA,HA2,no,N,37,,113927,19912,6HB
38,,SING,CB,HB,no,N,38,,113927,19912,6HB
39,,SING,OB,HOB,no,N,39,,113927,19912,6HB
40,,SING,CC,HC,no,N,40,,113927,19912,6HB
41,,SING,CD,HD2,no,N,41,,113927,19912,6HB
42,,SING,CD,HD1,no,N,42,,113927,19912,6HB
43,,SING,C2,H2,no,N,43,,113927,19912,6HB
44,,SING,C3',H3',no,N,44,,113927,19912,6HB
45,,SING,C2',H2',no,N,45,,113927,19912,6HB
46,,SING,C2',H2'',no,N,46,,113927,19912,6HB
47,,SING,O3',H4,no,N,47,,113927,19912,6HB
48,,SING,P,OP3,no,N,48,,113927,19912,6HB
49,,SING,OP3,H1,no,N,49,,113927,19912,6HB
1,,SING,CAA,OAK,no,N,1,,114003,19916,DT7
2,,SING,CAB,OAL,no,N,2,,114003,19916,DT7
3,,SING,NAD,SAS,no,N,3,,114003,19916,DT7
4,,DOUB,OAE,SAS,no,N,4,,114003,19916,DT7
5,,DOUB,OAF,SAS,no,N,5,,114003,19916,DT7
6,,DOUB,CAG,CAM,yes,N,6,,114003,19916,DT7
7,,SING,CAG,CAN,yes,N,7,,114003,19916,DT7
8,,SING,CAH,CAO,yes,N,8,,114003,19916,DT7
9,,DOUB,CAH,CAP,yes,N,9,,114003,19916,DT7
10,,SING,CAI,CAJ,no,N,10,,114003,19916,DT7
11,,SING,CAI,CAM,no,N,11,,114003,19916,DT7
12,,SING,CAJ,NAR,no,N,12,,114003,19916,DT7
13,,SING,OAK,CAN,no,N,13,,114003,19916,DT7
14,,SING,OAL,CAO,no,N,14,,114003,19916,DT7
15,,SING,CAM,CAP,yes,N,15,,114003,19916,DT7
16,,DOUB,CAN,CAO,yes,N,16,,114003,19916,DT7
17,,SING,CAP,CAQ,no,N,17,,114003,19916,DT7
18,,SING,CAQ,NAR,no,N,18,,114003,19916,DT7
19,,SING,NAR,SAS,no,N,19,,114003,19916,DT7
20,,SING,CAA,HAA,no,N,20,,114003,19916,DT7
21,,SING,CAA,HAAA,no,N,21,,114003,19916,DT7
22,,SING,CAA,HAAB,no,N,22,,114003,19916,DT7
23,,SING,CAB,HAB,no,N,23,,114003,19916,DT7
24,,SING,CAB,HABA,no,N,24,,114003,19916,DT7
25,,SING,CAB,HABB,no,N,25,,114003,19916,DT7
26,,SING,NAD,HNAD,no,N,26,,114003,19916,DT7
27,,SING,NAD,HNAA,no,N,27,,114003,19916,DT7
28,,SING,CAG,HAG,no,N,28,,114003,19916,DT7
29,,SING,CAH,HAH,no,N,29,,114003,19916,DT7
30,,SING,CAI,HAI,no,N,30,,114003,19916,DT7
31,,SING,CAI,HAIA,no,N,31,,114003,19916,DT7
32,,SING,CAJ,HAJ,no,N,32,,114003,19916,DT7
33,,SING,CAJ,HAJA,no,N,33,,114003,19916,DT7
34,,SING,CAQ,HAQ,no,N,34,,114003,19916,DT7
35,,SING,CAQ,HAQA,no,N,35,,114003,19916,DT7
1,,SING,P,O5',no,N,1,,114019,19917,5OC
2,,DOUB,P,OP3,no,N,2,,114019,19917,5OC
3,,SING,N1,C6,no,N,3,,114019,19917,5OC
4,,SING,N1,C2,no,N,4,,114019,19917,5OC
5,,SING,C2,N3,no,N,5,,114019,19917,5OC
6,,DOUB,O2,C2,no,N,6,,114019,19917,5OC
7,,DOUB,N3,C4,no,N,7,,114019,19917,5OC
8,,SING,C4,N4,no,N,8,,114019,19917,5OC
9,,SING,N4,HN4,no,N,9,,114019,19917,5OC
10,,SING,N4,HN4A,no,N,10,,114019,19917,5OC
11,,SING,C5,C4,no,N,11,,114019,19917,5OC
12,,SING,C5,O5,no,N,12,,114019,19917,5OC
13,,DOUB,C6,C5,no,N,13,,114019,19917,5OC
14,,SING,C6,H6,no,N,14,,114019,19917,5OC
15,,SING,C1',N1,no,N,15,,114019,19917,5OC
16,,SING,C1',C2',no,N,16,,114019,19917,5OC
17,,SING,C1',H1',no,N,17,,114019,19917,5OC
18,,SING,C2',H2',no,N,18,,114019,19917,5OC
19,,SING,C2',H2'A,no,N,19,,114019,19917,5OC
20,,SING,C3',C2',no,N,20,,114019,19917,5OC
21,,SING,C3',O3',no,N,21,,114019,19917,5OC
22,,SING,C3',H3',no,N,22,,114019,19917,5OC
23,,SING,O3',HO3',no,N,23,,114019,19917,5OC
24,,SING,C4',C3',no,N,24,,114019,19917,5OC
25,,SING,C4',H4',no,N,25,,114019,19917,5OC
26,,SING,O4',C1',no,N,26,,114019,19917,5OC
27,,SING,O4',C4',no,N,27,,114019,19917,5OC
28,,SING,C5',C4',no,N,28,,114019,19917,5OC
29,,SING,C5',O5',no,N,29,,114019,19917,5OC
30,,SING,C5',H5',no,N,30,,114019,19917,5OC
31,,SING,C5',H5'A,no,N,31,,114019,19917,5OC
32,,SING,OP1,P,no,N,32,,114019,19917,5OC
33,,SING,OP1,HOP1,no,N,33,,114019,19917,5OC
34,,SING,P,OP2,no,N,34,,114019,19917,5OC
35,,SING,O5,H13,no,N,35,,114019,19917,5OC
36,,SING,OP2,HOP2,no,N,36,,114019,19917,5OC
1,,DOUB,C1,O1,no,N,1,,114037,19921,OLA
2,,SING,C1,O2,no,N,2,,114037,19921,OLA
3,,SING,C1,C2,no,N,3,,114037,19921,OLA
4,,SING,O2,HO2,no,N,4,,114037,19921,OLA
5,,SING,C2,C3,no,N,5,,114037,19921,OLA
6,,SING,C2,H21,no,N,6,,114037,19921,OLA
7,,SING,C2,H22,no,N,7,,114037,19921,OLA
8,,SING,C3,C4,no,N,8,,114037,19921,OLA
9,,SING,C3,H31,no,N,9,,114037,19921,OLA
10,,SING,C3,H32,no,N,10,,114037,19921,OLA
11,,SING,C4,C5,no,N,11,,114037,19921,OLA
12,,SING,C4,H41,no,N,12,,114037,19921,OLA
13,,SING,C4,H42,no,N,13,,114037,19921,OLA
14,,SING,C5,C6,no,N,14,,114037,19921,OLA
15,,SING,C5,H51,no,N,15,,114037,19921,OLA
16,,SING,C5,H52,no,N,16,,114037,19921,OLA
17,,SING,C6,C7,no,N,17,,114037,19921,OLA
18,,SING,C6,H61,no,N,18,,114037,19921,OLA
19,,SING,C6,H62,no,N,19,,114037,19921,OLA
20,,SING,C7,C8,no,N,20,,114037,19921,OLA
21,,SING,C7,H71,no,N,21,,114037,19921,OLA
22,,SING,C7,H72,no,N,22,,114037,19921,OLA
23,,SING,C8,C9,no,N,23,,114037,19921,OLA
24,,SING,C8,H81,no,N,24,,114037,19921,OLA
25,,SING,C8,H82,no,N,25,,114037,19921,OLA
26,,DOUB,C9,C10,no,Z,26,,114037,19921,OLA
27,,SING,C9,H9,no,N,27,,114037,19921,OLA
28,,SING,C10,C11,no,N,28,,114037,19921,OLA
29,,SING,C10,H10,no,N,29,,114037,19921,OLA
30,,SING,C11,C12,no,N,30,,114037,19921,OLA
31,,SING,C11,H111,no,N,31,,114037,19921,OLA
32,,SING,C11,H112,no,N,32,,114037,19921,OLA
33,,SING,C12,C13,no,N,33,,114037,19921,OLA
34,,SING,C12,H121,no,N,34,,114037,19921,OLA
35,,SING,C12,H122,no,N,35,,114037,19921,OLA
36,,SING,C13,C14,no,N,36,,114037,19921,OLA
37,,SING,C13,H131,no,N,37,,114037,19921,OLA
38,,SING,C13,H132,no,N,38,,114037,19921,OLA
39,,SING,C14,C15,no,N,39,,114037,19921,OLA
40,,SING,C14,H141,no,N,40,,114037,19921,OLA
41,,SING,C14,H142,no,N,41,,114037,19921,OLA
42,,SING,C15,C16,no,N,42,,114037,19921,OLA
43,,SING,C15,H151,no,N,43,,114037,19921,OLA
44,,SING,C15,H152,no,N,44,,114037,19921,OLA
45,,SING,C16,C17,no,N,45,,114037,19921,OLA
46,,SING,C16,H161,no,N,46,,114037,19921,OLA
47,,SING,C16,H162,no,N,47,,114037,19921,OLA
48,,SING,C17,C18,no,N,48,,114037,19921,OLA
49,,SING,C17,H171,no,N,49,,114037,19921,OLA
50,,SING,C17,H172,no,N,50,,114037,19921,OLA
51,,SING,C18,H181,no,N,51,,114037,19921,OLA
52,,SING,C18,H182,no,N,52,,114037,19921,OLA
53,,SING,C18,H183,no,N,53,,114037,19921,OLA
1,,SING,N,CA,no,N,1,,114072,19923,SEC
2,,SING,N,H,no,N,2,,114072,19923,SEC
3,,SING,N,H2,no,N,3,,114072,19923,SEC
4,,SING,CA,CB,no,N,4,,114072,19923,SEC
5,,SING,CA,C,no,N,5,,114072,19923,SEC
6,,SING,CA,HA,no,N,6,,114072,19923,SEC
7,,SING,CB,SE,no,N,7,,114072,19923,SEC
8,,SING,CB,HB2,no,N,8,,114072,19923,SEC
9,,SING,CB,HB3,no,N,9,,114072,19923,SEC
10,,SING,SE,HE,no,N,10,,114072,19923,SEC
11,,DOUB,C,O,no,N,11,,114072,19923,SEC
12,,SING,C,OXT,no,N,12,,114072,19923,SEC
13,,SING,OXT,HXT,no,N,13,,114072,19923,SEC
1,,DOUB,C,O,no,N,1,,114153,19929,ACE
2,,SING,C,CH3,no,N,2,,114153,19929,ACE
3,,SING,C,H,no,N,3,,114153,19929,ACE
4,,SING,CH3,H1,no,N,4,,114153,19929,ACE
5,,SING,CH3,H2,no,N,5,,114153,19929,ACE
6,,SING,CH3,H3,no,N,6,,114153,19929,ACE
1,,SING,N,HN1,no,N,1,,114154,19929,NH2
2,,SING,N,HN2,no,N,2,,114154,19929,NH2
1,,DOUB,O,C,no,N,1,,114207,19932,81S
2,,SING,C,CA,no,N,2,,114207,19932,81S
3,,SING,SD2,CG,no,N,3,,114207,19932,81S
4,,SING,CG,CB,no,N,4,,114207,19932,81S
5,,SING,CG,CD1,no,N,5,,114207,19932,81S
6,,SING,CB,CA,no,N,6,,114207,19932,81S
7,,SING,CA,N,no,N,7,,114207,19932,81S
8,,SING,CD1,SE,no,N,8,,114207,19932,81S
9,,SING,N,H1,no,N,9,,114207,19932,81S
10,,SING,N,H2,no,N,10,,114207,19932,81S
11,,SING,CA,H4,no,N,11,,114207,19932,81S
12,,SING,CB,H5,no,N,12,,114207,19932,81S
13,,SING,CB,H6,no,N,13,,114207,19932,81S
14,,SING,CG,H7,no,N,14,,114207,19932,81S
15,,SING,CD1,H8,no,N,15,,114207,19932,81S
16,,SING,CD1,H9,no,N,16,,114207,19932,81S
17,,SING,SE,H10,no,N,17,,114207,19932,81S
18,,SING,SD2,H11,no,N,18,,114207,19932,81S
19,,SING,C,OXT,no,N,19,,114207,19932,81S
20,,SING,OXT,H3,no,N,20,,114207,19932,81S
1,,SING,N,HN1,no,N,1,,114208,19932,NH2
2,,SING,N,HN2,no,N,2,,114208,19932,NH2
1,,SING,N,CA,no,N,1,,114242,19934,TPO
2,,SING,N,H,no,N,2,,114242,19934,TPO
3,,SING,N,H2,no,N,3,,114242,19934,TPO
4,,SING,CA,CB,no,N,4,,114242,19934,TPO
5,,SING,CA,C,no,N,5,,114242,19934,TPO
6,,SING,CA,HA,no,N,6,,114242,19934,TPO
7,,SING,CB,CG2,no,N,7,,114242,19934,TPO
8,,SING,CB,OG1,no,N,8,,114242,19934,TPO
9,,SING,CB,HB,no,N,9,,114242,19934,TPO
10,,SING,CG2,HG21,no,N,10,,114242,19934,TPO
11,,SING,CG2,HG22,no,N,11,,114242,19934,TPO
12,,SING,CG2,HG23,no,N,12,,114242,19934,TPO
13,,SING,OG1,P,no,N,13,,114242,19934,TPO
14,,DOUB,P,O1P,no,N,14,,114242,19934,TPO
15,,SING,P,O2P,no,N,15,,114242,19934,TPO
16,,SING,P,O3P,no,N,16,,114242,19934,TPO
17,,SING,O2P,HOP2,no,N,17,,114242,19934,TPO
18,,SING,O3P,HOP3,no,N,18,,114242,19934,TPO
19,,DOUB,C,O,no,N,19,,114242,19934,TPO
20,,SING,C,OXT,no,N,20,,114242,19934,TPO
21,,SING,OXT,HXT,no,N,21,,114242,19934,TPO
1,,SING,N,CA,no,N,1,,114243,19934,PTR
2,,SING,N,H,no,N,2,,114243,19934,PTR
3,,SING,N,HN2,no,N,3,,114243,19934,PTR
4,,SING,CA,C,no,N,4,,114243,19934,PTR
5,,SING,CA,CB,no,N,5,,114243,19934,PTR
6,,SING,CA,HA,no,N,6,,114243,19934,PTR
7,,DOUB,C,O,no,N,7,,114243,19934,PTR
8,,SING,C,OXT,no,N,8,,114243,19934,PTR
9,,SING,OXT,HXT,no,N,9,,114243,19934,PTR
10,,SING,CB,CG,no,N,10,,114243,19934,PTR
11,,SING,CB,HB2,no,N,11,,114243,19934,PTR
12,,SING,CB,HB3,no,N,12,,114243,19934,PTR
13,,DOUB,CG,CD1,yes,N,13,,114243,19934,PTR
14,,SING,CG,CD2,yes,N,14,,114243,19934,PTR
15,,SING,CD1,CE1,yes,N,15,,114243,19934,PTR
16,,SING,CD1,HD1,no,N,16,,114243,19934,PTR
17,,DOUB,CD2,CE2,yes,N,17,,114243,19934,PTR
18,,SING,CD2,HD2,no,N,18,,114243,19934,PTR
19,,DOUB,CE1,CZ,yes,N,19,,114243,19934,PTR
20,,SING,CE1,HE1,no,N,20,,114243,19934,PTR
21,,SING,CE2,CZ,yes,N,21,,114243,19934,PTR
22,,SING,CE2,HE2,no,N,22,,114243,19934,PTR
23,,SING,CZ,OH,no,N,23,,114243,19934,PTR
24,,SING,OH,P,no,N,24,,114243,19934,PTR
25,,DOUB,P,O1P,no,N,25,,114243,19934,PTR
26,,SING,P,O2P,no,N,26,,114243,19934,PTR
27,,SING,P,O3P,no,N,27,,114243,19934,PTR
28,,SING,O2P,HO2P,no,N,28,,114243,19934,PTR
29,,SING,O3P,HO3P,no,N,29,,114243,19934,PTR
1,,SING,N,CA,no,N,1,,114263,19935,TPO
2,,SING,N,H,no,N,2,,114263,19935,TPO
3,,SING,N,H2,no,N,3,,114263,19935,TPO
4,,SING,CA,CB,no,N,4,,114263,19935,TPO
5,,SING,CA,C,no,N,5,,114263,19935,TPO
6,,SING,CA,HA,no,N,6,,114263,19935,TPO
7,,SING,CB,CG2,no,N,7,,114263,19935,TPO
8,,SING,CB,OG1,no,N,8,,114263,19935,TPO
9,,SING,CB,HB,no,N,9,,114263,19935,TPO
10,,SING,CG2,HG21,no,N,10,,114263,19935,TPO
11,,SING,CG2,HG22,no,N,11,,114263,19935,TPO
12,,SING,CG2,HG23,no,N,12,,114263,19935,TPO
13,,SING,OG1,P,no,N,13,,114263,19935,TPO
14,,DOUB,P,O1P,no,N,14,,114263,19935,TPO
15,,SING,P,O2P,no,N,15,,114263,19935,TPO
16,,SING,P,O3P,no,N,16,,114263,19935,TPO
17,,SING,O2P,HOP2,no,N,17,,114263,19935,TPO
18,,SING,O3P,HOP3,no,N,18,,114263,19935,TPO
19,,DOUB,C,O,no,N,19,,114263,19935,TPO
20,,SING,C,OXT,no,N,20,,114263,19935,TPO
21,,SING,OXT,HXT,no,N,21,,114263,19935,TPO
1,,SING,N,CA,no,N,1,,114264,19935,PTR
2,,SING,N,H,no,N,2,,114264,19935,PTR
3,,SING,N,HN2,no,N,3,,114264,19935,PTR
4,,SING,CA,C,no,N,4,,114264,19935,PTR
5,,SING,CA,CB,no,N,5,,114264,19935,PTR
6,,SING,CA,HA,no,N,6,,114264,19935,PTR
7,,DOUB,C,O,no,N,7,,114264,19935,PTR
8,,SING,C,OXT,no,N,8,,114264,19935,PTR
9,,SING,OXT,HXT,no,N,9,,114264,19935,PTR
10,,SING,CB,CG,no,N,10,,114264,19935,PTR
11,,SING,CB,HB2,no,N,11,,114264,19935,PTR
12,,SING,CB,HB3,no,N,12,,114264,19935,PTR
13,,DOUB,CG,CD1,yes,N,13,,114264,19935,PTR
14,,SING,CG,CD2,yes,N,14,,114264,19935,PTR
15,,SING,CD1,CE1,yes,N,15,,114264,19935,PTR
16,,SING,CD1,HD1,no,N,16,,114264,19935,PTR
17,,DOUB,CD2,CE2,yes,N,17,,114264,19935,PTR
18,,SING,CD2,HD2,no,N,18,,114264,19935,PTR
19,,DOUB,CE1,CZ,yes,N,19,,114264,19935,PTR
20,,SING,CE1,HE1,no,N,20,,114264,19935,PTR
21,,SING,CE2,CZ,yes,N,21,,114264,19935,PTR
22,,SING,CE2,HE2,no,N,22,,114264,19935,PTR
23,,SING,CZ,OH,no,N,23,,114264,19935,PTR
24,,SING,OH,P,no,N,24,,114264,19935,PTR
25,,DOUB,P,O1P,no,N,25,,114264,19935,PTR
26,,SING,P,O2P,no,N,26,,114264,19935,PTR
27,,SING,P,O3P,no,N,27,,114264,19935,PTR
28,,SING,O2P,HO2P,no,N,28,,114264,19935,PTR
29,,SING,O3P,HO3P,no,N,29,,114264,19935,PTR
1,,DOUB,PB,O1B,no,N,1,,114265,19935,ADP
2,,SING,PB,O2B,no,N,2,,114265,19935,ADP
3,,SING,PB,O3B,no,N,3,,114265,19935,ADP
4,,SING,PB,O3A,no,N,4,,114265,19935,ADP
5,,SING,O2B,HOB2,no,N,5,,114265,19935,ADP
6,,SING,O3B,HOB3,no,N,6,,114265,19935,ADP
7,,DOUB,PA,O1A,no,N,7,,114265,19935,ADP
8,,SING,PA,O2A,no,N,8,,114265,19935,ADP
9,,SING,PA,O3A,no,N,9,,114265,19935,ADP
10,,SING,PA,O5',no,N,10,,114265,19935,ADP
11,,SING,O2A,HOA2,no,N,11,,114265,19935,ADP
12,,SING,O5',C5',no,N,12,,114265,19935,ADP
13,,SING,C5',C4',no,N,13,,114265,19935,ADP
14,,SING,C5',H5'1,no,N,14,,114265,19935,ADP
15,,SING,C5',H5'2,no,N,15,,114265,19935,ADP
16,,SING,C4',O4',no,N,16,,114265,19935,ADP
17,,SING,C4',C3',no,N,17,,114265,19935,ADP
18,,SING,C4',H4',no,N,18,,114265,19935,ADP
19,,SING,O4',C1',no,N,19,,114265,19935,ADP
20,,SING,C3',O3',no,N,20,,114265,19935,ADP
21,,SING,C3',C2',no,N,21,,114265,19935,ADP
22,,SING,C3',H3',no,N,22,,114265,19935,ADP
23,,SING,O3',HO3',no,N,23,,114265,19935,ADP
24,,SING,C2',O2',no,N,24,,114265,19935,ADP
25,,SING,C2',C1',no,N,25,,114265,19935,ADP
26,,SING,C2',H2',no,N,26,,114265,19935,ADP
27,,SING,O2',HO2',no,N,27,,114265,19935,ADP
28,,SING,C1',N9,no,N,28,,114265,19935,ADP
29,,SING,C1',H1',no,N,29,,114265,19935,ADP
30,,SING,N9,C8,yes,N,30,,114265,19935,ADP
31,,SING,N9,C4,yes,N,31,,114265,19935,ADP
32,,DOUB,C8,N7,yes,N,32,,114265,19935,ADP
33,,SING,C8,H8,no,N,33,,114265,19935,ADP
34,,SING,N7,C5,yes,N,34,,114265,19935,ADP
35,,SING,C5,C6,yes,N,35,,114265,19935,ADP
36,,DOUB,C5,C4,yes,N,36,,114265,19935,ADP
37,,SING,C6,N6,no,N,37,,114265,19935,ADP
38,,DOUB,C6,N1,yes,N,38,,114265,19935,ADP
39,,SING,N6,HN61,no,N,39,,114265,19935,ADP
40,,SING,N6,HN62,no,N,40,,114265,19935,ADP
41,,SING,N1,C2,yes,N,41,,114265,19935,ADP
42,,DOUB,C2,N3,yes,N,42,,114265,19935,ADP
43,,SING,C2,H2,no,N,43,,114265,19935,ADP
44,,SING,N3,C4,yes,N,44,,114265,19935,ADP
1,,SING,N,CA,no,N,1,,114285,19936,TPO
2,,SING,N,H,no,N,2,,114285,19936,TPO
3,,SING,N,H2,no,N,3,,114285,19936,TPO
4,,SING,CA,CB,no,N,4,,114285,19936,TPO
5,,SING,CA,C,no,N,5,,114285,19936,TPO
6,,SING,CA,HA,no,N,6,,114285,19936,TPO
7,,SING,CB,CG2,no,N,7,,114285,19936,TPO
8,,SING,CB,OG1,no,N,8,,114285,19936,TPO
9,,SING,CB,HB,no,N,9,,114285,19936,TPO
10,,SING,CG2,HG21,no,N,10,,114285,19936,TPO
11,,SING,CG2,HG22,no,N,11,,114285,19936,TPO
12,,SING,CG2,HG23,no,N,12,,114285,19936,TPO
13,,SING,OG1,P,no,N,13,,114285,19936,TPO
14,,DOUB,P,O1P,no,N,14,,114285,19936,TPO
15,,SING,P,O2P,no,N,15,,114285,19936,TPO
16,,SING,P,O3P,no,N,16,,114285,19936,TPO
17,,SING,O2P,HOP2,no,N,17,,114285,19936,TPO
18,,SING,O3P,HOP3,no,N,18,,114285,19936,TPO
19,,DOUB,C,O,no,N,19,,114285,19936,TPO
20,,SING,C,OXT,no,N,20,,114285,19936,TPO
21,,SING,OXT,HXT,no,N,21,,114285,19936,TPO
1,,SING,N,CA,no,N,1,,114286,19936,PTR
2,,SING,N,H,no,N,2,,114286,19936,PTR
3,,SING,N,HN2,no,N,3,,114286,19936,PTR
4,,SING,CA,C,no,N,4,,114286,19936,PTR
5,,SING,CA,CB,no,N,5,,114286,19936,PTR
6,,SING,CA,HA,no,N,6,,114286,19936,PTR
7,,DOUB,C,O,no,N,7,,114286,19936,PTR
8,,SING,C,OXT,no,N,8,,114286,19936,PTR
9,,SING,OXT,HXT,no,N,9,,114286,19936,PTR
10,,SING,CB,CG,no,N,10,,114286,19936,PTR
11,,SING,CB,HB2,no,N,11,,114286,19936,PTR
12,,SING,CB,HB3,no,N,12,,114286,19936,PTR
13,,DOUB,CG,CD1,yes,N,13,,114286,19936,PTR
14,,SING,CG,CD2,yes,N,14,,114286,19936,PTR
15,,SING,CD1,CE1,yes,N,15,,114286,19936,PTR
16,,SING,CD1,HD1,no,N,16,,114286,19936,PTR
17,,DOUB,CD2,CE2,yes,N,17,,114286,19936,PTR
18,,SING,CD2,HD2,no,N,18,,114286,19936,PTR
19,,DOUB,CE1,CZ,yes,N,19,,114286,19936,PTR
20,,SING,CE1,HE1,no,N,20,,114286,19936,PTR
21,,SING,CE2,CZ,yes,N,21,,114286,19936,PTR
22,,SING,CE2,HE2,no,N,22,,114286,19936,PTR
23,,SING,CZ,OH,no,N,23,,114286,19936,PTR
24,,SING,OH,P,no,N,24,,114286,19936,PTR
25,,DOUB,P,O1P,no,N,25,,114286,19936,PTR
26,,SING,P,O2P,no,N,26,,114286,19936,PTR
27,,SING,P,O3P,no,N,27,,114286,19936,PTR
28,,SING,O2P,HO2P,no,N,28,,114286,19936,PTR
29,,SING,O3P,HO3P,no,N,29,,114286,19936,PTR
1,,DOUB,PB,O1B,no,N,1,,114307,19937,ADP
2,,SING,PB,O2B,no,N,2,,114307,19937,ADP
3,,SING,PB,O3B,no,N,3,,114307,19937,ADP
4,,SING,PB,O3A,no,N,4,,114307,19937,ADP
5,,SING,O2B,HOB2,no,N,5,,114307,19937,ADP
6,,SING,O3B,HOB3,no,N,6,,114307,19937,ADP
7,,DOUB,PA,O1A,no,N,7,,114307,19937,ADP
8,,SING,PA,O2A,no,N,8,,114307,19937,ADP
9,,SING,PA,O3A,no,N,9,,114307,19937,ADP
10,,SING,PA,O5',no,N,10,,114307,19937,ADP
11,,SING,O2A,HOA2,no,N,11,,114307,19937,ADP
12,,SING,O5',C5',no,N,12,,114307,19937,ADP
13,,SING,C5',C4',no,N,13,,114307,19937,ADP
14,,SING,C5',H5'1,no,N,14,,114307,19937,ADP
15,,SING,C5',H5'2,no,N,15,,114307,19937,ADP
16,,SING,C4',O4',no,N,16,,114307,19937,ADP
17,,SING,C4',C3',no,N,17,,114307,19937,ADP
18,,SING,C4',H4',no,N,18,,114307,19937,ADP
19,,SING,O4',C1',no,N,19,,114307,19937,ADP
20,,SING,C3',O3',no,N,20,,114307,19937,ADP
21,,SING,C3',C2',no,N,21,,114307,19937,ADP
22,,SING,C3',H3',no,N,22,,114307,19937,ADP
23,,SING,O3',HO3',no,N,23,,114307,19937,ADP
24,,SING,C2',O2',no,N,24,,114307,19937,ADP
25,,SING,C2',C1',no,N,25,,114307,19937,ADP
26,,SING,C2',H2',no,N,26,,114307,19937,ADP
27,,SING,O2',HO2',no,N,27,,114307,19937,ADP
28,,SING,C1',N9,no,N,28,,114307,19937,ADP
29,,SING,C1',H1',no,N,29,,114307,19937,ADP
30,,SING,N9,C8,yes,N,30,,114307,19937,ADP
31,,SING,N9,C4,yes,N,31,,114307,19937,ADP
32,,DOUB,C8,N7,yes,N,32,,114307,19937,ADP
33,,SING,C8,H8,no,N,33,,114307,19937,ADP
34,,SING,N7,C5,yes,N,34,,114307,19937,ADP
35,,SING,C5,C6,yes,N,35,,114307,19937,ADP
36,,DOUB,C5,C4,yes,N,36,,114307,19937,ADP
37,,SING,C6,N6,no,N,37,,114307,19937,ADP
38,,DOUB,C6,N1,yes,N,38,,114307,19937,ADP
39,,SING,N6,HN61,no,N,39,,114307,19937,ADP
40,,SING,N6,HN62,no,N,40,,114307,19937,ADP
41,,SING,N1,C2,yes,N,41,,114307,19937,ADP
42,,DOUB,C2,N3,yes,N,42,,114307,19937,ADP
43,,SING,C2,H2,no,N,43,,114307,19937,ADP
44,,SING,N3,C4,yes,N,44,,114307,19937,ADP
1,,SING,N,CA,no,N,1,,114308,19937,TPO
2,,SING,N,H,no,N,2,,114308,19937,TPO
3,,SING,N,H2,no,N,3,,114308,19937,TPO
4,,SING,CA,CB,no,N,4,,114308,19937,TPO
5,,SING,CA,C,no,N,5,,114308,19937,TPO
6,,SING,CA,HA,no,N,6,,114308,19937,TPO
7,,SING,CB,CG2,no,N,7,,114308,19937,TPO
8,,SING,CB,OG1,no,N,8,,114308,19937,TPO
9,,SING,CB,HB,no,N,9,,114308,19937,TPO
10,,SING,CG2,HG21,no,N,10,,114308,19937,TPO
11,,SING,CG2,HG22,no,N,11,,114308,19937,TPO
12,,SING,CG2,HG23,no,N,12,,114308,19937,TPO
13,,SING,OG1,P,no,N,13,,114308,19937,TPO
14,,DOUB,P,O1P,no,N,14,,114308,19937,TPO
15,,SING,P,O2P,no,N,15,,114308,19937,TPO
16,,SING,P,O3P,no,N,16,,114308,19937,TPO
17,,SING,O2P,HOP2,no,N,17,,114308,19937,TPO
18,,SING,O3P,HOP3,no,N,18,,114308,19937,TPO
19,,DOUB,C,O,no,N,19,,114308,19937,TPO
20,,SING,C,OXT,no,N,20,,114308,19937,TPO
21,,SING,OXT,HXT,no,N,21,,114308,19937,TPO
1,,SING,N,CA,no,N,1,,114309,19937,PTR
2,,SING,N,H,no,N,2,,114309,19937,PTR
3,,SING,N,HN2,no,N,3,,114309,19937,PTR
4,,SING,CA,C,no,N,4,,114309,19937,PTR
5,,SING,CA,CB,no,N,5,,114309,19937,PTR
6,,SING,CA,HA,no,N,6,,114309,19937,PTR
7,,DOUB,C,O,no,N,7,,114309,19937,PTR
8,,SING,C,OXT,no,N,8,,114309,19937,PTR
9,,SING,OXT,HXT,no,N,9,,114309,19937,PTR
10,,SING,CB,CG,no,N,10,,114309,19937,PTR
11,,SING,CB,HB2,no,N,11,,114309,19937,PTR
12,,SING,CB,HB3,no,N,12,,114309,19937,PTR
13,,DOUB,CG,CD1,yes,N,13,,114309,19937,PTR
14,,SING,CG,CD2,yes,N,14,,114309,19937,PTR
15,,SING,CD1,CE1,yes,N,15,,114309,19937,PTR
16,,SING,CD1,HD1,no,N,16,,114309,19937,PTR
17,,DOUB,CD2,CE2,yes,N,17,,114309,19937,PTR
18,,SING,CD2,HD2,no,N,18,,114309,19937,PTR
19,,DOUB,CE1,CZ,yes,N,19,,114309,19937,PTR
20,,SING,CE1,HE1,no,N,20,,114309,19937,PTR
21,,SING,CE2,CZ,yes,N,21,,114309,19937,PTR
22,,SING,CE2,HE2,no,N,22,,114309,19937,PTR
23,,SING,CZ,OH,no,N,23,,114309,19937,PTR
24,,SING,OH,P,no,N,24,,114309,19937,PTR
25,,DOUB,P,O1P,no,N,25,,114309,19937,PTR
26,,SING,P,O2P,no,N,26,,114309,19937,PTR
27,,SING,P,O3P,no,N,27,,114309,19937,PTR
28,,SING,O2P,HO2P,no,N,28,,114309,19937,PTR
29,,SING,O3P,HO3P,no,N,29,,114309,19937,PTR
1,,SING,N1,C2,no,N,1,,114351,19939,5CM
2,,SING,N1,C6,no,N,2,,114351,19939,5CM
3,,SING,N1,C1',no,N,3,,114351,19939,5CM
4,,SING,C2,N3,no,N,4,,114351,19939,5CM
5,,DOUB,C2,O2,no,N,5,,114351,19939,5CM
6,,DOUB,N3,C4,no,N,6,,114351,19939,5CM
7,,SING,C4,C5,no,N,7,,114351,19939,5CM
8,,SING,C4,N4,no,N,8,,114351,19939,5CM
9,,SING,C5,C5A,no,N,9,,114351,19939,5CM
10,,DOUB,C5,C6,no,N,10,,114351,19939,5CM
11,,SING,C5A,H5A1,no,N,11,,114351,19939,5CM
12,,SING,C5A,H5A2,no,N,12,,114351,19939,5CM
13,,SING,C5A,H5A3,no,N,13,,114351,19939,5CM
14,,SING,C6,H6,no,N,14,,114351,19939,5CM
15,,SING,N4,HN41,no,N,15,,114351,19939,5CM
16,,SING,N4,HN42,no,N,16,,114351,19939,5CM
17,,SING,C1',C2',no,N,17,,114351,19939,5CM
18,,SING,C1',O4',no,N,18,,114351,19939,5CM
19,,SING,C1',H1',no,N,19,,114351,19939,5CM
20,,SING,C2',C3',no,N,20,,114351,19939,5CM
21,,SING,C2',H2',no,N,21,,114351,19939,5CM
22,,SING,C2',H2'',no,N,22,,114351,19939,5CM
23,,SING,C3',C4',no,N,23,,114351,19939,5CM
24,,SING,C3',O3',no,N,24,,114351,19939,5CM
25,,SING,C3',H3',no,N,25,,114351,19939,5CM
26,,SING,C4',O4',no,N,26,,114351,19939,5CM
27,,SING,C4',C5',no,N,27,,114351,19939,5CM
28,,SING,C4',H4',no,N,28,,114351,19939,5CM
29,,SING,O3',HO3',no,N,29,,114351,19939,5CM
30,,SING,C5',O5',no,N,30,,114351,19939,5CM
31,,SING,C5',H5',no,N,31,,114351,19939,5CM
32,,SING,C5',H5'',no,N,32,,114351,19939,5CM
33,,SING,O5',P,no,N,33,,114351,19939,5CM
34,,DOUB,P,OP1,no,N,34,,114351,19939,5CM
35,,SING,P,OP2,no,N,35,,114351,19939,5CM
36,,SING,P,OP3,no,N,36,,114351,19939,5CM
37,,SING,OP2,HOP2,no,N,37,,114351,19939,5CM
38,,SING,OP3,HOP3,no,N,38,,114351,19939,5CM
1,,SING,N1,C2,yes,N,1,,114439,19945,FMN
2,,DOUB,N1,C10,yes,N,2,,114439,19945,FMN
3,,DOUB,C2,O2,no,N,3,,114439,19945,FMN
4,,SING,C2,N3,yes,N,4,,114439,19945,FMN
5,,SING,N3,C4,yes,N,5,,114439,19945,FMN
6,,SING,N3,HN3,no,N,6,,114439,19945,FMN
7,,DOUB,C4,O4,no,N,7,,114439,19945,FMN
8,,SING,C4,C4A,yes,N,8,,114439,19945,FMN
9,,DOUB,C4A,N5,yes,N,9,,114439,19945,FMN
10,,SING,C4A,C10,yes,N,10,,114439,19945,FMN
11,,SING,N5,C5A,yes,N,11,,114439,19945,FMN
12,,DOUB,C5A,C6,yes,N,12,,114439,19945,FMN
13,,SING,C5A,C9A,yes,N,13,,114439,19945,FMN
14,,SING,C6,C7,yes,N,14,,114439,19945,FMN
15,,SING,C6,H6,no,N,15,,114439,19945,FMN
16,,SING,C7,C7M,no,N,16,,114439,19945,FMN
17,,DOUB,C7,C8,yes,N,17,,114439,19945,FMN
18,,SING,C7M,HM71,no,N,18,,114439,19945,FMN
19,,SING,C7M,HM72,no,N,19,,114439,19945,FMN
20,,SING,C7M,HM73,no,N,20,,114439,19945,FMN
21,,SING,C8,C8M,no,N,21,,114439,19945,FMN
22,,SING,C8,C9,yes,N,22,,114439,19945,FMN
23,,SING,C8M,HM81,no,N,23,,114439,19945,FMN
24,,SING,C8M,HM82,no,N,24,,114439,19945,FMN
25,,SING,C8M,HM83,no,N,25,,114439,19945,FMN
26,,DOUB,C9,C9A,yes,N,26,,114439,19945,FMN
27,,SING,C9,H9,no,N,27,,114439,19945,FMN
28,,SING,C9A,N10,yes,N,28,,114439,19945,FMN
29,,SING,N10,C10,yes,N,29,,114439,19945,FMN
30,,SING,N10,C1',no,N,30,,114439,19945,FMN
31,,SING,C1',C2',no,N,31,,114439,19945,FMN
32,,SING,C1',H1'1,no,N,32,,114439,19945,FMN
33,,SING,C1',H1'2,no,N,33,,114439,19945,FMN
34,,SING,C2',O2',no,N,34,,114439,19945,FMN
35,,SING,C2',C3',no,N,35,,114439,19945,FMN
36,,SING,C2',H2',no,N,36,,114439,19945,FMN
37,,SING,O2',HO2',no,N,37,,114439,19945,FMN
38,,SING,C3',O3',no,N,38,,114439,19945,FMN
39,,SING,C3',C4',no,N,39,,114439,19945,FMN
40,,SING,C3',H3',no,N,40,,114439,19945,FMN
41,,SING,O3',HO3',no,N,41,,114439,19945,FMN
42,,SING,C4',O4',no,N,42,,114439,19945,FMN
43,,SING,C4',C5',no,N,43,,114439,19945,FMN
44,,SING,C4',H4',no,N,44,,114439,19945,FMN
45,,SING,O4',HO4',no,N,45,,114439,19945,FMN
46,,SING,C5',O5',no,N,46,,114439,19945,FMN
47,,SING,C5',H5'1,no,N,47,,114439,19945,FMN
48,,SING,C5',H5'2,no,N,48,,114439,19945,FMN
49,,SING,O5',P,no,N,49,,114439,19945,FMN
50,,DOUB,P,O1P,no,N,50,,114439,19945,FMN
51,,SING,P,O2P,no,N,51,,114439,19945,FMN
52,,SING,P,O3P,no,N,52,,114439,19945,FMN
53,,SING,O2P,HOP2,no,N,53,,114439,19945,FMN
54,,SING,O3P,HOP3,no,N,54,,114439,19945,FMN
1,,SING,C6,C3,no,N,1,,114592,19953,IOR
2,,SING,C3,N2,no,N,2,,114592,19953,IOR
3,,SING,C3,C4,no,N,3,,114592,19953,IOR
4,,SING,N2,C1,no,N,4,,114592,19953,IOR
5,,SING,C4,O4,no,N,5,,114592,19953,IOR
6,,SING,C4,N5,no,N,6,,114592,19953,IOR
7,,SING,C1,NE,no,N,7,,114592,19953,IOR
8,,SING,C1,N5,no,N,8,,114592,19953,IOR
9,,SING,NE,CD,no,N,9,,114592,19953,IOR
10,,SING,CD,CG,no,N,10,,114592,19953,IOR
11,,SING,CG,CB,no,N,11,,114592,19953,IOR
12,,SING,CB,CA,no,N,12,,114592,19953,IOR
13,,SING,CA,N,no,N,13,,114592,19953,IOR
14,,SING,CA,C,no,N,14,,114592,19953,IOR
15,,DOUB,C,O,no,N,15,,114592,19953,IOR
16,,SING,N,H,no,N,16,,114592,19953,IOR
17,,SING,N,H2,no,N,17,,114592,19953,IOR
18,,SING,CA,HA,no,N,18,,114592,19953,IOR
19,,SING,CB,HB3,no,N,19,,114592,19953,IOR
20,,SING,CB,HB2,no,N,20,,114592,19953,IOR
21,,SING,CG,HG2,no,N,21,,114592,19953,IOR
22,,SING,CG,HG3,no,N,22,,114592,19953,IOR
23,,SING,CD,HD3,no,N,23,,114592,19953,IOR
24,,SING,CD,HD2,no,N,24,,114592,19953,IOR
25,,SING,NE,HE,no,N,25,,114592,19953,IOR
26,,SING,C1,H10,no,N,26,,114592,19953,IOR
27,,SING,N5,H11,no,N,27,,114592,19953,IOR
28,,SING,N2,H5,no,N,28,,114592,19953,IOR
29,,SING,C4,H19,no,N,29,,114592,19953,IOR
30,,SING,O4,H20,no,N,30,,114592,19953,IOR
31,,SING,C3,H3,no,N,31,,114592,19953,IOR
32,,SING,C6,H63,no,N,32,,114592,19953,IOR
33,,SING,C6,H61,no,N,33,,114592,19953,IOR
34,,SING,C6,H62,no,N,34,,114592,19953,IOR
35,,SING,C,OXT,no,N,35,,114592,19953,IOR
36,,SING,OXT,HXT,no,N,36,,114592,19953,IOR
1,,DOUB,P,O1,no,N,1,,114669,19958,PO3
2,,SING,P,O2,no,N,2,,114669,19958,PO3
3,,SING,P,O3,no,N,3,,114669,19958,PO3
1,,SING,N,HN1,no,N,1,,114923,19973,NH2
2,,SING,N,HN2,no,N,2,,114923,19973,NH2
1,,SING,N,CA,no,N,1,,114998,19978,AIB
2,,SING,N,H,no,N,2,,114998,19978,AIB
3,,SING,N,H2,no,N,3,,114998,19978,AIB
4,,SING,CA,C,no,N,4,,114998,19978,AIB
5,,SING,CA,CB1,no,N,5,,114998,19978,AIB
6,,SING,CA,CB2,no,N,6,,114998,19978,AIB
7,,DOUB,C,O,no,N,7,,114998,19978,AIB
8,,SING,C,OXT,no,N,8,,114998,19978,AIB
9,,SING,OXT,HO2,no,N,9,,114998,19978,AIB
10,,SING,CB1,HB11,no,N,10,,114998,19978,AIB
11,,SING,CB1,HB12,no,N,11,,114998,19978,AIB
12,,SING,CB1,HB13,no,N,12,,114998,19978,AIB
13,,SING,CB2,HB21,no,N,13,,114998,19978,AIB
14,,SING,CB2,HB22,no,N,14,,114998,19978,AIB
15,,SING,CB2,HB23,no,N,15,,114998,19978,AIB
1,,SING,CHA,C1A,yes,N,1,,115120,19985,HEM
2,,DOUB,CHA,C4D,yes,N,2,,115120,19985,HEM
3,,SING,CHA,HHA,no,N,3,,115120,19985,HEM
4,,SING,CHB,C4A,yes,N,4,,115120,19985,HEM
5,,DOUB,CHB,C1B,yes,N,5,,115120,19985,HEM
6,,SING,CHB,HHB,no,N,6,,115120,19985,HEM
7,,SING,CHC,C4B,yes,N,7,,115120,19985,HEM
8,,DOUB,CHC,C1C,yes,N,8,,115120,19985,HEM
9,,SING,CHC,HHC,no,N,9,,115120,19985,HEM
10,,DOUB,CHD,C4C,yes,N,10,,115120,19985,HEM
11,,SING,CHD,C1D,yes,N,11,,115120,19985,HEM
12,,SING,CHD,HHD,no,N,12,,115120,19985,HEM
13,,DOUB,C1A,C2A,yes,N,13,,115120,19985,HEM
14,,SING,C1A,NA,yes,N,14,,115120,19985,HEM
15,,SING,C2A,C3A,yes,N,15,,115120,19985,HEM
16,,SING,C2A,CAA,no,N,16,,115120,19985,HEM
17,,DOUB,C3A,C4A,yes,N,17,,115120,19985,HEM
18,,SING,C3A,CMA,no,N,18,,115120,19985,HEM
19,,SING,C4A,NA,yes,N,19,,115120,19985,HEM
20,,SING,CMA,HMA,no,N,20,,115120,19985,HEM
21,,SING,CMA,HMAA,no,N,21,,115120,19985,HEM
22,,SING,CMA,HMAB,no,N,22,,115120,19985,HEM
23,,SING,CAA,CBA,no,N,23,,115120,19985,HEM
24,,SING,CAA,HAA,no,N,24,,115120,19985,HEM
25,,SING,CAA,HAAA,no,N,25,,115120,19985,HEM
26,,SING,CBA,CGA,no,N,26,,115120,19985,HEM
27,,SING,CBA,HBA,no,N,27,,115120,19985,HEM
28,,SING,CBA,HBAA,no,N,28,,115120,19985,HEM
29,,DOUB,CGA,O1A,no,N,29,,115120,19985,HEM
30,,SING,CGA,O2A,no,N,30,,115120,19985,HEM
31,,SING,C1B,C2B,no,N,31,,115120,19985,HEM
32,,SING,C1B,NB,yes,N,32,,115120,19985,HEM
33,,DOUB,C2B,C3B,yes,N,33,,115120,19985,HEM
34,,SING,C2B,CMB,yes,N,34,,115120,19985,HEM
35,,SING,C3B,C4B,no,N,35,,115120,19985,HEM
36,,SING,C3B,CAB,yes,N,36,,115120,19985,HEM
37,,DOUB,C4B,NB,no,N,37,,115120,19985,HEM
38,,SING,CMB,HMB,yes,N,38,,115120,19985,HEM
39,,SING,CMB,HMBA,no,N,39,,115120,19985,HEM
40,,SING,CMB,HMBB,no,N,40,,115120,19985,HEM
41,,DOUB,CAB,CBB,no,N,41,,115120,19985,HEM
42,,SING,CAB,HAB,no,N,42,,115120,19985,HEM
43,,SING,CBB,HBB,no,N,43,,115120,19985,HEM
44,,SING,CBB,HBBA,no,N,44,,115120,19985,HEM
45,,SING,C1C,C2C,no,N,45,,115120,19985,HEM
46,,SING,C1C,NC,yes,N,46,,115120,19985,HEM
47,,DOUB,C2C,C3C,yes,N,47,,115120,19985,HEM
48,,SING,C2C,CMC,yes,N,48,,115120,19985,HEM
49,,SING,C3C,C4C,no,N,49,,115120,19985,HEM
50,,SING,C3C,CAC,yes,N,50,,115120,19985,HEM
51,,SING,C4C,NC,no,N,51,,115120,19985,HEM
52,,SING,CMC,HMC,yes,N,52,,115120,19985,HEM
53,,SING,CMC,HMCA,no,N,53,,115120,19985,HEM
54,,SING,CMC,HMCB,no,N,54,,115120,19985,HEM
55,,DOUB,CAC,CBC,no,N,55,,115120,19985,HEM
56,,SING,CAC,HAC,no,N,56,,115120,19985,HEM
57,,SING,CBC,HBC,no,N,57,,115120,19985,HEM
58,,SING,CBC,HBCA,no,N,58,,115120,19985,HEM
59,,SING,C1D,C2D,no,N,59,,115120,19985,HEM
60,,DOUB,C1D,ND,yes,N,60,,115120,19985,HEM
61,,DOUB,C2D,C3D,yes,N,61,,115120,19985,HEM
62,,SING,C2D,CMD,yes,N,62,,115120,19985,HEM
63,,SING,C3D,C4D,no,N,63,,115120,19985,HEM
64,,SING,C3D,CAD,yes,N,64,,115120,19985,HEM
65,,SING,C4D,ND,no,N,65,,115120,19985,HEM
66,,SING,CMD,HMD,yes,N,66,,115120,19985,HEM
67,,SING,CMD,HMDA,no,N,67,,115120,19985,HEM
68,,SING,CMD,HMDB,no,N,68,,115120,19985,HEM
69,,SING,CAD,CBD,no,N,69,,115120,19985,HEM
70,,SING,CAD,HAD,no,N,70,,115120,19985,HEM
71,,SING,CAD,HADA,no,N,71,,115120,19985,HEM
72,,SING,CBD,CGD,no,N,72,,115120,19985,HEM
73,,SING,CBD,HBD,no,N,73,,115120,19985,HEM
74,,SING,CBD,HBDA,no,N,74,,115120,19985,HEM
75,,DOUB,CGD,O1D,no,N,75,,115120,19985,HEM
76,,SING,CGD,O2D,no,N,76,,115120,19985,HEM
77,,SING,O2A,H2A,no,N,77,,115120,19985,HEM
78,,SING,O2D,H2D,no,N,78,,115120,19985,HEM
79,,SING,FE,NA,no,N,79,,115120,19985,HEM
80,,SING,FE,NB,no,N,80,,115120,19985,HEM
81,,SING,FE,NC,no,N,81,,115120,19985,HEM
82,,SING,FE,ND,no,N,82,,115120,19985,HEM
1,,SING,N,CA,no,N,1,,115199,19989,TYS
2,,SING,N,H,no,N,2,,115199,19989,TYS
3,,SING,N,HN2,no,N,3,,115199,19989,TYS
4,,SING,CA,CB,no,N,4,,115199,19989,TYS
5,,SING,CA,C,no,N,5,,115199,19989,TYS
6,,SING,CA,HA,no,N,6,,115199,19989,TYS
7,,SING,CB,CG,no,N,7,,115199,19989,TYS
8,,SING,CB,HB2,no,N,8,,115199,19989,TYS
9,,SING,CB,HB3,no,N,9,,115199,19989,TYS
10,,DOUB,CG,CD1,yes,N,10,,115199,19989,TYS
11,,SING,CG,CD2,yes,N,11,,115199,19989,TYS
12,,SING,CD1,CE1,yes,N,12,,115199,19989,TYS
13,,SING,CD1,HD1,no,N,13,,115199,19989,TYS
14,,DOUB,CD2,CE2,yes,N,14,,115199,19989,TYS
15,,SING,CD2,HD2,no,N,15,,115199,19989,TYS
16,,DOUB,CE1,CZ,yes,N,16,,115199,19989,TYS
17,,SING,CE1,HE1,no,N,17,,115199,19989,TYS
18,,SING,CE2,CZ,yes,N,18,,115199,19989,TYS
19,,SING,CE2,HE2,no,N,19,,115199,19989,TYS
20,,SING,CZ,OH,no,N,20,,115199,19989,TYS
21,,SING,OH,S,no,N,21,,115199,19989,TYS
22,,DOUB,S,O1,no,N,22,,115199,19989,TYS
23,,DOUB,S,O2,no,N,23,,115199,19989,TYS
24,,SING,S,O3,no,N,24,,115199,19989,TYS
25,,SING,O3,HO3,no,N,25,,115199,19989,TYS
26,,DOUB,C,O,no,N,26,,115199,19989,TYS
27,,SING,C,OXT,no,N,27,,115199,19989,TYS
28,,SING,OXT,HXT,no,N,28,,115199,19989,TYS
1,,DOUB,C,O,no,N,1,,115570,20010,ACE
2,,SING,C,CH3,no,N,2,,115570,20010,ACE
3,,SING,C,H,no,N,3,,115570,20010,ACE
4,,SING,CH3,H1,no,N,4,,115570,20010,ACE
5,,SING,CH3,H2,no,N,5,,115570,20010,ACE
6,,SING,CH3,H3,no,N,6,,115570,20010,ACE
1,,SING,N,HN1,no,N,1,,115571,20010,NH2
2,,SING,N,HN2,no,N,2,,115571,20010,NH2
1,,SING,N,HN1,no,N,1,,115605,20012,NH2
2,,SING,N,HN2,no,N,2,,115605,20012,NH2
1,,SING,N,HN1,no,N,1,,115622,20013,NH2
2,,SING,N,HN2,no,N,2,,115622,20013,NH2
1,,SING,N,HN1,no,N,1,,115683,20016,NH2
2,,SING,N,HN2,no,N,2,,115683,20016,NH2
1,,SING,N,HN1,no,N,1,,115701,20017,NH2
2,,SING,N,HN2,no,N,2,,115701,20017,NH2
1,,SING,N,HN1,no,N,1,,115719,20018,NH2
2,,SING,N,HN2,no,N,2,,115719,20018,NH2
1,,SING,N1,N2,,,,,115738,20019,PND
2,,SING,N1,HN11,,,,,115738,20019,PND
3,,SING,N1,HN12,,,,,115738,20019,PND
4,,SING,C1,N2,,,,,115738,20019,PND
5,,DOUB,C1,C2,,,,,115738,20019,PND
6,,SING,C1,C6,,,,,115738,20019,PND
7,,SING,N2,HN2,,,,,115738,20019,PND
8,,SING,C2,C3,,,,,115738,20019,PND
9,,SING,C2,H2,,,,,115738,20019,PND
10,,DOUB,C3,C4,,,,,115738,20019,PND
11,,SING,C3,H3,,,,,115738,20019,PND
12,,SING,C4,N4,,,,,115738,20019,PND
13,,SING,C4,C5,,,,,115738,20019,PND
14,,SING,N4,O3,,,,,115738,20019,PND
15,,DOUB,N4,O4,,,,,115738,20019,PND
16,,DOUB,C5,C6,,,,,115738,20019,PND
17,,SING,C5,H5,,,,,115738,20019,PND
18,,SING,C6,H6,,,,,115738,20019,PND
1,,SING,N1,N2,,,,,115774,20020,PND
2,,SING,N1,HN11,,,,,115774,20020,PND
3,,SING,N1,HN12,,,,,115774,20020,PND
4,,SING,C1,N2,,,,,115774,20020,PND
5,,DOUB,C1,C2,,,,,115774,20020,PND
6,,SING,C1,C6,,,,,115774,20020,PND
7,,SING,N2,HN2,,,,,115774,20020,PND
8,,SING,C2,C3,,,,,115774,20020,PND
9,,SING,C2,H2,,,,,115774,20020,PND
10,,DOUB,C3,C4,,,,,115774,20020,PND
11,,SING,C3,H3,,,,,115774,20020,PND
12,,SING,C4,N4,,,,,115774,20020,PND
13,,SING,C4,C5,,,,,115774,20020,PND
14,,SING,N4,O3,,,,,115774,20020,PND
15,,DOUB,N4,O4,,,,,115774,20020,PND
16,,DOUB,C5,C6,,,,,115774,20020,PND
17,,SING,C5,H5,,,,,115774,20020,PND
18,,SING,C6,H6,,,,,115774,20020,PND
1,,SING,N,HN1,no,N,1,,115796,20022,NH2
2,,SING,N,HN2,no,N,2,,115796,20022,NH2
1,,SING,N,CA,no,N,1,,115814,20023,PCA
2,,SING,N,CD,no,N,2,,115814,20023,PCA
3,,SING,N,H,no,N,3,,115814,20023,PCA
4,,SING,CA,CB,no,N,4,,115814,20023,PCA
5,,SING,CA,C,no,N,5,,115814,20023,PCA
6,,SING,CA,HA,no,N,6,,115814,20023,PCA
7,,SING,CB,CG,no,N,7,,115814,20023,PCA
8,,SING,CB,HB2,no,N,8,,115814,20023,PCA
9,,SING,CB,HB3,no,N,9,,115814,20023,PCA
10,,SING,CG,CD,no,N,10,,115814,20023,PCA
11,,SING,CG,HG2,no,N,11,,115814,20023,PCA
12,,SING,CG,HG3,no,N,12,,115814,20023,PCA
13,,DOUB,CD,OE,no,N,13,,115814,20023,PCA
14,,DOUB,C,O,no,N,14,,115814,20023,PCA
15,,SING,C,OXT,no,N,15,,115814,20023,PCA
16,,SING,OXT,HXT,no,N,16,,115814,20023,PCA
1,,SING,N,HN1,no,N,1,,115815,20023,NH2
2,,SING,N,HN2,no,N,2,,115815,20023,NH2
1,,SING,N,CA,no,N,1,,115840,20024,HYP
2,,SING,N,CD,no,N,2,,115840,20024,HYP
3,,SING,N,H,no,N,3,,115840,20024,HYP
4,,SING,CA,C,no,N,4,,115840,20024,HYP
5,,SING,CA,CB,no,N,5,,115840,20024,HYP
6,,SING,CA,HA,no,N,6,,115840,20024,HYP
7,,DOUB,C,O,no,N,7,,115840,20024,HYP
8,,SING,C,OXT,no,N,8,,115840,20024,HYP
9,,SING,CB,CG,no,N,9,,115840,20024,HYP
10,,SING,CB,HB2,no,N,10,,115840,20024,HYP
11,,SING,CB,HB3,no,N,11,,115840,20024,HYP
12,,SING,CG,CD,no,N,12,,115840,20024,HYP
13,,SING,CG,OD1,no,N,13,,115840,20024,HYP
14,,SING,CG,HG,no,N,14,,115840,20024,HYP
15,,SING,CD,HD22,no,N,15,,115840,20024,HYP
16,,SING,CD,HD23,no,N,16,,115840,20024,HYP
17,,SING,OD1,HD1,no,N,17,,115840,20024,HYP
18,,SING,OXT,HXT,no,N,18,,115840,20024,HYP
1,,SING,C1,C2,no,N,1,,115858,20025,GLP
2,,SING,C1,O1,no,N,2,,115858,20025,GLP
3,,SING,C1,O5,no,N,3,,115858,20025,GLP
4,,SING,C1,H1,no,N,4,,115858,20025,GLP
5,,SING,C2,C3,no,N,5,,115858,20025,GLP
6,,SING,C2,N2,no,N,6,,115858,20025,GLP
7,,SING,C2,H2,no,N,7,,115858,20025,GLP
8,,SING,C3,C4,no,N,8,,115858,20025,GLP
9,,SING,C3,O3,no,N,9,,115858,20025,GLP
10,,SING,C3,H3,no,N,10,,115858,20025,GLP
11,,SING,C4,C5,no,N,11,,115858,20025,GLP
12,,SING,C4,O4,no,N,12,,115858,20025,GLP
13,,SING,C4,H4,no,N,13,,115858,20025,GLP
14,,SING,C5,C6,no,N,14,,115858,20025,GLP
15,,SING,C5,O5,no,N,15,,115858,20025,GLP
16,,SING,C5,H5,no,N,16,,115858,20025,GLP
17,,SING,C6,O6,no,N,17,,115858,20025,GLP
18,,SING,C6,H61,no,N,18,,115858,20025,GLP
19,,SING,C6,H62,no,N,19,,115858,20025,GLP
20,,SING,O1,HO1,no,N,20,,115858,20025,GLP
21,,SING,N2,HN21,no,N,21,,115858,20025,GLP
22,,SING,N2,HN22,no,N,22,,115858,20025,GLP
23,,SING,O3,HO3,no,N,23,,115858,20025,GLP
24,,SING,O4,HO4,no,N,24,,115858,20025,GLP
25,,SING,O6,P,no,N,25,,115858,20025,GLP
26,,DOUB,P,O1P,no,N,26,,115858,20025,GLP
27,,SING,P,O2P,no,N,27,,115858,20025,GLP
28,,SING,P,O3P,no,N,28,,115858,20025,GLP
29,,SING,O2P,HOP2,no,N,29,,115858,20025,GLP
30,,SING,O3P,HOP3,no,N,30,,115858,20025,GLP
1,,SING,N,CA,,,,,115922,20028,SEP
2,,SING,N,H,,,,,115922,20028,SEP
3,,SING,N,H2,,,,,115922,20028,SEP
4,,SING,CA,CB,,,,,115922,20028,SEP
5,,SING,CA,C,,,,,115922,20028,SEP
6,,SING,CA,HA,,,,,115922,20028,SEP
7,,SING,CB,OG,,,,,115922,20028,SEP
8,,SING,CB,HB2,,,,,115922,20028,SEP
9,,SING,CB,HB3,,,,,115922,20028,SEP
10,,SING,OG,P,,,,,115922,20028,SEP
11,,DOUB,C,O,,,,,115922,20028,SEP
12,,SING,C,OXT,,,,,115922,20028,SEP
13,,SING,OXT,HXT,,,,,115922,20028,SEP
14,,DOUB,P,O1P,,,,,115922,20028,SEP
15,,SING,P,O2P,,,,,115922,20028,SEP
16,,SING,P,O3P,,,,,115922,20028,SEP
17,,SING,O2P,HOP2,,,,,115922,20028,SEP
18,,SING,O3P,HOP3,,,,,115922,20028,SEP
1,,SING,N,CA,no,N,1,,116046,20033,ABA
2,,SING,N,H,no,N,2,,116046,20033,ABA
3,,SING,N,HN2,no,N,3,,116046,20033,ABA
4,,SING,CA,C,no,N,4,,116046,20033,ABA
5,,SING,CA,CB,no,N,5,,116046,20033,ABA
6,,SING,CA,HA,no,N,6,,116046,20033,ABA
7,,DOUB,C,O,no,N,7,,116046,20033,ABA
8,,SING,C,OXT,no,N,8,,116046,20033,ABA
9,,SING,CB,CG,no,N,9,,116046,20033,ABA
10,,SING,CB,HB3,no,N,10,,116046,20033,ABA
11,,SING,CB,HB2,no,N,11,,116046,20033,ABA
12,,SING,CG,HG1,no,N,12,,116046,20033,ABA
13,,SING,CG,HG3,no,N,13,,116046,20033,ABA
14,,SING,CG,HG2,no,N,14,,116046,20033,ABA
15,,SING,OXT,HXT,no,N,15,,116046,20033,ABA
1,,SING,N,HN1,no,N,1,,116047,20033,NH2
2,,SING,N,HN2,no,N,2,,116047,20033,NH2
1,,DOUB,C,O,no,N,1,,116072,20034,ACE
2,,SING,C,CH3,no,N,2,,116072,20034,ACE
3,,SING,C,H,no,N,3,,116072,20034,ACE
4,,SING,CH3,H1,no,N,4,,116072,20034,ACE
5,,SING,CH3,H2,no,N,5,,116072,20034,ACE
6,,SING,CH3,H3,no,N,6,,116072,20034,ACE
1,,SING,N,CA,,,,,116106,20037,DPN
2,,SING,N,H,,,,,116106,20037,DPN
3,,SING,N,H2,,,,,116106,20037,DPN
4,,SING,CA,C,,,,,116106,20037,DPN
5,,SING,CA,CB,,,,,116106,20037,DPN
6,,SING,CA,HA,,,,,116106,20037,DPN
7,,DOUB,C,O,,,,,116106,20037,DPN
8,,SING,C,OXT,,,,,116106,20037,DPN
9,,SING,OXT,HXT,,,,,116106,20037,DPN
10,,SING,CB,CG,,,,,116106,20037,DPN
11,,SING,CB,HB2,,,,,116106,20037,DPN
12,,SING,CB,HB3,,,,,116106,20037,DPN
13,,DOUB,CG,CD1,,,,,116106,20037,DPN
14,,SING,CG,CD2,,,,,116106,20037,DPN
15,,SING,CD1,CE1,,,,,116106,20037,DPN
16,,SING,CD1,HD1,,,,,116106,20037,DPN
17,,DOUB,CD2,CE2,,,,,116106,20037,DPN
18,,SING,CD2,HD2,,,,,116106,20037,DPN
19,,DOUB,CE1,CZ,,,,,116106,20037,DPN
20,,SING,CE1,HE1,,,,,116106,20037,DPN
21,,SING,CE2,CZ,,,,,116106,20037,DPN
22,,SING,CE2,HE2,,,,,116106,20037,DPN
23,,SING,CZ,HZ,,,,,116106,20037,DPN
1,,SING,N,CA,no,N,1,,116123,20038,DTR
2,,SING,N,H,no,N,2,,116123,20038,DTR
3,,SING,N,HN2,no,N,3,,116123,20038,DTR
4,,SING,CA,CB,no,N,4,,116123,20038,DTR
5,,SING,CA,C,no,N,5,,116123,20038,DTR
6,,SING,CA,HA,no,N,6,,116123,20038,DTR
7,,SING,CB,CG,no,N,7,,116123,20038,DTR
8,,SING,CB,HB2,no,N,8,,116123,20038,DTR
9,,SING,CB,HB3,no,N,9,,116123,20038,DTR
10,,DOUB,CG,CD1,yes,N,10,,116123,20038,DTR
11,,SING,CG,CD2,yes,N,11,,116123,20038,DTR
12,,SING,CD1,NE1,yes,N,12,,116123,20038,DTR
13,,SING,CD1,HD1,no,N,13,,116123,20038,DTR
14,,SING,NE1,CE2,yes,N,14,,116123,20038,DTR
15,,SING,NE1,HE1,no,N,15,,116123,20038,DTR
16,,DOUB,CE2,CZ2,yes,N,16,,116123,20038,DTR
17,,SING,CE2,CD2,yes,N,17,,116123,20038,DTR
18,,SING,CZ2,CH2,yes,N,18,,116123,20038,DTR
19,,SING,CZ2,HZ2,no,N,19,,116123,20038,DTR
20,,DOUB,CH2,CZ3,yes,N,20,,116123,20038,DTR
21,,SING,CH2,HH2,no,N,21,,116123,20038,DTR
22,,SING,CZ3,CE3,yes,N,22,,116123,20038,DTR
23,,SING,CZ3,HZ3,no,N,23,,116123,20038,DTR
24,,DOUB,CE3,CD2,yes,N,24,,116123,20038,DTR
25,,SING,CE3,HE3,no,N,25,,116123,20038,DTR
26,,DOUB,C,O,no,N,26,,116123,20038,DTR
27,,SING,C,OXT,no,N,27,,116123,20038,DTR
28,,SING,OXT,HXT,no,N,28,,116123,20038,DTR
1,,SING,N,CA,no,N,1,,116140,20039,DLY
2,,SING,N,H,no,N,2,,116140,20039,DLY
3,,SING,N,H2,no,N,3,,116140,20039,DLY
4,,SING,CA,C,no,N,4,,116140,20039,DLY
5,,SING,CA,CB,no,N,5,,116140,20039,DLY
6,,SING,CA,HA,no,N,6,,116140,20039,DLY
7,,DOUB,C,O,no,N,7,,116140,20039,DLY
8,,SING,C,OXT,no,N,8,,116140,20039,DLY
9,,SING,CB,CG,no,N,9,,116140,20039,DLY
10,,SING,CB,HB2,no,N,10,,116140,20039,DLY
11,,SING,CB,HB3,no,N,11,,116140,20039,DLY
12,,SING,CG,CD,no,N,12,,116140,20039,DLY
13,,SING,CG,HG2,no,N,13,,116140,20039,DLY
14,,SING,CG,HG3,no,N,14,,116140,20039,DLY
15,,SING,CD,CE,no,N,15,,116140,20039,DLY
16,,SING,CD,HD2,no,N,16,,116140,20039,DLY
17,,SING,CD,HD3,no,N,17,,116140,20039,DLY
18,,SING,CE,NZ,no,N,18,,116140,20039,DLY
19,,SING,CE,HE2,no,N,19,,116140,20039,DLY
20,,SING,CE,HE3,no,N,20,,116140,20039,DLY
21,,SING,NZ,HZ1,no,N,21,,116140,20039,DLY
22,,SING,NZ,HZ2,no,N,22,,116140,20039,DLY
23,,SING,OXT,HXT,no,N,23,,116140,20039,DLY
1,,SING,N,CA,no,N,1,,116157,20040,DPN
2,,SING,N,H,no,N,2,,116157,20040,DPN
3,,SING,N,H2,no,N,3,,116157,20040,DPN
4,,SING,CA,C,no,N,4,,116157,20040,DPN
5,,SING,CA,CB,no,N,5,,116157,20040,DPN
6,,SING,CA,HA,no,N,6,,116157,20040,DPN
7,,DOUB,C,O,no,N,7,,116157,20040,DPN
8,,SING,C,OXT,no,N,8,,116157,20040,DPN
9,,SING,OXT,HXT,no,N,9,,116157,20040,DPN
10,,SING,CB,CG,no,N,10,,116157,20040,DPN
11,,SING,CB,HB2,no,N,11,,116157,20040,DPN
12,,SING,CB,HB3,no,N,12,,116157,20040,DPN
13,,DOUB,CG,CD1,yes,N,13,,116157,20040,DPN
14,,SING,CG,CD2,yes,N,14,,116157,20040,DPN
15,,SING,CD1,CE1,yes,N,15,,116157,20040,DPN
16,,SING,CD1,HD1,no,N,16,,116157,20040,DPN
17,,DOUB,CD2,CE2,yes,N,17,,116157,20040,DPN
18,,SING,CD2,HD2,no,N,18,,116157,20040,DPN
19,,DOUB,CE1,CZ,yes,N,19,,116157,20040,DPN
20,,SING,CE1,HE1,no,N,20,,116157,20040,DPN
21,,SING,CE2,CZ,yes,N,21,,116157,20040,DPN
22,,SING,CE2,HE2,no,N,22,,116157,20040,DPN
23,,SING,CZ,HZ,no,N,23,,116157,20040,DPN
1,,SING,N,CA,no,N,1,,116158,20040,DTR
2,,SING,N,H,no,N,2,,116158,20040,DTR
3,,SING,N,HN2,no,N,3,,116158,20040,DTR
4,,SING,CA,CB,no,N,4,,116158,20040,DTR
5,,SING,CA,C,no,N,5,,116158,20040,DTR
6,,SING,CA,HA,no,N,6,,116158,20040,DTR
7,,SING,CB,CG,no,N,7,,116158,20040,DTR
8,,SING,CB,HB2,no,N,8,,116158,20040,DTR
9,,SING,CB,HB3,no,N,9,,116158,20040,DTR
10,,DOUB,CG,CD1,yes,N,10,,116158,20040,DTR
11,,SING,CG,CD2,yes,N,11,,116158,20040,DTR
12,,SING,CD1,NE1,yes,N,12,,116158,20040,DTR
13,,SING,CD1,HD1,no,N,13,,116158,20040,DTR
14,,SING,NE1,CE2,yes,N,14,,116158,20040,DTR
15,,SING,NE1,HE1,no,N,15,,116158,20040,DTR
16,,DOUB,CE2,CZ2,yes,N,16,,116158,20040,DTR
17,,SING,CE2,CD2,yes,N,17,,116158,20040,DTR
18,,SING,CZ2,CH2,yes,N,18,,116158,20040,DTR
19,,SING,CZ2,HZ2,no,N,19,,116158,20040,DTR
20,,DOUB,CH2,CZ3,yes,N,20,,116158,20040,DTR
21,,SING,CH2,HH2,no,N,21,,116158,20040,DTR
22,,SING,CZ3,CE3,yes,N,22,,116158,20040,DTR
23,,SING,CZ3,HZ3,no,N,23,,116158,20040,DTR
24,,DOUB,CE3,CD2,yes,N,24,,116158,20040,DTR
25,,SING,CE3,HE3,no,N,25,,116158,20040,DTR
26,,DOUB,C,O,no,N,26,,116158,20040,DTR
27,,SING,C,OXT,no,N,27,,116158,20040,DTR
28,,SING,OXT,HXT,no,N,28,,116158,20040,DTR
1,,SING,N,CA,no,N,1,,116159,20040,DLY
2,,SING,N,H,no,N,2,,116159,20040,DLY
3,,SING,N,H2,no,N,3,,116159,20040,DLY
4,,SING,CA,C,no,N,4,,116159,20040,DLY
5,,SING,CA,CB,no,N,5,,116159,20040,DLY
6,,SING,CA,HA,no,N,6,,116159,20040,DLY
7,,DOUB,C,O,no,N,7,,116159,20040,DLY
8,,SING,C,OXT,no,N,8,,116159,20040,DLY
9,,SING,CB,CG,no,N,9,,116159,20040,DLY
10,,SING,CB,HB2,no,N,10,,116159,20040,DLY
11,,SING,CB,HB3,no,N,11,,116159,20040,DLY
12,,SING,CG,CD,no,N,12,,116159,20040,DLY
13,,SING,CG,HG2,no,N,13,,116159,20040,DLY
14,,SING,CG,HG3,no,N,14,,116159,20040,DLY
15,,SING,CD,CE,no,N,15,,116159,20040,DLY
16,,SING,CD,HD2,no,N,16,,116159,20040,DLY
17,,SING,CD,HD3,no,N,17,,116159,20040,DLY
18,,SING,CE,NZ,no,N,18,,116159,20040,DLY
19,,SING,CE,HE2,no,N,19,,116159,20040,DLY
20,,SING,CE,HE3,no,N,20,,116159,20040,DLY
21,,SING,NZ,HZ1,no,N,21,,116159,20040,DLY
22,,SING,NZ,HZ2,no,N,22,,116159,20040,DLY
23,,SING,OXT,HXT,no,N,23,,116159,20040,DLY
1,,SING,N,CA,no,N,1,,116176,20041,DTR
2,,SING,N,H,no,N,2,,116176,20041,DTR
3,,SING,N,HN2,no,N,3,,116176,20041,DTR
4,,SING,CA,CB,no,N,4,,116176,20041,DTR
5,,SING,CA,C,no,N,5,,116176,20041,DTR
6,,SING,CA,HA,no,N,6,,116176,20041,DTR
7,,SING,CB,CG,no,N,7,,116176,20041,DTR
8,,SING,CB,HB2,no,N,8,,116176,20041,DTR
9,,SING,CB,HB3,no,N,9,,116176,20041,DTR
10,,DOUB,CG,CD1,yes,N,10,,116176,20041,DTR
11,,SING,CG,CD2,yes,N,11,,116176,20041,DTR
12,,SING,CD1,NE1,yes,N,12,,116176,20041,DTR
13,,SING,CD1,HD1,no,N,13,,116176,20041,DTR
14,,SING,NE1,CE2,yes,N,14,,116176,20041,DTR
15,,SING,NE1,HE1,no,N,15,,116176,20041,DTR
16,,DOUB,CE2,CZ2,yes,N,16,,116176,20041,DTR
17,,SING,CE2,CD2,yes,N,17,,116176,20041,DTR
18,,SING,CZ2,CH2,yes,N,18,,116176,20041,DTR
19,,SING,CZ2,HZ2,no,N,19,,116176,20041,DTR
20,,DOUB,CH2,CZ3,yes,N,20,,116176,20041,DTR
21,,SING,CH2,HH2,no,N,21,,116176,20041,DTR
22,,SING,CZ3,CE3,yes,N,22,,116176,20041,DTR
23,,SING,CZ3,HZ3,no,N,23,,116176,20041,DTR
24,,DOUB,CE3,CD2,yes,N,24,,116176,20041,DTR
25,,SING,CE3,HE3,no,N,25,,116176,20041,DTR
26,,DOUB,C,O,no,N,26,,116176,20041,DTR
27,,SING,C,OXT,no,N,27,,116176,20041,DTR
28,,SING,OXT,HXT,no,N,28,,116176,20041,DTR
1,,SING,N,CA,no,N,1,,116177,20041,DLY
2,,SING,N,H,no,N,2,,116177,20041,DLY
3,,SING,N,H2,no,N,3,,116177,20041,DLY
4,,SING,CA,C,no,N,4,,116177,20041,DLY
5,,SING,CA,CB,no,N,5,,116177,20041,DLY
6,,SING,CA,HA,no,N,6,,116177,20041,DLY
7,,DOUB,C,O,no,N,7,,116177,20041,DLY
8,,SING,C,OXT,no,N,8,,116177,20041,DLY
9,,SING,CB,CG,no,N,9,,116177,20041,DLY
10,,SING,CB,HB2,no,N,10,,116177,20041,DLY
11,,SING,CB,HB3,no,N,11,,116177,20041,DLY
12,,SING,CG,CD,no,N,12,,116177,20041,DLY
13,,SING,CG,HG2,no,N,13,,116177,20041,DLY
14,,SING,CG,HG3,no,N,14,,116177,20041,DLY
15,,SING,CD,CE,no,N,15,,116177,20041,DLY
16,,SING,CD,HD2,no,N,16,,116177,20041,DLY
17,,SING,CD,HD3,no,N,17,,116177,20041,DLY
18,,SING,CE,NZ,no,N,18,,116177,20041,DLY
19,,SING,CE,HE2,no,N,19,,116177,20041,DLY
20,,SING,CE,HE3,no,N,20,,116177,20041,DLY
21,,SING,NZ,HZ1,no,N,21,,116177,20041,DLY
22,,SING,NZ,HZ2,no,N,22,,116177,20041,DLY
23,,SING,OXT,HXT,no,N,23,,116177,20041,DLY
1,,SING,N,CA,,,,,116194,20042,DLY
2,,SING,N,H,,,,,116194,20042,DLY
3,,SING,N,H2,,,,,116194,20042,DLY
4,,SING,CA,C,,,,,116194,20042,DLY
5,,SING,CA,CB,,,,,116194,20042,DLY
6,,SING,CA,HA,,,,,116194,20042,DLY
7,,DOUB,C,O,,,,,116194,20042,DLY
8,,SING,C,OXT,,,,,116194,20042,DLY
9,,SING,CB,CG,,,,,116194,20042,DLY
10,,SING,CB,HB2,,,,,116194,20042,DLY
11,,SING,CB,HB3,,,,,116194,20042,DLY
12,,SING,CG,CD,,,,,116194,20042,DLY
13,,SING,CG,HG2,,,,,116194,20042,DLY
14,,SING,CG,HG3,,,,,116194,20042,DLY
15,,SING,CD,CE,,,,,116194,20042,DLY
16,,SING,CD,HD2,,,,,116194,20042,DLY
17,,SING,CD,HD3,,,,,116194,20042,DLY
18,,SING,CE,NZ,,,,,116194,20042,DLY
19,,SING,CE,HE2,,,,,116194,20042,DLY
20,,SING,CE,HE3,,,,,116194,20042,DLY
21,,SING,NZ,HZ1,,,,,116194,20042,DLY
22,,SING,NZ,HZ2,,,,,116194,20042,DLY
23,,SING,OXT,HXT,,,,,116194,20042,DLY
1,,SING,N,CA,,,,,116195,20042,DTH
2,,SING,N,H,,,,,116195,20042,DTH
3,,SING,N,HN2,,,,,116195,20042,DTH
4,,SING,CA,CB,,,,,116195,20042,DTH
5,,SING,CA,C,,,,,116195,20042,DTH
6,,SING,CA,HA,,,,,116195,20042,DTH
7,,SING,CB,CG2,,,,,116195,20042,DTH
8,,SING,CB,OG1,,,,,116195,20042,DTH
9,,SING,CB,HB,,,,,116195,20042,DTH
10,,SING,CG2,HG21,,,,,116195,20042,DTH
11,,SING,CG2,HG22,,,,,116195,20042,DTH
12,,SING,CG2,HG23,,,,,116195,20042,DTH
13,,SING,OG1,HG1,,,,,116195,20042,DTH
14,,DOUB,C,O,,,,,116195,20042,DTH
15,,SING,C,OXT,,,,,116195,20042,DTH
16,,SING,OXT,HXT,,,,,116195,20042,DTH
1,,SING,N,CA,no,N,1,,116212,20043,DTR
2,,SING,N,H,no,N,2,,116212,20043,DTR
3,,SING,N,HN2,no,N,3,,116212,20043,DTR
4,,SING,CA,CB,no,N,4,,116212,20043,DTR
5,,SING,CA,C,no,N,5,,116212,20043,DTR
6,,SING,CA,HA,no,N,6,,116212,20043,DTR
7,,SING,CB,CG,no,N,7,,116212,20043,DTR
8,,SING,CB,HB2,no,N,8,,116212,20043,DTR
9,,SING,CB,HB3,no,N,9,,116212,20043,DTR
10,,DOUB,CG,CD1,yes,N,10,,116212,20043,DTR
11,,SING,CG,CD2,yes,N,11,,116212,20043,DTR
12,,SING,CD1,NE1,yes,N,12,,116212,20043,DTR
13,,SING,CD1,HD1,no,N,13,,116212,20043,DTR
14,,SING,NE1,CE2,yes,N,14,,116212,20043,DTR
15,,SING,NE1,HE1,no,N,15,,116212,20043,DTR
16,,DOUB,CE2,CZ2,yes,N,16,,116212,20043,DTR
17,,SING,CE2,CD2,yes,N,17,,116212,20043,DTR
18,,SING,CZ2,CH2,yes,N,18,,116212,20043,DTR
19,,SING,CZ2,HZ2,no,N,19,,116212,20043,DTR
20,,DOUB,CH2,CZ3,yes,N,20,,116212,20043,DTR
21,,SING,CH2,HH2,no,N,21,,116212,20043,DTR
22,,SING,CZ3,CE3,yes,N,22,,116212,20043,DTR
23,,SING,CZ3,HZ3,no,N,23,,116212,20043,DTR
24,,DOUB,CE3,CD2,yes,N,24,,116212,20043,DTR
25,,SING,CE3,HE3,no,N,25,,116212,20043,DTR
26,,DOUB,C,O,no,N,26,,116212,20043,DTR
27,,SING,C,OXT,no,N,27,,116212,20043,DTR
28,,SING,OXT,HXT,no,N,28,,116212,20043,DTR
1,,SING,N,CA,no,N,1,,116213,20043,DTH
2,,SING,N,H,no,N,2,,116213,20043,DTH
3,,SING,N,HN2,no,N,3,,116213,20043,DTH
4,,SING,CA,CB,no,N,4,,116213,20043,DTH
5,,SING,CA,C,no,N,5,,116213,20043,DTH
6,,SING,CA,HA,no,N,6,,116213,20043,DTH
7,,SING,CB,CG2,no,N,7,,116213,20043,DTH
8,,SING,CB,OG1,no,N,8,,116213,20043,DTH
9,,SING,CB,HB,no,N,9,,116213,20043,DTH
10,,SING,CG2,HG21,no,N,10,,116213,20043,DTH
11,,SING,CG2,HG22,no,N,11,,116213,20043,DTH
12,,SING,CG2,HG23,no,N,12,,116213,20043,DTH
13,,SING,OG1,HG1,no,N,13,,116213,20043,DTH
14,,DOUB,C,O,no,N,14,,116213,20043,DTH
15,,SING,C,OXT,no,N,15,,116213,20043,DTH
16,,SING,OXT,HXT,no,N,16,,116213,20043,DTH
1,,SING,N,CA,,,,,116367,20050,DPR
2,,SING,N,CD,,,,,116367,20050,DPR
3,,SING,N,H,,,,,116367,20050,DPR
4,,SING,CA,CB,,,,,116367,20050,DPR
5,,SING,CA,C,,,,,116367,20050,DPR
6,,SING,CA,HA,,,,,116367,20050,DPR
7,,SING,CB,CG,,,,,116367,20050,DPR
8,,SING,CB,HB2,,,,,116367,20050,DPR
9,,SING,CB,HB3,,,,,116367,20050,DPR
10,,SING,CG,CD,,,,,116367,20050,DPR
11,,SING,CG,HG2,,,,,116367,20050,DPR
12,,SING,CG,HG3,,,,,116367,20050,DPR
13,,SING,CD,HD2,,,,,116367,20050,DPR
14,,SING,CD,HD3,,,,,116367,20050,DPR
15,,DOUB,C,O,,,,,116367,20050,DPR
16,,SING,C,OXT,,,,,116367,20050,DPR
17,,SING,OXT,HXT,,,,,116367,20050,DPR
1,,DOUB,C,O,no,N,1,,116445,20054,ACE
2,,SING,C,CH3,no,N,2,,116445,20054,ACE
3,,SING,C,H,no,N,3,,116445,20054,ACE
4,,SING,CH3,H1,no,N,4,,116445,20054,ACE
5,,SING,CH3,H2,no,N,5,,116445,20054,ACE
6,,SING,CH3,H3,no,N,6,,116445,20054,ACE
1,,SING,N,HN1,no,N,1,,116446,20054,NH2
2,,SING,N,HN2,no,N,2,,116446,20054,NH2
1,,DOUB,C,O,no,N,1,,116468,20055,ACE
2,,SING,C,CH3,no,N,2,,116468,20055,ACE
3,,SING,C,H,no,N,3,,116468,20055,ACE
4,,SING,CH3,H1,no,N,4,,116468,20055,ACE
5,,SING,CH3,H2,no,N,5,,116468,20055,ACE
6,,SING,CH3,H3,no,N,6,,116468,20055,ACE
1,,SING,N,HN1,no,N,1,,116469,20055,NH2
2,,SING,N,HN2,no,N,2,,116469,20055,NH2
1,,DOUB,O,C,,,,,116617,20063,LPD
2,,SING,C,N2,,,,,116617,20063,LPD
3,,SING,C,CA,,,,,116617,20063,LPD
4,,SING,N2,HN21,,,,,116617,20063,LPD
5,,SING,N2,HN22,,,,,116617,20063,LPD
6,,SING,CA,N,,,,,116617,20063,LPD
7,,SING,CA,CB,,,,,116617,20063,LPD
8,,SING,CA,HA,,,,,116617,20063,LPD
9,,SING,N,CD,,,,,116617,20063,LPD
10,,SING,N,H,,,,,116617,20063,LPD
11,,SING,CD,CG,,,,,116617,20063,LPD
12,,SING,CD,HD3,,,,,116617,20063,LPD
13,,SING,CD,HD2,,,,,116617,20063,LPD
14,,SING,CG,CB,,,,,116617,20063,LPD
15,,SING,CG,HG3,,,,,116617,20063,LPD
16,,SING,CG,HG2,,,,,116617,20063,LPD
17,,SING,CB,HB2,,,,,116617,20063,LPD
18,,SING,CB,HB3,,,,,116617,20063,LPD
1,,SING,N,CB,no,N,1,,116650,20065,BAL
2,,SING,N,H,no,N,2,,116650,20065,BAL
3,,SING,N,H2,no,N,3,,116650,20065,BAL
4,,SING,CB,CA,no,N,4,,116650,20065,BAL
5,,SING,CB,HB3,no,N,5,,116650,20065,BAL
6,,SING,CB,HB2,no,N,6,,116650,20065,BAL
7,,SING,CA,C,no,N,7,,116650,20065,BAL
8,,SING,CA,HA1,no,N,8,,116650,20065,BAL
9,,SING,CA,HA2,no,N,9,,116650,20065,BAL
10,,DOUB,C,O,no,N,10,,116650,20065,BAL
11,,SING,C,OXT,no,N,11,,116650,20065,BAL
12,,SING,OXT,HXT,no,N,12,,116650,20065,BAL
1,,SING,N,CB,no,N,1,,116716,20069,BAL
2,,SING,N,H,no,N,2,,116716,20069,BAL
3,,SING,N,H2,no,N,3,,116716,20069,BAL
4,,SING,CB,CA,no,N,4,,116716,20069,BAL
5,,SING,CB,HB3,no,N,5,,116716,20069,BAL
6,,SING,CB,HB2,no,N,6,,116716,20069,BAL
7,,SING,CA,C,no,N,7,,116716,20069,BAL
8,,SING,CA,HA1,no,N,8,,116716,20069,BAL
9,,SING,CA,HA2,no,N,9,,116716,20069,BAL
10,,DOUB,C,O,no,N,10,,116716,20069,BAL
11,,SING,C,OXT,no,N,11,,116716,20069,BAL
12,,SING,OXT,HXT,no,N,12,,116716,20069,BAL
1,,DOUB,C,O,no,N,1,,116735,20070,B3L
2,,SING,C,OXT,no,N,2,,116735,20070,B3L
3,,SING,CA,C,no,N,3,,116735,20070,B3L
4,,SING,CB,CA,no,N,4,,116735,20070,B3L
5,,SING,CB,HB,no,N,5,,116735,20070,B3L
6,,SING,N,CB,no,N,6,,116735,20070,B3L
7,,SING,N,HNA,no,N,7,,116735,20070,B3L
8,,SING,CG,CB,no,N,8,,116735,20070,B3L
9,,SING,CG,HG,no,N,9,,116735,20070,B3L
10,,SING,CD,CG,no,N,10,,116735,20070,B3L
11,,SING,CD,CE1,no,N,11,,116735,20070,B3L
12,,SING,CE2,CD,no,N,12,,116735,20070,B3L
13,,SING,CE2,H1E2,no,N,13,,116735,20070,B3L
14,,SING,CE1,H1E1,no,N,14,,116735,20070,B3L
15,,SING,CE1,H3E1,no,N,15,,116735,20070,B3L
16,,SING,HA,CA,no,N,16,,116735,20070,B3L
17,,SING,HAA,CA,no,N,17,,116735,20070,B3L
7,,DOUB,C,O,,,,,240393,6146,DHA_2
18,,SING,HN,N,no,N,18,,116735,20070,B3L
19,,SING,HGA,CG,no,N,19,,116735,20070,B3L
20,,SING,HD,CD,no,N,20,,116735,20070,B3L
21,,SING,H3E2,CE2,no,N,21,,116735,20070,B3L
22,,SING,H2E2,CE2,no,N,22,,116735,20070,B3L
23,,SING,H2E1,CE1,no,N,23,,116735,20070,B3L
24,,SING,OXT,HXT,no,N,24,,116735,20070,B3L
1,,SING,C1,C2,no,N,1,,116919,20081,GGP
2,,SING,C1,O6,no,N,2,,116919,20081,GGP
3,,SING,C1,C30,no,N,3,,116919,20081,GGP
4,,SING,C1,HC1,no,N,4,,116919,20081,GGP
5,,SING,C2,C3,no,N,5,,116919,20081,GGP
6,,SING,C2,O32,no,N,6,,116919,20081,GGP
7,,SING,C2,HC2,no,N,7,,116919,20081,GGP
8,,SING,C3,C4,no,N,8,,116919,20081,GGP
9,,SING,C3,O56,no,N,9,,116919,20081,GGP
10,,SING,C3,HC3,no,N,10,,116919,20081,GGP
11,,SING,C4,C5,no,N,11,,116919,20081,GGP
12,,SING,C4,O44,no,N,12,,116919,20081,GGP
13,,SING,C4,HC4,no,N,13,,116919,20081,GGP
14,,SING,C5,O6,no,N,14,,116919,20081,GGP
15,,SING,C5,O7,no,N,15,,116919,20081,GGP
16,,SING,C5,HC5,no,N,16,,116919,20081,GGP
17,,SING,O7,C8,no,N,17,,116919,20081,GGP
18,,DOUB,C8,O9,no,N,18,,116919,20081,GGP
19,,SING,C8,C10,no,N,19,,116919,20081,GGP
20,,SING,C10,C11,yes,N,20,,116919,20081,GGP
21,,DOUB,C10,C18,yes,N,21,,116919,20081,GGP
22,,DOUB,C11,C12,yes,N,22,,116919,20081,GGP
23,,SING,C11,H11,no,N,23,,116919,20081,GGP
24,,SING,C12,O13,no,N,24,,116919,20081,GGP
25,,SING,C12,C14,yes,N,25,,116919,20081,GGP
26,,SING,O13,H13,no,N,26,,116919,20081,GGP
27,,SING,C14,O15,no,N,27,,116919,20081,GGP
28,,DOUB,C14,C16,yes,N,28,,116919,20081,GGP
29,,SING,O15,H15,no,N,29,,116919,20081,GGP
30,,SING,C16,O17,no,N,30,,116919,20081,GGP
31,,SING,C16,C18,yes,N,31,,116919,20081,GGP
32,,SING,O17,H17,no,N,32,,116919,20081,GGP
33,,SING,C18,H18,no,N,33,,116919,20081,GGP
34,,DOUB,C19,O20,no,N,34,,116919,20081,GGP
35,,SING,C19,C21,no,N,35,,116919,20081,GGP
36,,SING,C19,O31,no,N,36,,116919,20081,GGP
37,,DOUB,C21,C22,yes,N,37,,116919,20081,GGP
38,,SING,C21,C29,yes,N,38,,116919,20081,GGP
39,,SING,C22,C23,yes,N,39,,116919,20081,GGP
40,,SING,C22,H22,no,N,40,,116919,20081,GGP
41,,SING,C23,O24,no,N,41,,116919,20081,GGP
42,,DOUB,C23,C25,yes,N,42,,116919,20081,GGP
43,,SING,O24,H24,no,N,43,,116919,20081,GGP
44,,SING,C25,O26,no,N,44,,116919,20081,GGP
45,,SING,C25,C27,yes,N,45,,116919,20081,GGP
46,,SING,O26,H26,no,N,46,,116919,20081,GGP
47,,SING,C27,O28,no,N,47,,116919,20081,GGP
48,,DOUB,C27,C29,yes,N,48,,116919,20081,GGP
49,,SING,O28,H28,no,N,49,,116919,20081,GGP
50,,SING,C29,H29,no,N,50,,116919,20081,GGP
51,,SING,C30,O31,no,N,51,,116919,20081,GGP
52,,SING,C30,H301,no,N,52,,116919,20081,GGP
53,,SING,C30,H302,no,N,53,,116919,20081,GGP
54,,SING,O32,C33,no,N,54,,116919,20081,GGP
55,,DOUB,C33,O34,no,N,55,,116919,20081,GGP
56,,SING,C33,C35,no,N,56,,116919,20081,GGP
57,,DOUB,C35,C36,yes,N,57,,116919,20081,GGP
58,,SING,C35,C43,yes,N,58,,116919,20081,GGP
59,,SING,C36,C37,yes,N,59,,116919,20081,GGP
60,,SING,C36,H36,no,N,60,,116919,20081,GGP
61,,SING,C37,O38,no,N,61,,116919,20081,GGP
62,,DOUB,C37,C39,yes,N,62,,116919,20081,GGP
63,,SING,O38,H38,no,N,63,,116919,20081,GGP
64,,SING,C39,O40,no,N,64,,116919,20081,GGP
65,,SING,C39,C41,yes,N,65,,116919,20081,GGP
66,,SING,O40,H40,no,N,66,,116919,20081,GGP
67,,SING,C41,O42,no,N,67,,116919,20081,GGP
68,,DOUB,C41,C43,yes,N,68,,116919,20081,GGP
69,,SING,O42,H42,no,N,69,,116919,20081,GGP
70,,SING,C43,H43,no,N,70,,116919,20081,GGP
71,,SING,O44,C45,no,N,71,,116919,20081,GGP
72,,DOUB,C45,O46,no,N,72,,116919,20081,GGP
73,,SING,C45,C47,no,N,73,,116919,20081,GGP
74,,DOUB,C47,C48,yes,N,74,,116919,20081,GGP
75,,SING,C47,C55,yes,N,75,,116919,20081,GGP
76,,SING,C48,C49,yes,N,76,,116919,20081,GGP
77,,SING,C48,H48,no,N,77,,116919,20081,GGP
78,,SING,C49,O50,no,N,78,,116919,20081,GGP
79,,DOUB,C49,C51,yes,N,79,,116919,20081,GGP
80,,SING,O50,H50,no,N,80,,116919,20081,GGP
81,,SING,C51,O52,no,N,81,,116919,20081,GGP
82,,SING,C51,C53,yes,N,82,,116919,20081,GGP
83,,SING,O52,H52,no,N,83,,116919,20081,GGP
84,,SING,C53,O54,no,N,84,,116919,20081,GGP
85,,DOUB,C53,C55,yes,N,85,,116919,20081,GGP
86,,SING,O54,H54,no,N,86,,116919,20081,GGP
87,,SING,C55,H55,no,N,87,,116919,20081,GGP
88,,SING,O56,C57,no,N,88,,116919,20081,GGP
89,,DOUB,C57,O58,no,N,89,,116919,20081,GGP
90,,SING,C57,C59,no,N,90,,116919,20081,GGP
91,,DOUB,C59,C60,yes,N,91,,116919,20081,GGP
92,,SING,C59,C67,yes,N,92,,116919,20081,GGP
93,,SING,C60,C61,yes,N,93,,116919,20081,GGP
94,,SING,C60,H60,no,N,94,,116919,20081,GGP
95,,SING,C61,O62,no,N,95,,116919,20081,GGP
96,,DOUB,C61,C63,yes,N,96,,116919,20081,GGP
97,,SING,O62,H62,no,N,97,,116919,20081,GGP
98,,SING,C63,O64,no,N,98,,116919,20081,GGP
99,,SING,C63,C65,yes,N,99,,116919,20081,GGP
100,,SING,O64,H64,no,N,100,,116919,20081,GGP
101,,SING,C65,O66,no,N,101,,116919,20081,GGP
102,,DOUB,C65,C67,yes,N,102,,116919,20081,GGP
103,,SING,O66,H66,no,N,103,,116919,20081,GGP
104,,SING,C67,H67,no,N,104,,116919,20081,GGP
1,,DOUB,C,O,no,N,1,,116964,20084,ACT
2,,SING,C,OXT,no,N,2,,116964,20084,ACT
3,,SING,C,CH3,no,N,3,,116964,20084,ACT
4,,SING,CH3,H1,no,N,4,,116964,20084,ACT
5,,SING,CH3,H2,no,N,5,,116964,20084,ACT
6,,SING,CH3,H3,no,N,6,,116964,20084,ACT
1,,SING,N,HN1,no,N,1,,116965,20084,NH2
2,,SING,N,HN2,no,N,2,,116965,20084,NH2
1,,SING,N,CA,,,,,117021,20087,PFF
2,,SING,N,H,,,,,117021,20087,PFF
3,,SING,N,H2,,,,,117021,20087,PFF
4,,SING,CA,C,,,,,117021,20087,PFF
5,,SING,CA,CB,,,,,117021,20087,PFF
6,,SING,CA,HA,,,,,117021,20087,PFF
7,,DOUB,C,O,,,,,117021,20087,PFF
8,,SING,C,OXT,,,,,117021,20087,PFF
9,,SING,OXT,HXT,,,,,117021,20087,PFF
10,,SING,CB,CG,,,,,117021,20087,PFF
11,,SING,CB,HB2,,,,,117021,20087,PFF
12,,SING,CB,HB3,,,,,117021,20087,PFF
13,,DOUB,CG,CD1,,,,,117021,20087,PFF
14,,SING,CG,CD2,,,,,117021,20087,PFF
15,,SING,CD1,CE1,,,,,117021,20087,PFF
16,,SING,CD1,HD1,,,,,117021,20087,PFF
17,,DOUB,CD2,CE2,,,,,117021,20087,PFF
18,,SING,CD2,HD2,,,,,117021,20087,PFF
19,,DOUB,CE1,CZ,,,,,117021,20087,PFF
20,,SING,CE1,HE1,,,,,117021,20087,PFF
21,,SING,CE2,CZ,,,,,117021,20087,PFF
22,,SING,CE2,HE2,,,,,117021,20087,PFF
23,,SING,CZ,F,,,,,117021,20087,PFF
1,,SING,N,HN1,no,N,1,,117022,20087,NH2
2,,SING,N,HN2,no,N,2,,117022,20087,NH2
1,,SING,N,CA,,,,,117040,20088,PFF
2,,SING,N,H,,,,,117040,20088,PFF
3,,SING,N,H2,,,,,117040,20088,PFF
4,,SING,CA,C,,,,,117040,20088,PFF
5,,SING,CA,CB,,,,,117040,20088,PFF
6,,SING,CA,HA,,,,,117040,20088,PFF
7,,DOUB,C,O,,,,,117040,20088,PFF
8,,SING,C,OXT,,,,,117040,20088,PFF
9,,SING,OXT,HXT,,,,,117040,20088,PFF
10,,SING,CB,CG,,,,,117040,20088,PFF
11,,SING,CB,HB2,,,,,117040,20088,PFF
12,,SING,CB,HB3,,,,,117040,20088,PFF
13,,DOUB,CG,CD1,,,,,117040,20088,PFF
14,,SING,CG,CD2,,,,,117040,20088,PFF
15,,SING,CD1,CE1,,,,,117040,20088,PFF
16,,SING,CD1,HD1,,,,,117040,20088,PFF
17,,DOUB,CD2,CE2,,,,,117040,20088,PFF
18,,SING,CD2,HD2,,,,,117040,20088,PFF
19,,DOUB,CE1,CZ,,,,,117040,20088,PFF
20,,SING,CE1,HE1,,,,,117040,20088,PFF
21,,SING,CE2,CZ,,,,,117040,20088,PFF
22,,SING,CE2,HE2,,,,,117040,20088,PFF
23,,SING,CZ,F,,,,,117040,20088,PFF
1,,SING,N,HN1,no,N,1,,117041,20088,NH2
2,,SING,N,HN2,no,N,2,,117041,20088,NH2
1,,SING,N,CA,,,,,117059,20089,PFF
2,,SING,N,H,,,,,117059,20089,PFF
3,,SING,N,H2,,,,,117059,20089,PFF
4,,SING,CA,C,,,,,117059,20089,PFF
5,,SING,CA,CB,,,,,117059,20089,PFF
6,,SING,CA,HA,,,,,117059,20089,PFF
7,,DOUB,C,O,,,,,117059,20089,PFF
8,,SING,C,OXT,,,,,117059,20089,PFF
9,,SING,OXT,HXT,,,,,117059,20089,PFF
10,,SING,CB,CG,,,,,117059,20089,PFF
11,,SING,CB,HB2,,,,,117059,20089,PFF
12,,SING,CB,HB3,,,,,117059,20089,PFF
13,,DOUB,CG,CD1,,,,,117059,20089,PFF
14,,SING,CG,CD2,,,,,117059,20089,PFF
15,,SING,CD1,CE1,,,,,117059,20089,PFF
16,,SING,CD1,HD1,,,,,117059,20089,PFF
17,,DOUB,CD2,CE2,,,,,117059,20089,PFF
18,,SING,CD2,HD2,,,,,117059,20089,PFF
19,,DOUB,CE1,CZ,,,,,117059,20089,PFF
20,,SING,CE1,HE1,,,,,117059,20089,PFF
21,,SING,CE2,CZ,,,,,117059,20089,PFF
22,,SING,CE2,HE2,,,,,117059,20089,PFF
23,,SING,CZ,F,,,,,117059,20089,PFF
1,,SING,N,HN1,no,N,1,,117060,20089,NH2
2,,SING,N,HN2,no,N,2,,117060,20089,NH2
1,,SING,N,CA,,,,,117112,20092,NLE
2,,SING,N,H,,,,,117112,20092,NLE
3,,SING,N,HN2,,,,,117112,20092,NLE
4,,SING,CA,C,,,,,117112,20092,NLE
5,,SING,CA,CB,,,,,117112,20092,NLE
6,,SING,CA,HA,,,,,117112,20092,NLE
7,,DOUB,C,O,,,,,117112,20092,NLE
8,,SING,C,OXT,,,,,117112,20092,NLE
9,,SING,OXT,HXT,,,,,117112,20092,NLE
10,,SING,CB,CG,,,,,117112,20092,NLE
11,,SING,CB,HB2,,,,,117112,20092,NLE
12,,SING,CB,HB3,,,,,117112,20092,NLE
13,,SING,CG,CD,,,,,117112,20092,NLE
14,,SING,CG,HG2,,,,,117112,20092,NLE
15,,SING,CG,HG3,,,,,117112,20092,NLE
16,,SING,CD,CE,,,,,117112,20092,NLE
17,,SING,CD,HD2,,,,,117112,20092,NLE
18,,SING,CD,HD3,,,,,117112,20092,NLE
1,,SING,N,HN1,no,N,1,,117113,20092,NH2
2,,SING,N,HN2,no,N,2,,117113,20092,NH2
1,,SING,N,HN1,no,N,1,,117199,20101,NH2
2,,SING,N,HN2,no,N,2,,117199,20101,NH2
1,,SING,N,CA,no,N,1,,117291,20107,ABA
2,,SING,N,H,no,N,2,,117291,20107,ABA
3,,SING,N,HN2,no,N,3,,117291,20107,ABA
4,,SING,CA,C,no,N,4,,117291,20107,ABA
5,,SING,CA,CB,no,N,5,,117291,20107,ABA
6,,SING,CA,HA,no,N,6,,117291,20107,ABA
7,,DOUB,C,O,no,N,7,,117291,20107,ABA
8,,SING,C,OXT,no,N,8,,117291,20107,ABA
9,,SING,CB,CG,no,N,9,,117291,20107,ABA
10,,SING,CB,HB3,no,N,10,,117291,20107,ABA
11,,SING,CB,HB2,no,N,11,,117291,20107,ABA
12,,SING,CG,HG1,no,N,12,,117291,20107,ABA
13,,SING,CG,HG3,no,N,13,,117291,20107,ABA
14,,SING,CG,HG2,no,N,14,,117291,20107,ABA
15,,SING,OXT,HXT,no,N,15,,117291,20107,ABA
1,,SING,O5',C5',no,N,1,,117344,20110,TYU
2,,SING,O5',H5',no,N,2,,117344,20110,TYU
3,,SING,C5',C4',no,N,3,,117344,20110,TYU
4,,SING,C5',H5'1,no,N,4,,117344,20110,TYU
5,,SING,C5',H5'',no,N,5,,117344,20110,TYU
6,,SING,C4',O4',no,N,6,,117344,20110,TYU
7,,SING,C4',C3',no,N,7,,117344,20110,TYU
8,,SING,C4',H4',no,N,8,,117344,20110,TYU
9,,SING,O4',C1',no,N,9,,117344,20110,TYU
10,,SING,C1',N1,no,N,10,,117344,20110,TYU
11,,SING,C1',C2',no,N,11,,117344,20110,TYU
12,,SING,C1',H1',no,N,12,,117344,20110,TYU
13,,SING,N1,C6,no,N,13,,117344,20110,TYU
14,,SING,N1,C2,no,N,14,,117344,20110,TYU
15,,SING,C6,C5,no,N,15,,117344,20110,TYU
16,,SING,C6,H61,no,N,16,,117344,20110,TYU
17,,SING,C6,H62,no,N,17,,117344,20110,TYU
18,,DOUB,C2,O2,no,N,18,,117344,20110,TYU
19,,SING,C2,N3,no,N,19,,117344,20110,TYU
20,,SING,N3,C4,no,N,20,,117344,20110,TYU
21,,SING,N3,HN3,no,N,21,,117344,20110,TYU
22,,SING,C4,O4,no,N,22,,117344,20110,TYU
23,,SING,C4,C5,no,N,23,,117344,20110,TYU
24,,SING,C4,H4,no,N,24,,117344,20110,TYU
25,,SING,O4,HO4,no,N,25,,117344,20110,TYU
26,,SING,C5,H51,no,N,26,,117344,20110,TYU
27,,SING,C5,H52,no,N,27,,117344,20110,TYU
28,,SING,C2',O2',no,N,28,,117344,20110,TYU
29,,SING,C2',C3',no,N,29,,117344,20110,TYU
30,,SING,C2',H2',no,N,30,,117344,20110,TYU
31,,SING,O2',H1,no,N,31,,117344,20110,TYU
32,,SING,C3',O3',no,N,32,,117344,20110,TYU
33,,SING,C3',H3',no,N,33,,117344,20110,TYU
34,,SING,O3',H2,no,N,34,,117344,20110,TYU
1,,SING,N,CA,,,,,117401,20113,NFA
2,,SING,N,H,,,,,117401,20113,NFA
3,,SING,N,H2,,,,,117401,20113,NFA
4,,SING,CA,C,,,,,117401,20113,NFA
5,,SING,CA,CB,,,,,117401,20113,NFA
6,,SING,CA,HA,,,,,117401,20113,NFA
7,,DOUB,C,O,,,,,117401,20113,NFA
8,,SING,C,NXT,,,,,117401,20113,NFA
9,,SING,CB,CG,,,,,117401,20113,NFA
10,,SING,CB,HB2,,,,,117401,20113,NFA
11,,SING,CB,HB3,,,,,117401,20113,NFA
12,,DOUB,CG,CD1,,,,,117401,20113,NFA
13,,SING,CG,CD2,,,,,117401,20113,NFA
14,,SING,CD1,CE1,,,,,117401,20113,NFA
15,,SING,CD1,HD1,,,,,117401,20113,NFA
16,,DOUB,CD2,CE2,,,,,117401,20113,NFA
17,,SING,CD2,HD2,,,,,117401,20113,NFA
18,,DOUB,CE1,CZ,,,,,117401,20113,NFA
19,,SING,CE1,HE1,,,,,117401,20113,NFA
20,,SING,CE2,CZ,,,,,117401,20113,NFA
21,,SING,CE2,HE2,,,,,117401,20113,NFA
22,,SING,CZ,HZ,,,,,117401,20113,NFA
23,,SING,NXT,HXT1,,,,,117401,20113,NFA
24,,SING,NXT,HXT2,,,,,117401,20113,NFA
1,,DOUB,O,C,no,N,1,,117523,2012,LPD
2,,SING,C,N2,no,N,2,,117523,2012,LPD
3,,SING,C,CA,no,N,3,,117523,2012,LPD
4,,SING,N2,HN21,no,N,4,,117523,2012,LPD
5,,SING,N2,HN22,no,N,5,,117523,2012,LPD
6,,SING,CA,N,no,N,6,,117523,2012,LPD
7,,SING,CA,CB,no,N,7,,117523,2012,LPD
8,,SING,CA,HA,no,N,8,,117523,2012,LPD
9,,SING,N,CD,no,N,9,,117523,2012,LPD
10,,SING,N,H,no,N,10,,117523,2012,LPD
11,,SING,CD,CG,no,N,11,,117523,2012,LPD
12,,SING,CD,HD3,no,N,12,,117523,2012,LPD
13,,SING,CD,HD2,no,N,13,,117523,2012,LPD
14,,SING,CG,CB,no,N,14,,117523,2012,LPD
15,,SING,CG,HG3,no,N,15,,117523,2012,LPD
16,,SING,CG,HG2,no,N,16,,117523,2012,LPD
17,,SING,CB,HB2,no,N,17,,117523,2012,LPD
18,,SING,CB,HB3,no,N,18,,117523,2012,LPD
1,,DOUB,P,OP1,,,,,117537,20121,T23
2,,SING,P,OP2,,,,,117537,20121,T23
3,,SING,P,OP3,,,,,117537,20121,T23
4,,SING,P,O5',,,,,117537,20121,T23
5,,SING,OP2,HOP2,,,,,117537,20121,T23
6,,SING,OP3,HOP3,,,,,117537,20121,T23
7,,SING,O5',C5',,,,,117537,20121,T23
8,,SING,N1,C6,,,,,117537,20121,T23
9,,SING,N1,C2,,,,,117537,20121,T23
10,,SING,N1,C1',,,,,117537,20121,T23
11,,DOUB,C6,C5,,,,,117537,20121,T23
12,,SING,C6,H6,,,,,117537,20121,T23
13,,DOUB,C2,O2,,,,,117537,20121,T23
14,,SING,C2,N3,,,,,117537,20121,T23
20,,SING,C5M,H5A1,,,,,117537,20121,T23
21,,SING,C5M,H5A2,,,,,117537,20121,T23
22,,SING,C5M,H5A3,,,,,117537,20121,T23
23,,SING,C2',O2',,,,,117537,20121,T23
24,,SING,C2',C1',,,,,117537,20121,T23
25,,SING,C2',C3',,,,,117537,20121,T23
26,,SING,C2',H2',,,,,117537,20121,T23
27,,SING,O2',C2M,,,,,117537,20121,T23
28,,SING,C2M,H2M1,,,,,117537,20121,T23
29,,SING,C2M,H2M2,,,,,117537,20121,T23
30,,SING,C2M,H2M3,,,,,117537,20121,T23
31,,SING,C5',C4',,,,,117537,20121,T23
32,,SING,C5',H5',,,,,117537,20121,T23
33,,SING,C5',H5'',,,,,117537,20121,T23
34,,SING,C4',O4',,,,,117537,20121,T23
35,,SING,C4',C3',,,,,117537,20121,T23
36,,SING,C4',H4',,,,,117537,20121,T23
37,,SING,O4',C1',,,,,117537,20121,T23
38,,SING,C1',H1',,,,,117537,20121,T23
39,,SING,C3',C3M,,,,,117537,20121,T23
40,,SING,C3',H3',,,,,117537,20121,T23
41,,SING,C3M,H3M1,,,,,117537,20121,T23
42,,SING,C3M,H3M2,,,,,117537,20121,T23
43,,SING,C3M,H3M3,,,,,117537,20121,T23
1,,DOUB,O,C,no,N,1,,117808,2047,LPD
2,,SING,C,N2,no,N,2,,117808,2047,LPD
3,,SING,C,CA,no,N,3,,117808,2047,LPD
4,,SING,N2,HN21,no,N,4,,117808,2047,LPD
5,,SING,N2,HN22,no,N,5,,117808,2047,LPD
6,,SING,CA,N,no,N,6,,117808,2047,LPD
7,,SING,CA,CB,no,N,7,,117808,2047,LPD
8,,SING,CA,HA,no,N,8,,117808,2047,LPD
9,,SING,N,CD,no,N,9,,117808,2047,LPD
10,,SING,N,H,no,N,10,,117808,2047,LPD
11,,SING,CD,CG,no,N,11,,117808,2047,LPD
12,,SING,CD,HD3,no,N,12,,117808,2047,LPD
13,,SING,CD,HD2,no,N,13,,117808,2047,LPD
14,,SING,CG,CB,no,N,14,,117808,2047,LPD
15,,SING,CG,HG3,no,N,15,,117808,2047,LPD
16,,SING,CG,HG2,no,N,16,,117808,2047,LPD
17,,SING,CB,HB2,no,N,17,,117808,2047,LPD
18,,SING,CB,HB3,no,N,18,,117808,2047,LPD
1,,DOUB,O,C,no,N,1,,117822,2048,LPD
2,,SING,C,N2,no,N,2,,117822,2048,LPD
3,,SING,C,CA,no,N,3,,117822,2048,LPD
4,,SING,N2,HN21,no,N,4,,117822,2048,LPD
5,,SING,N2,HN22,no,N,5,,117822,2048,LPD
6,,SING,CA,N,no,N,6,,117822,2048,LPD
7,,SING,CA,CB,no,N,7,,117822,2048,LPD
8,,SING,CA,HA,no,N,8,,117822,2048,LPD
9,,SING,N,CD,no,N,9,,117822,2048,LPD
10,,SING,N,H,no,N,10,,117822,2048,LPD
11,,SING,CD,CG,no,N,11,,117822,2048,LPD
12,,SING,CD,HD3,no,N,12,,117822,2048,LPD
13,,SING,CD,HD2,no,N,13,,117822,2048,LPD
14,,SING,CG,CB,no,N,14,,117822,2048,LPD
15,,SING,CG,HG3,no,N,15,,117822,2048,LPD
16,,SING,CG,HG2,no,N,16,,117822,2048,LPD
17,,SING,CB,HB2,no,N,17,,117822,2048,LPD
18,,SING,CB,HB3,no,N,18,,117822,2048,LPD
1,,SING,N,CA,no,N,1,,117901,2059,PCA
2,,SING,N,CD,no,N,2,,117901,2059,PCA
3,,SING,N,H,no,N,3,,117901,2059,PCA
4,,SING,CA,CB,no,N,4,,117901,2059,PCA
5,,SING,CA,C,no,N,5,,117901,2059,PCA
6,,SING,CA,HA,no,N,6,,117901,2059,PCA
7,,SING,CB,CG,no,N,7,,117901,2059,PCA
8,,SING,CB,HB2,no,N,8,,117901,2059,PCA
9,,SING,CB,HB3,no,N,9,,117901,2059,PCA
10,,SING,CG,CD,no,N,10,,117901,2059,PCA
11,,SING,CG,HG2,no,N,11,,117901,2059,PCA
12,,SING,CG,HG3,no,N,12,,117901,2059,PCA
13,,DOUB,CD,OE,no,N,13,,117901,2059,PCA
14,,DOUB,C,O,no,N,14,,117901,2059,PCA
15,,SING,C,OXT,no,N,15,,117901,2059,PCA
16,,SING,OXT,HXT,no,N,16,,117901,2059,PCA
1,,DOUB,C,O,no,N,1,,117941,2062,ACE
2,,SING,C,CH3,no,N,2,,117941,2062,ACE
3,,SING,C,H,no,N,3,,117941,2062,ACE
4,,SING,CH3,H1,no,N,4,,117941,2062,ACE
5,,SING,CH3,H2,no,N,5,,117941,2062,ACE
6,,SING,CH3,H3,no,N,6,,117941,2062,ACE
1,,SING,N,HN1,no,N,1,,117942,2062,NH2
2,,SING,N,HN2,no,N,2,,117942,2062,NH2
1,,SING,N,CA,no,N,1,,118156,21001,PCA
2,,SING,N,CD,no,N,2,,118156,21001,PCA
3,,SING,N,H,no,N,3,,118156,21001,PCA
4,,SING,CA,CB,no,N,4,,118156,21001,PCA
5,,SING,CA,C,no,N,5,,118156,21001,PCA
6,,SING,CA,HA,no,N,6,,118156,21001,PCA
7,,SING,CB,CG,no,N,7,,118156,21001,PCA
8,,SING,CB,HB2,no,N,8,,118156,21001,PCA
9,,SING,CB,HB3,no,N,9,,118156,21001,PCA
10,,SING,CG,CD,no,N,10,,118156,21001,PCA
11,,SING,CG,HG2,no,N,11,,118156,21001,PCA
12,,SING,CG,HG3,no,N,12,,118156,21001,PCA
13,,DOUB,CD,OE,no,N,13,,118156,21001,PCA
14,,DOUB,C,O,no,N,14,,118156,21001,PCA
15,,SING,C,OXT,no,N,15,,118156,21001,PCA
16,,SING,OXT,HXT,no,N,16,,118156,21001,PCA
1,,SING,N,CA,no,N,1,,118175,21002,AIB
2,,SING,N,H,no,N,2,,118175,21002,AIB
3,,SING,N,H2,no,N,3,,118175,21002,AIB
4,,SING,CA,C,no,N,4,,118175,21002,AIB
5,,SING,CA,CB1,no,N,5,,118175,21002,AIB
6,,SING,CA,CB2,no,N,6,,118175,21002,AIB
7,,DOUB,C,O,no,N,7,,118175,21002,AIB
8,,SING,C,OXT,no,N,8,,118175,21002,AIB
9,,SING,OXT,HO2,no,N,9,,118175,21002,AIB
10,,SING,CB1,HB11,no,N,10,,118175,21002,AIB
11,,SING,CB1,HB12,no,N,11,,118175,21002,AIB
12,,SING,CB1,HB13,no,N,12,,118175,21002,AIB
13,,SING,CB2,HB21,no,N,13,,118175,21002,AIB
14,,SING,CB2,HB22,no,N,14,,118175,21002,AIB
15,,SING,CB2,HB23,no,N,15,,118175,21002,AIB
1,covalent,SING,C1,C2,,,,,118191,21006,1
2,covalent,SING,C1,C3,,,,,118191,21006,1
3,covalent,SING,C1,N4,,,,,118191,21006,1
4,covalent,SING,C1,H15,,,,,118191,21006,1
5,covalent,SING,C2,C5,,,,,118191,21006,1
6,covalent,SING,C2,H16,,,,,118191,21006,1
7,covalent,SING,C2,H17,,,,,118191,21006,1
8,covalent,SING,C3,O6,,,,,118191,21006,1
9,covalent,DOUB,C3,O7,,,,,118191,21006,1
10,covalent,SING,N4,H18,,,,,118191,21006,1
11,covalent,SING,N4,H19,,,,,118191,21006,1
12,covalent,SING,C5,S8,,,,,118191,21006,1
13,covalent,SING,C5,H20,,,,,118191,21006,1
14,covalent,SING,C5,H21,,,,,118191,21006,1
15,covalent,SING,O6,H22,,,,,118191,21006,1
16,covalent,SING,S8,C9,,,,,118191,21006,1
17,covalent,SING,C9,C10,,,,,118191,21006,1
18,covalent,SING,C9,H23,,,,,118191,21006,1
19,covalent,SING,C9,H24,,,,,118191,21006,1
20,covalent,SING,C10,C11,,,,,118191,21006,1
21,covalent,SING,C10,N12,,,,,118191,21006,1
22,covalent,SING,C10,H25,,,,,118191,21006,1
23,covalent,SING,C11,O13,,,,,118191,21006,1
24,covalent,DOUB,C11,O14,,,,,118191,21006,1
25,covalent,SING,N12,H26,,,,,118191,21006,1
26,covalent,SING,N12,H27,,,,,118191,21006,1
27,covalent,SING,O13,H28,,,,,118191,21006,1
1,covalent,SING,C1,C2,,,,,118211,21007,1
2,covalent,SING,C1,C3,,,,,118211,21007,1
3,covalent,SING,C1,N4,,,,,118211,21007,1
4,covalent,SING,C1,H15,,,,,118211,21007,1
5,covalent,SING,C2,C5,,,,,118211,21007,1
6,covalent,SING,C2,H16,,,,,118211,21007,1
7,covalent,SING,C2,H17,,,,,118211,21007,1
8,covalent,SING,C3,O6,,,,,118211,21007,1
9,covalent,DOUB,C3,O7,,,,,118211,21007,1
10,covalent,SING,N4,H18,,,,,118211,21007,1
11,covalent,SING,N4,H19,,,,,118211,21007,1
12,covalent,SING,C5,S8,,,,,118211,21007,1
13,covalent,SING,C5,H20,,,,,118211,21007,1
14,covalent,SING,C5,H21,,,,,118211,21007,1
15,covalent,SING,O6,H22,,,,,118211,21007,1
16,covalent,SING,S8,C9,,,,,118211,21007,1
17,covalent,SING,C9,C10,,,,,118211,21007,1
18,covalent,SING,C9,H23,,,,,118211,21007,1
19,covalent,SING,C9,H24,,,,,118211,21007,1
20,covalent,SING,C10,C11,,,,,118211,21007,1
21,covalent,SING,C10,N12,,,,,118211,21007,1
22,covalent,SING,C10,H25,,,,,118211,21007,1
23,covalent,SING,C11,O13,,,,,118211,21007,1
24,covalent,DOUB,C11,O14,,,,,118211,21007,1
25,covalent,SING,N12,H26,,,,,118211,21007,1
26,covalent,SING,N12,H27,,,,,118211,21007,1
27,covalent,SING,O13,H28,,,,,118211,21007,1
1,,DOUB,C,O,no,N,1,,118247,21009,ACE
2,,SING,C,CH3,no,N,2,,118247,21009,ACE
3,,SING,C,H,no,N,3,,118247,21009,ACE
4,,SING,CH3,H1,no,N,4,,118247,21009,ACE
5,,SING,CH3,H2,no,N,5,,118247,21009,ACE
6,,SING,CH3,H3,no,N,6,,118247,21009,ACE
1,,SING,N,HN1,no,N,1,,118248,21009,NH2
2,,SING,N,HN2,no,N,2,,118248,21009,NH2
1,,DOUB,C,O,no,N,1,,118267,21010,ACE
2,,SING,C,CH3,no,N,2,,118267,21010,ACE
3,,SING,C,H,no,N,3,,118267,21010,ACE
4,,SING,CH3,H1,no,N,4,,118267,21010,ACE
5,,SING,CH3,H2,no,N,5,,118267,21010,ACE
6,,SING,CH3,H3,no,N,6,,118267,21010,ACE
1,,SING,N,HN1,no,N,1,,118268,21010,NH2
2,,SING,N,HN2,no,N,2,,118268,21010,NH2
1,,SING,N,HN1,no,N,1,,118314,21014,NH2
2,,SING,N,HN2,no,N,2,,118314,21014,NH2
1,,DOUB,C,O,no,N,1,,118349,21018,ACE
2,,SING,C,CH3,no,N,2,,118349,21018,ACE
3,,SING,C,H,no,N,3,,118349,21018,ACE
4,,SING,CH3,H1,no,N,4,,118349,21018,ACE
5,,SING,CH3,H2,no,N,5,,118349,21018,ACE
6,,SING,CH3,H3,no,N,6,,118349,21018,ACE
1,,SING,N,CA,no,N,1,,118350,21018,SAR
2,,SING,N,CN,no,N,2,,118350,21018,SAR
3,,SING,N,H,no,N,3,,118350,21018,SAR
4,,SING,CA,C,no,N,4,,118350,21018,SAR
5,,SING,CA,HA2,no,N,5,,118350,21018,SAR
6,,SING,CA,HA3,no,N,6,,118350,21018,SAR
7,,DOUB,C,O,no,N,7,,118350,21018,SAR
8,,SING,C,OXT,no,N,8,,118350,21018,SAR
9,,SING,CN,HN1,no,N,9,,118350,21018,SAR
10,,SING,CN,HN2,no,N,10,,118350,21018,SAR
11,,SING,CN,HN3,no,N,11,,118350,21018,SAR
12,,SING,OXT,HXT,no,N,12,,118350,21018,SAR
1,,DOUB,NG,CD1,yes,N,1,,118351,21018,TRM
2,,SING,NG,CD2,yes,N,2,,118351,21018,TRM
3,,SING,CD1,NE1,yes,N,3,,118351,21018,TRM
4,,SING,CD1,C,no,N,4,,118351,21018,TRM
5,,SING,NE1,CE2,yes,N,5,,118351,21018,TRM
6,,SING,NE1,HE11,no,N,6,,118351,21018,TRM
7,,DOUB,CE2,CZ2,yes,N,7,,118351,21018,TRM
8,,SING,CE2,CD2,yes,N,8,,118351,21018,TRM
9,,SING,CZ2,CH2,yes,N,9,,118351,21018,TRM
10,,SING,CZ2,HZ21,no,N,10,,118351,21018,TRM
11,,DOUB,CH2,CZ3,yes,N,11,,118351,21018,TRM
12,,SING,CH2,HH21,no,N,12,,118351,21018,TRM
13,,SING,CZ3,CE3,yes,N,13,,118351,21018,TRM
14,,SING,CZ3,HZ31,no,N,14,,118351,21018,TRM
15,,DOUB,CE3,CD2,yes,N,15,,118351,21018,TRM
16,,SING,CE3,HE31,no,N,16,,118351,21018,TRM
17,,DOUB,C,O,no,N,17,,118351,21018,TRM
18,,SING,C,OXT,no,N,18,,118351,21018,TRM
19,,SING,OXT,HXT,no,N,19,,118351,21018,TRM
1,,SING,N,HN1,no,N,1,,118352,21018,NH2
2,,SING,N,HN2,no,N,2,,118352,21018,NH2
1,,SING,ZN,NA,no,N,1,,118456,21027,ZEM
2,,SING,ZN,NB,no,N,2,,118456,21027,ZEM
3,,SING,ZN,NC,no,N,3,,118456,21027,ZEM
4,,SING,ZN,ND,no,N,4,,118456,21027,ZEM
5,,SING,NA,C1A,yes,N,5,,118456,21027,ZEM
6,,SING,NA,C4A,yes,N,6,,118456,21027,ZEM
7,,SING,NB,C1B,yes,N,7,,118456,21027,ZEM
8,,DOUB,NB,C4B,yes,N,8,,118456,21027,ZEM
9,,SING,NC,C1C,yes,N,9,,118456,21027,ZEM
10,,SING,NC,C4C,yes,N,10,,118456,21027,ZEM
11,,SING,ND,C4D,yes,N,11,,118456,21027,ZEM
12,,DOUB,ND,C1D,yes,N,12,,118456,21027,ZEM
13,,SING,C1A,CHA,yes,N,13,,118456,21027,ZEM
14,,DOUB,C1A,C2A,yes,N,14,,118456,21027,ZEM
15,,DOUB,CHA,C4D,yes,N,15,,118456,21027,ZEM
16,,SING,CHA,HHA,no,N,16,,118456,21027,ZEM
17,,SING,C4D,C3D,no,N,17,,118456,21027,ZEM
18,,DOUB,C1B,CHB,yes,N,18,,118456,21027,ZEM
19,,SING,C1B,C2B,no,N,19,,118456,21027,ZEM
20,,SING,CHB,OZ,no,N,20,,118456,21027,ZEM
21,,SING,CHB,C4A,yes,N,21,,118456,21027,ZEM
22,,SING,OZ,HZ,no,N,22,,118456,21027,ZEM
23,,DOUB,C4A,C3A,yes,N,23,,118456,21027,ZEM
24,,DOUB,C1C,CHC,yes,N,24,,118456,21027,ZEM
25,,SING,C1C,C2C,yes,N,25,,118456,21027,ZEM
26,,SING,CHC,C4B,yes,N,26,,118456,21027,ZEM
27,,SING,CHC,HHC,no,N,27,,118456,21027,ZEM
28,,SING,C4B,C3B,no,N,28,,118456,21027,ZEM
29,,SING,C1D,CHD,yes,N,29,,118456,21027,ZEM
30,,SING,C1D,C2D,no,N,30,,118456,21027,ZEM
31,,DOUB,CHD,C4C,yes,N,31,,118456,21027,ZEM
32,,SING,CHD,HHD,no,N,32,,118456,21027,ZEM
33,,SING,C4C,C3C,yes,N,33,,118456,21027,ZEM
34,,SING,C2A,CAA,no,N,34,,118456,21027,ZEM
35,,SING,C2A,C3A,yes,N,35,,118456,21027,ZEM
36,,SING,CAA,CBA,no,N,36,,118456,21027,ZEM
37,,SING,CAA,HAA1,no,N,37,,118456,21027,ZEM
38,,SING,CAA,HAA2,no,N,38,,118456,21027,ZEM
39,,SING,C3A,CMA,no,N,39,,118456,21027,ZEM
40,,SING,CMA,HMA1,no,N,40,,118456,21027,ZEM
41,,SING,CMA,HMA2,no,N,41,,118456,21027,ZEM
42,,SING,CMA,HMA3,no,N,42,,118456,21027,ZEM
43,,SING,CBA,CGA,no,N,43,,118456,21027,ZEM
44,,SING,CBA,HBA1,no,N,44,,118456,21027,ZEM
45,,SING,CBA,HBA2,no,N,45,,118456,21027,ZEM
46,,DOUB,CGA,O1A,no,N,46,,118456,21027,ZEM
47,,SING,CGA,O2A,no,N,47,,118456,21027,ZEM
48,,SING,O2A,H2A,no,N,48,,118456,21027,ZEM
49,,SING,C2B,CMB,no,N,49,,118456,21027,ZEM
50,,DOUB,C2B,C3B,no,N,50,,118456,21027,ZEM
51,,SING,CMB,HMB1,no,N,51,,118456,21027,ZEM
52,,SING,CMB,HMB2,no,N,52,,118456,21027,ZEM
53,,SING,CMB,HMB3,no,N,53,,118456,21027,ZEM
54,,SING,C3B,CAB,no,N,54,,118456,21027,ZEM
55,,DOUB,CAB,CBB,no,N,55,,118456,21027,ZEM
56,,SING,CAB,HAB,no,N,56,,118456,21027,ZEM
57,,SING,CBB,HBB1,no,N,57,,118456,21027,ZEM
58,,SING,CBB,HBB2,no,N,58,,118456,21027,ZEM
59,,SING,C2C,CMC,no,N,59,,118456,21027,ZEM
60,,DOUB,C2C,C3C,yes,N,60,,118456,21027,ZEM
61,,SING,CMC,HMC1,no,N,61,,118456,21027,ZEM
62,,SING,CMC,HMC2,no,N,62,,118456,21027,ZEM
63,,SING,CMC,HMC3,no,N,63,,118456,21027,ZEM
64,,SING,C3C,CAC,no,N,64,,118456,21027,ZEM
65,,DOUB,CAC,CBC,no,N,65,,118456,21027,ZEM
66,,SING,CAC,HAC,no,N,66,,118456,21027,ZEM
67,,SING,CBC,HBC1,no,N,67,,118456,21027,ZEM
68,,SING,CBC,HBC2,no,N,68,,118456,21027,ZEM
69,,SING,C2D,CMD,no,N,69,,118456,21027,ZEM
70,,DOUB,C2D,C3D,no,N,70,,118456,21027,ZEM
71,,SING,CMD,HMD1,no,N,71,,118456,21027,ZEM
72,,SING,CMD,HMD2,no,N,72,,118456,21027,ZEM
73,,SING,CMD,HMD3,no,N,73,,118456,21027,ZEM
74,,SING,C3D,CAD,no,N,74,,118456,21027,ZEM
75,,SING,CAD,CBD,no,N,75,,118456,21027,ZEM
76,,SING,CAD,HAD1,no,N,76,,118456,21027,ZEM
77,,SING,CAD,HAD2,no,N,77,,118456,21027,ZEM
78,,SING,CBD,CGD,no,N,78,,118456,21027,ZEM
79,,SING,CBD,HBD1,no,N,79,,118456,21027,ZEM
80,,SING,CBD,HBD2,no,N,80,,118456,21027,ZEM
81,,DOUB,CGD,O1D,no,N,81,,118456,21027,ZEM
82,,SING,CGD,O2D,no,N,82,,118456,21027,ZEM
83,,SING,O2D,H2D,no,N,83,,118456,21027,ZEM
1,,SING,O,HO,no,N,1,,118457,21027,OH
1,,SING,ZN,NA,no,N,1,,118474,21028,ZEM
2,,SING,ZN,NB,no,N,2,,118474,21028,ZEM
3,,SING,ZN,NC,no,N,3,,118474,21028,ZEM
4,,SING,ZN,ND,no,N,4,,118474,21028,ZEM
5,,SING,NA,C1A,yes,N,5,,118474,21028,ZEM
6,,SING,NA,C4A,yes,N,6,,118474,21028,ZEM
7,,SING,NB,C1B,yes,N,7,,118474,21028,ZEM
8,,DOUB,NB,C4B,yes,N,8,,118474,21028,ZEM
9,,SING,NC,C1C,yes,N,9,,118474,21028,ZEM
10,,SING,NC,C4C,yes,N,10,,118474,21028,ZEM
11,,SING,ND,C4D,yes,N,11,,118474,21028,ZEM
12,,DOUB,ND,C1D,yes,N,12,,118474,21028,ZEM
13,,SING,C1A,CHA,yes,N,13,,118474,21028,ZEM
14,,DOUB,C1A,C2A,yes,N,14,,118474,21028,ZEM
15,,DOUB,CHA,C4D,yes,N,15,,118474,21028,ZEM
16,,SING,CHA,HHA,no,N,16,,118474,21028,ZEM
17,,SING,C4D,C3D,no,N,17,,118474,21028,ZEM
18,,DOUB,C1B,CHB,yes,N,18,,118474,21028,ZEM
19,,SING,C1B,C2B,no,N,19,,118474,21028,ZEM
20,,SING,CHB,OZ,no,N,20,,118474,21028,ZEM
21,,SING,CHB,C4A,yes,N,21,,118474,21028,ZEM
22,,SING,OZ,HZ,no,N,22,,118474,21028,ZEM
23,,DOUB,C4A,C3A,yes,N,23,,118474,21028,ZEM
24,,DOUB,C1C,CHC,yes,N,24,,118474,21028,ZEM
25,,SING,C1C,C2C,yes,N,25,,118474,21028,ZEM
26,,SING,CHC,C4B,yes,N,26,,118474,21028,ZEM
27,,SING,CHC,HHC,no,N,27,,118474,21028,ZEM
28,,SING,C4B,C3B,no,N,28,,118474,21028,ZEM
29,,SING,C1D,CHD,yes,N,29,,118474,21028,ZEM
30,,SING,C1D,C2D,no,N,30,,118474,21028,ZEM
31,,DOUB,CHD,C4C,yes,N,31,,118474,21028,ZEM
32,,SING,CHD,HHD,no,N,32,,118474,21028,ZEM
33,,SING,C4C,C3C,yes,N,33,,118474,21028,ZEM
34,,SING,C2A,CAA,no,N,34,,118474,21028,ZEM
35,,SING,C2A,C3A,yes,N,35,,118474,21028,ZEM
36,,SING,CAA,CBA,no,N,36,,118474,21028,ZEM
37,,SING,CAA,HAA1,no,N,37,,118474,21028,ZEM
38,,SING,CAA,HAA2,no,N,38,,118474,21028,ZEM
39,,SING,C3A,CMA,no,N,39,,118474,21028,ZEM
40,,SING,CMA,HMA1,no,N,40,,118474,21028,ZEM
41,,SING,CMA,HMA2,no,N,41,,118474,21028,ZEM
42,,SING,CMA,HMA3,no,N,42,,118474,21028,ZEM
43,,SING,CBA,CGA,no,N,43,,118474,21028,ZEM
44,,SING,CBA,HBA1,no,N,44,,118474,21028,ZEM
45,,SING,CBA,HBA2,no,N,45,,118474,21028,ZEM
46,,DOUB,CGA,O1A,no,N,46,,118474,21028,ZEM
47,,SING,CGA,O2A,no,N,47,,118474,21028,ZEM
48,,SING,O2A,H2A,no,N,48,,118474,21028,ZEM
49,,SING,C2B,CMB,no,N,49,,118474,21028,ZEM
50,,DOUB,C2B,C3B,no,N,50,,118474,21028,ZEM
51,,SING,CMB,HMB1,no,N,51,,118474,21028,ZEM
52,,SING,CMB,HMB2,no,N,52,,118474,21028,ZEM
53,,SING,CMB,HMB3,no,N,53,,118474,21028,ZEM
54,,SING,C3B,CAB,no,N,54,,118474,21028,ZEM
55,,DOUB,CAB,CBB,no,N,55,,118474,21028,ZEM
56,,SING,CAB,HAB,no,N,56,,118474,21028,ZEM
57,,SING,CBB,HBB1,no,N,57,,118474,21028,ZEM
58,,SING,CBB,HBB2,no,N,58,,118474,21028,ZEM
59,,SING,C2C,CMC,no,N,59,,118474,21028,ZEM
60,,DOUB,C2C,C3C,yes,N,60,,118474,21028,ZEM
61,,SING,CMC,HMC1,no,N,61,,118474,21028,ZEM
62,,SING,CMC,HMC2,no,N,62,,118474,21028,ZEM
63,,SING,CMC,HMC3,no,N,63,,118474,21028,ZEM
64,,SING,C3C,CAC,no,N,64,,118474,21028,ZEM
65,,DOUB,CAC,CBC,no,N,65,,118474,21028,ZEM
66,,SING,CAC,HAC,no,N,66,,118474,21028,ZEM
67,,SING,CBC,HBC1,no,N,67,,118474,21028,ZEM
68,,SING,CBC,HBC2,no,N,68,,118474,21028,ZEM
69,,SING,C2D,CMD,no,N,69,,118474,21028,ZEM
70,,DOUB,C2D,C3D,no,N,70,,118474,21028,ZEM
71,,SING,CMD,HMD1,no,N,71,,118474,21028,ZEM
72,,SING,CMD,HMD2,no,N,72,,118474,21028,ZEM
73,,SING,CMD,HMD3,no,N,73,,118474,21028,ZEM
74,,SING,C3D,CAD,no,N,74,,118474,21028,ZEM
75,,SING,CAD,CBD,no,N,75,,118474,21028,ZEM
76,,SING,CAD,HAD1,no,N,76,,118474,21028,ZEM
77,,SING,CAD,HAD2,no,N,77,,118474,21028,ZEM
78,,SING,CBD,CGD,no,N,78,,118474,21028,ZEM
79,,SING,CBD,HBD1,no,N,79,,118474,21028,ZEM
80,,SING,CBD,HBD2,no,N,80,,118474,21028,ZEM
81,,DOUB,CGD,O1D,no,N,81,,118474,21028,ZEM
82,,SING,CGD,O2D,no,N,82,,118474,21028,ZEM
83,,SING,O2D,H2D,no,N,83,,118474,21028,ZEM
1,,SING,O,H1,no,N,1,,118475,21028,HOH
2,,SING,O,H2,no,N,2,,118475,21028,HOH
1,,SING,C1,C2,no,N,1,,118490,21031,MAG
2,,SING,C1,O1,no,N,2,,118490,21031,MAG
3,,SING,C1,O5,no,N,3,,118490,21031,MAG
4,,SING,C1,H1,no,N,4,,118490,21031,MAG
5,,SING,C2,C3,no,N,5,,118490,21031,MAG
6,,SING,C2,N2,no,N,6,,118490,21031,MAG
7,,SING,C2,H2,no,N,7,,118490,21031,MAG
8,,SING,C3,C4,no,N,8,,118490,21031,MAG
9,,SING,C3,O3,no,N,9,,118490,21031,MAG
10,,SING,C3,H3,no,N,10,,118490,21031,MAG
11,,SING,C4,C5,no,N,11,,118490,21031,MAG
12,,SING,C4,O4,no,N,12,,118490,21031,MAG
13,,SING,C4,H4,no,N,13,,118490,21031,MAG
14,,SING,C5,C6,no,N,14,,118490,21031,MAG
15,,SING,C5,O5,no,N,15,,118490,21031,MAG
16,,SING,C5,H5,no,N,16,,118490,21031,MAG
1,,SING,N,CA,,,,,240394,6146,DHB_2
17,,SING,C6,O6,no,N,17,,118490,21031,MAG
18,,SING,C6,H61,no,N,18,,118490,21031,MAG
19,,SING,C6,H62,no,N,19,,118490,21031,MAG
20,,SING,C7,C8,no,N,20,,118490,21031,MAG
21,,SING,C7,N2,no,N,21,,118490,21031,MAG
22,,DOUB,C7,O7,no,N,22,,118490,21031,MAG
23,,SING,C8,H81,no,N,23,,118490,21031,MAG
24,,SING,C8,H82,no,N,24,,118490,21031,MAG
25,,SING,C8,H83,no,N,25,,118490,21031,MAG
26,,SING,N2,HN2,no,N,26,,118490,21031,MAG
27,,SING,O1,CM,no,N,27,,118490,21031,MAG
28,,SING,O3,HO3,no,N,28,,118490,21031,MAG
29,,SING,O4,HO4,no,N,29,,118490,21031,MAG
30,,SING,O6,HO6,no,N,30,,118490,21031,MAG
31,,SING,CM,HM1,no,N,31,,118490,21031,MAG
32,,SING,CM,HM2,no,N,32,,118490,21031,MAG
33,,SING,CM,HM3,no,N,33,,118490,21031,MAG
1,,SING,C1,C2,no,N,1,,118491,21031,GAL
2,,SING,C1,O1,no,N,2,,118491,21031,GAL
3,,SING,C1,O5,no,N,3,,118491,21031,GAL
4,,SING,C1,H1,no,N,4,,118491,21031,GAL
5,,SING,C2,C3,no,N,5,,118491,21031,GAL
6,,SING,C2,O2,no,N,6,,118491,21031,GAL
7,,SING,C2,H2,no,N,7,,118491,21031,GAL
8,,SING,C3,C4,no,N,8,,118491,21031,GAL
9,,SING,C3,O3,no,N,9,,118491,21031,GAL
10,,SING,C3,H3,no,N,10,,118491,21031,GAL
11,,SING,C4,C5,no,N,11,,118491,21031,GAL
12,,SING,C4,O4,no,N,12,,118491,21031,GAL
13,,SING,C4,H4,no,N,13,,118491,21031,GAL
14,,SING,C5,C6,no,N,14,,118491,21031,GAL
15,,SING,C5,O5,no,N,15,,118491,21031,GAL
16,,SING,C5,H5,no,N,16,,118491,21031,GAL
17,,SING,C6,O6,no,N,17,,118491,21031,GAL
18,,SING,C6,H61,no,N,18,,118491,21031,GAL
19,,SING,C6,H62,no,N,19,,118491,21031,GAL
20,,SING,O1,HO1,no,N,20,,118491,21031,GAL
21,,SING,O2,HO2,no,N,21,,118491,21031,GAL
22,,SING,O3,HO3,no,N,22,,118491,21031,GAL
23,,SING,O4,HO4,no,N,23,,118491,21031,GAL
24,,SING,O6,HO6,no,N,24,,118491,21031,GAL
1,,SING,C1,C2,no,N,1,,118492,21031,FUC
2,,SING,C1,O1,no,N,2,,118492,21031,FUC
3,,SING,C1,O5,no,N,3,,118492,21031,FUC
4,,SING,C1,H1,no,N,4,,118492,21031,FUC
5,,SING,C2,C3,no,N,5,,118492,21031,FUC
6,,SING,C2,O2,no,N,6,,118492,21031,FUC
7,,SING,C2,H2,no,N,7,,118492,21031,FUC
8,,SING,C3,C4,no,N,8,,118492,21031,FUC
9,,SING,C3,O3,no,N,9,,118492,21031,FUC
10,,SING,C3,H3,no,N,10,,118492,21031,FUC
11,,SING,C4,C5,no,N,11,,118492,21031,FUC
12,,SING,C4,O4,no,N,12,,118492,21031,FUC
13,,SING,C4,H4,no,N,13,,118492,21031,FUC
14,,SING,C5,C6,no,N,14,,118492,21031,FUC
15,,SING,C5,O5,no,N,15,,118492,21031,FUC
16,,SING,C5,H5,no,N,16,,118492,21031,FUC
17,,SING,C6,H61,no,N,17,,118492,21031,FUC
18,,SING,C6,H62,no,N,18,,118492,21031,FUC
19,,SING,C6,H63,no,N,19,,118492,21031,FUC
20,,SING,O1,HO1,no,N,20,,118492,21031,FUC
21,,SING,O2,HO2,no,N,21,,118492,21031,FUC
22,,SING,O3,HO3,no,N,22,,118492,21031,FUC
23,,SING,O4,HO4,no,N,23,,118492,21031,FUC
1,,SING,C1,C2,no,N,1,,118512,21032,NAG
2,,SING,C1,O1,no,N,2,,118512,21032,NAG
3,,SING,C1,O5,no,N,3,,118512,21032,NAG
4,,SING,C1,H1,no,N,4,,118512,21032,NAG
5,,SING,C2,C3,no,N,5,,118512,21032,NAG
6,,SING,C2,N2,no,N,6,,118512,21032,NAG
7,,SING,C2,H2,no,N,7,,118512,21032,NAG
8,,SING,C3,C4,no,N,8,,118512,21032,NAG
9,,SING,C3,O3,no,N,9,,118512,21032,NAG
10,,SING,C3,H3,no,N,10,,118512,21032,NAG
11,,SING,C4,C5,no,N,11,,118512,21032,NAG
12,,SING,C4,O4,no,N,12,,118512,21032,NAG
13,,SING,C4,H4,no,N,13,,118512,21032,NAG
14,,SING,C5,C6,no,N,14,,118512,21032,NAG
15,,SING,C5,O5,no,N,15,,118512,21032,NAG
16,,SING,C5,H5,no,N,16,,118512,21032,NAG
17,,SING,C6,O6,no,N,17,,118512,21032,NAG
18,,SING,C6,H61,no,N,18,,118512,21032,NAG
19,,SING,C6,H62,no,N,19,,118512,21032,NAG
20,,SING,C7,C8,no,N,20,,118512,21032,NAG
21,,SING,C7,N2,no,N,21,,118512,21032,NAG
22,,DOUB,C7,O7,no,N,22,,118512,21032,NAG
23,,SING,C8,H81,no,N,23,,118512,21032,NAG
24,,SING,C8,H82,no,N,24,,118512,21032,NAG
25,,SING,C8,H83,no,N,25,,118512,21032,NAG
26,,SING,N2,HN2,no,N,26,,118512,21032,NAG
27,,SING,O1,HO1,no,N,27,,118512,21032,NAG
28,,SING,O3,HO3,no,N,28,,118512,21032,NAG
29,,SING,O4,HO4,no,N,29,,118512,21032,NAG
30,,SING,O6,HO6,no,N,30,,118512,21032,NAG
1,,SING,C1,C2,no,N,1,,118513,21032,FUC
2,,SING,C1,O1,no,N,2,,118513,21032,FUC
3,,SING,C1,O5,no,N,3,,118513,21032,FUC
4,,SING,C1,H1,no,N,4,,118513,21032,FUC
5,,SING,C2,C3,no,N,5,,118513,21032,FUC
6,,SING,C2,O2,no,N,6,,118513,21032,FUC
7,,SING,C2,H2,no,N,7,,118513,21032,FUC
8,,SING,C3,C4,no,N,8,,118513,21032,FUC
9,,SING,C3,O3,no,N,9,,118513,21032,FUC
10,,SING,C3,H3,no,N,10,,118513,21032,FUC
11,,SING,C4,C5,no,N,11,,118513,21032,FUC
12,,SING,C4,O4,no,N,12,,118513,21032,FUC
13,,SING,C4,H4,no,N,13,,118513,21032,FUC
14,,SING,C5,C6,no,N,14,,118513,21032,FUC
15,,SING,C5,O5,no,N,15,,118513,21032,FUC
16,,SING,C5,H5,no,N,16,,118513,21032,FUC
17,,SING,C6,H61,no,N,17,,118513,21032,FUC
18,,SING,C6,H62,no,N,18,,118513,21032,FUC
19,,SING,C6,H63,no,N,19,,118513,21032,FUC
20,,SING,O1,HO1,no,N,20,,118513,21032,FUC
21,,SING,O2,HO2,no,N,21,,118513,21032,FUC
22,,SING,O3,HO3,no,N,22,,118513,21032,FUC
23,,SING,O4,HO4,no,N,23,,118513,21032,FUC
1,,SING,C1,C2,no,N,1,,118537,21033,NAG
2,,SING,C1,O1,no,N,2,,118537,21033,NAG
3,,SING,C1,O5,no,N,3,,118537,21033,NAG
4,,SING,C1,H1,no,N,4,,118537,21033,NAG
5,,SING,C2,C3,no,N,5,,118537,21033,NAG
6,,SING,C2,N2,no,N,6,,118537,21033,NAG
7,,SING,C2,H2,no,N,7,,118537,21033,NAG
8,,SING,C3,C4,no,N,8,,118537,21033,NAG
9,,SING,C3,O3,no,N,9,,118537,21033,NAG
10,,SING,C3,H3,no,N,10,,118537,21033,NAG
11,,SING,C4,C5,no,N,11,,118537,21033,NAG
12,,SING,C4,O4,no,N,12,,118537,21033,NAG
13,,SING,C4,H4,no,N,13,,118537,21033,NAG
14,,SING,C5,C6,no,N,14,,118537,21033,NAG
15,,SING,C5,O5,no,N,15,,118537,21033,NAG
16,,SING,C5,H5,no,N,16,,118537,21033,NAG
17,,SING,C6,O6,no,N,17,,118537,21033,NAG
18,,SING,C6,H61,no,N,18,,118537,21033,NAG
19,,SING,C6,H62,no,N,19,,118537,21033,NAG
20,,SING,C7,C8,no,N,20,,118537,21033,NAG
21,,SING,C7,N2,no,N,21,,118537,21033,NAG
22,,DOUB,C7,O7,no,N,22,,118537,21033,NAG
23,,SING,C8,H81,no,N,23,,118537,21033,NAG
24,,SING,C8,H82,no,N,24,,118537,21033,NAG
25,,SING,C8,H83,no,N,25,,118537,21033,NAG
26,,SING,N2,HN2,no,N,26,,118537,21033,NAG
27,,SING,O1,HO1,no,N,27,,118537,21033,NAG
28,,SING,O3,HO3,no,N,28,,118537,21033,NAG
29,,SING,O4,HO4,no,N,29,,118537,21033,NAG
30,,SING,O6,HO6,no,N,30,,118537,21033,NAG
1,,SING,C1,C2,no,N,1,,118538,21033,GAL
2,,SING,C1,O1,no,N,2,,118538,21033,GAL
3,,SING,C1,O5,no,N,3,,118538,21033,GAL
4,,SING,C1,H1,no,N,4,,118538,21033,GAL
5,,SING,C2,C3,no,N,5,,118538,21033,GAL
6,,SING,C2,O2,no,N,6,,118538,21033,GAL
7,,SING,C2,H2,no,N,7,,118538,21033,GAL
8,,SING,C3,C4,no,N,8,,118538,21033,GAL
9,,SING,C3,O3,no,N,9,,118538,21033,GAL
10,,SING,C3,H3,no,N,10,,118538,21033,GAL
11,,SING,C4,C5,no,N,11,,118538,21033,GAL
12,,SING,C4,O4,no,N,12,,118538,21033,GAL
13,,SING,C4,H4,no,N,13,,118538,21033,GAL
14,,SING,C5,C6,no,N,14,,118538,21033,GAL
15,,SING,C5,O5,no,N,15,,118538,21033,GAL
16,,SING,C5,H5,no,N,16,,118538,21033,GAL
17,,SING,C6,O6,no,N,17,,118538,21033,GAL
18,,SING,C6,H61,no,N,18,,118538,21033,GAL
19,,SING,C6,H62,no,N,19,,118538,21033,GAL
20,,SING,O1,HO1,no,N,20,,118538,21033,GAL
21,,SING,O2,HO2,no,N,21,,118538,21033,GAL
22,,SING,O3,HO3,no,N,22,,118538,21033,GAL
23,,SING,O4,HO4,no,N,23,,118538,21033,GAL
24,,SING,O6,HO6,no,N,24,,118538,21033,GAL
1,,SING,C1,C2,no,N,1,,118539,21033,FUC
2,,SING,C1,O1,no,N,2,,118539,21033,FUC
3,,SING,C1,O5,no,N,3,,118539,21033,FUC
4,,SING,C1,H1,no,N,4,,118539,21033,FUC
5,,SING,C2,C3,no,N,5,,118539,21033,FUC
6,,SING,C2,O2,no,N,6,,118539,21033,FUC
7,,SING,C2,H2,no,N,7,,118539,21033,FUC
8,,SING,C3,C4,no,N,8,,118539,21033,FUC
9,,SING,C3,O3,no,N,9,,118539,21033,FUC
10,,SING,C3,H3,no,N,10,,118539,21033,FUC
11,,SING,C4,C5,no,N,11,,118539,21033,FUC
12,,SING,C4,O4,no,N,12,,118539,21033,FUC
13,,SING,C4,H4,no,N,13,,118539,21033,FUC
14,,SING,C5,C6,no,N,14,,118539,21033,FUC
15,,SING,C5,O5,no,N,15,,118539,21033,FUC
16,,SING,C5,H5,no,N,16,,118539,21033,FUC
17,,SING,C6,H61,no,N,17,,118539,21033,FUC
18,,SING,C6,H62,no,N,18,,118539,21033,FUC
19,,SING,C6,H63,no,N,19,,118539,21033,FUC
20,,SING,O1,HO1,no,N,20,,118539,21033,FUC
21,,SING,O2,HO2,no,N,21,,118539,21033,FUC
22,,SING,O3,HO3,no,N,22,,118539,21033,FUC
23,,SING,O4,HO4,no,N,23,,118539,21033,FUC
1,,SING,C1,C2,no,N,1,,118559,21034,MAG
2,,SING,C1,O1,no,N,2,,118559,21034,MAG
3,,SING,C1,O5,no,N,3,,118559,21034,MAG
4,,SING,C1,H1,no,N,4,,118559,21034,MAG
5,,SING,C2,C3,no,N,5,,118559,21034,MAG
6,,SING,C2,N2,no,N,6,,118559,21034,MAG
7,,SING,C2,H2,no,N,7,,118559,21034,MAG
8,,SING,C3,C4,no,N,8,,118559,21034,MAG
9,,SING,C3,O3,no,N,9,,118559,21034,MAG
10,,SING,C3,H3,no,N,10,,118559,21034,MAG
11,,SING,C4,C5,no,N,11,,118559,21034,MAG
12,,SING,C4,O4,no,N,12,,118559,21034,MAG
13,,SING,C4,H4,no,N,13,,118559,21034,MAG
14,,SING,C5,C6,no,N,14,,118559,21034,MAG
15,,SING,C5,O5,no,N,15,,118559,21034,MAG
16,,SING,C5,H5,no,N,16,,118559,21034,MAG
17,,SING,C6,O6,no,N,17,,118559,21034,MAG
18,,SING,C6,H61,no,N,18,,118559,21034,MAG
19,,SING,C6,H62,no,N,19,,118559,21034,MAG
20,,SING,C7,C8,no,N,20,,118559,21034,MAG
21,,SING,C7,N2,no,N,21,,118559,21034,MAG
22,,DOUB,C7,O7,no,N,22,,118559,21034,MAG
23,,SING,C8,H81,no,N,23,,118559,21034,MAG
24,,SING,C8,H82,no,N,24,,118559,21034,MAG
25,,SING,C8,H83,no,N,25,,118559,21034,MAG
26,,SING,N2,HN2,no,N,26,,118559,21034,MAG
27,,SING,O1,CM,no,N,27,,118559,21034,MAG
28,,SING,O3,HO3,no,N,28,,118559,21034,MAG
29,,SING,O4,HO4,no,N,29,,118559,21034,MAG
30,,SING,O6,HO6,no,N,30,,118559,21034,MAG
31,,SING,CM,HM1,no,N,31,,118559,21034,MAG
32,,SING,CM,HM2,no,N,32,,118559,21034,MAG
33,,SING,CM,HM3,no,N,33,,118559,21034,MAG
1,,SING,C1,C2,no,N,1,,118560,21034,GAL
2,,SING,C1,O1,no,N,2,,118560,21034,GAL
3,,SING,C1,O5,no,N,3,,118560,21034,GAL
4,,SING,C1,H1,no,N,4,,118560,21034,GAL
5,,SING,C2,C3,no,N,5,,118560,21034,GAL
6,,SING,C2,O2,no,N,6,,118560,21034,GAL
7,,SING,C2,H2,no,N,7,,118560,21034,GAL
8,,SING,C3,C4,no,N,8,,118560,21034,GAL
9,,SING,C3,O3,no,N,9,,118560,21034,GAL
10,,SING,C3,H3,no,N,10,,118560,21034,GAL
11,,SING,C4,C5,no,N,11,,118560,21034,GAL
12,,SING,C4,O4,no,N,12,,118560,21034,GAL
13,,SING,C4,H4,no,N,13,,118560,21034,GAL
14,,SING,C5,C6,no,N,14,,118560,21034,GAL
15,,SING,C5,O5,no,N,15,,118560,21034,GAL
16,,SING,C5,H5,no,N,16,,118560,21034,GAL
17,,SING,C6,O6,no,N,17,,118560,21034,GAL
18,,SING,C6,H61,no,N,18,,118560,21034,GAL
19,,SING,C6,H62,no,N,19,,118560,21034,GAL
20,,SING,O1,HO1,no,N,20,,118560,21034,GAL
21,,SING,O2,HO2,no,N,21,,118560,21034,GAL
22,,SING,O3,HO3,no,N,22,,118560,21034,GAL
23,,SING,O4,HO4,no,N,23,,118560,21034,GAL
24,,SING,O6,HO6,no,N,24,,118560,21034,GAL
1,,SING,C1,C2,no,N,1,,118561,21034,FUC
2,,SING,C1,O1,no,N,2,,118561,21034,FUC
3,,SING,C1,O5,no,N,3,,118561,21034,FUC
4,,SING,C1,H1,no,N,4,,118561,21034,FUC
5,,SING,C2,C3,no,N,5,,118561,21034,FUC
6,,SING,C2,O2,no,N,6,,118561,21034,FUC
7,,SING,C2,H2,no,N,7,,118561,21034,FUC
8,,SING,C3,C4,no,N,8,,118561,21034,FUC
9,,SING,C3,O3,no,N,9,,118561,21034,FUC
10,,SING,C3,H3,no,N,10,,118561,21034,FUC
11,,SING,C4,C5,no,N,11,,118561,21034,FUC
12,,SING,C4,O4,no,N,12,,118561,21034,FUC
13,,SING,C4,H4,no,N,13,,118561,21034,FUC
14,,SING,C5,C6,no,N,14,,118561,21034,FUC
15,,SING,C5,O5,no,N,15,,118561,21034,FUC
16,,SING,C5,H5,no,N,16,,118561,21034,FUC
17,,SING,C6,H61,no,N,17,,118561,21034,FUC
18,,SING,C6,H62,no,N,18,,118561,21034,FUC
19,,SING,C6,H63,no,N,19,,118561,21034,FUC
20,,SING,O1,HO1,no,N,20,,118561,21034,FUC
21,,SING,O2,HO2,no,N,21,,118561,21034,FUC
22,,SING,O3,HO3,no,N,22,,118561,21034,FUC
23,,SING,O4,HO4,no,N,23,,118561,21034,FUC
1,,SING,N,CA,no,N,1,,118614,21037,DPN
2,,SING,N,H,no,N,2,,118614,21037,DPN
3,,SING,N,H2,no,N,3,,118614,21037,DPN
4,,SING,CA,C,no,N,4,,118614,21037,DPN
5,,SING,CA,CB,no,N,5,,118614,21037,DPN
6,,SING,CA,HA,no,N,6,,118614,21037,DPN
7,,DOUB,C,O,no,N,7,,118614,21037,DPN
8,,SING,C,OXT,no,N,8,,118614,21037,DPN
9,,SING,OXT,HXT,no,N,9,,118614,21037,DPN
10,,SING,CB,CG,no,N,10,,118614,21037,DPN
11,,SING,CB,HB2,no,N,11,,118614,21037,DPN
12,,SING,CB,HB3,no,N,12,,118614,21037,DPN
13,,DOUB,CG,CD1,yes,N,13,,118614,21037,DPN
14,,SING,CG,CD2,yes,N,14,,118614,21037,DPN
15,,SING,CD1,CE1,yes,N,15,,118614,21037,DPN
16,,SING,CD1,HD1,no,N,16,,118614,21037,DPN
17,,DOUB,CD2,CE2,yes,N,17,,118614,21037,DPN
18,,SING,CD2,HD2,no,N,18,,118614,21037,DPN
19,,DOUB,CE1,CZ,yes,N,19,,118614,21037,DPN
20,,SING,CE1,HE1,no,N,20,,118614,21037,DPN
21,,SING,CE2,CZ,yes,N,21,,118614,21037,DPN
22,,SING,CE2,HE2,no,N,22,,118614,21037,DPN
23,,SING,CZ,HZ,no,N,23,,118614,21037,DPN
1,,SING,N,CA,no,N,1,,118630,21038,DLE
2,,SING,N,H,no,N,2,,118630,21038,DLE
3,,SING,N,H2,no,N,3,,118630,21038,DLE
4,,SING,CA,CB,no,N,4,,118630,21038,DLE
5,,SING,CA,C,no,N,5,,118630,21038,DLE
6,,SING,CA,HA,no,N,6,,118630,21038,DLE
7,,SING,CB,CG,no,N,7,,118630,21038,DLE
8,,SING,CB,HB2,no,N,8,,118630,21038,DLE
9,,SING,CB,HB3,no,N,9,,118630,21038,DLE
10,,SING,CG,CD1,no,N,10,,118630,21038,DLE
11,,SING,CG,CD2,no,N,11,,118630,21038,DLE
12,,SING,CG,HG,no,N,12,,118630,21038,DLE
13,,SING,CD1,HD11,no,N,13,,118630,21038,DLE
14,,SING,CD1,HD12,no,N,14,,118630,21038,DLE
15,,SING,CD1,HD13,no,N,15,,118630,21038,DLE
16,,SING,CD2,HD21,no,N,16,,118630,21038,DLE
17,,SING,CD2,HD22,no,N,17,,118630,21038,DLE
18,,SING,CD2,HD23,no,N,18,,118630,21038,DLE
19,,DOUB,C,O,no,N,19,,118630,21038,DLE
20,,SING,C,OXT,no,N,20,,118630,21038,DLE
21,,SING,OXT,HXT,no,N,21,,118630,21038,DLE
1,,DOUB,C,O,no,N,1,,118676,21041,ACE
2,,SING,C,CH3,no,N,2,,118676,21041,ACE
3,,SING,C,H,no,N,3,,118676,21041,ACE
4,,SING,CH3,H1,no,N,4,,118676,21041,ACE
5,,SING,CH3,H2,no,N,5,,118676,21041,ACE
6,,SING,CH3,H3,no,N,6,,118676,21041,ACE
1,,DOUB,C,O,no,N,1,,118692,21042,ACE
2,,SING,C,CH3,no,N,2,,118692,21042,ACE
3,,SING,C,H,no,N,3,,118692,21042,ACE
4,,SING,CH3,H1,no,N,4,,118692,21042,ACE
5,,SING,CH3,H2,no,N,5,,118692,21042,ACE
6,,SING,CH3,H3,no,N,6,,118692,21042,ACE
1,,SING,C1,C2,no,N,1,,118753,21053,MAG
2,,SING,C1,O1,no,N,2,,118753,21053,MAG
3,,SING,C1,O5,no,N,3,,118753,21053,MAG
4,,SING,C1,H1,no,N,4,,118753,21053,MAG
5,,SING,C2,C3,no,N,5,,118753,21053,MAG
6,,SING,C2,N2,no,N,6,,118753,21053,MAG
7,,SING,C2,H2,no,N,7,,118753,21053,MAG
8,,SING,C3,C4,no,N,8,,118753,21053,MAG
9,,SING,C3,O3,no,N,9,,118753,21053,MAG
10,,SING,C3,H3,no,N,10,,118753,21053,MAG
11,,SING,C4,C5,no,N,11,,118753,21053,MAG
12,,SING,C4,O4,no,N,12,,118753,21053,MAG
13,,SING,C4,H4,no,N,13,,118753,21053,MAG
14,,SING,C5,C6,no,N,14,,118753,21053,MAG
15,,SING,C5,O5,no,N,15,,118753,21053,MAG
16,,SING,C5,H5,no,N,16,,118753,21053,MAG
17,,SING,C6,O6,no,N,17,,118753,21053,MAG
18,,SING,C6,H61,no,N,18,,118753,21053,MAG
19,,SING,C6,H62,no,N,19,,118753,21053,MAG
20,,SING,C7,C8,no,N,20,,118753,21053,MAG
21,,SING,C7,N2,no,N,21,,118753,21053,MAG
22,,DOUB,C7,O7,no,N,22,,118753,21053,MAG
23,,SING,C8,H81,no,N,23,,118753,21053,MAG
24,,SING,C8,H82,no,N,24,,118753,21053,MAG
25,,SING,C8,H83,no,N,25,,118753,21053,MAG
26,,SING,N2,HN2,no,N,26,,118753,21053,MAG
27,,SING,O1,CM,no,N,27,,118753,21053,MAG
28,,SING,O3,HO3,no,N,28,,118753,21053,MAG
29,,SING,O4,HO4,no,N,29,,118753,21053,MAG
30,,SING,O6,HO6,no,N,30,,118753,21053,MAG
31,,SING,CM,HM1,no,N,31,,118753,21053,MAG
32,,SING,CM,HM2,no,N,32,,118753,21053,MAG
33,,SING,CM,HM3,no,N,33,,118753,21053,MAG
1,,SING,O,C5,no,N,1,,118754,21053,A2G
2,,SING,C1,O,no,N,2,,118754,21053,A2G
3,,SING,C1,C2,no,N,3,,118754,21053,A2G
4,,SING,C1,H1,no,N,4,,118754,21053,A2G
5,,SING,O1,C1,no,N,5,,118754,21053,A2G
6,,SING,O1,HO1,no,N,6,,118754,21053,A2G
7,,SING,C2,C3,no,N,7,,118754,21053,A2G
8,,SING,C2,H2,no,N,8,,118754,21053,A2G
9,,SING,N2,C2,no,N,9,,118754,21053,A2G
10,,SING,N2,HN2,no,N,10,,118754,21053,A2G
11,,SING,C3,C4,no,N,11,,118754,21053,A2G
12,,SING,C3,O3,no,N,12,,118754,21053,A2G
13,,SING,C3,H3,no,N,13,,118754,21053,A2G
14,,SING,O3,HO3,no,N,14,,118754,21053,A2G
15,,SING,C4,O4,no,N,15,,118754,21053,A2G
16,,SING,C4,H4,no,N,16,,118754,21053,A2G
17,,SING,O4,HO4,no,N,17,,118754,21053,A2G
18,,SING,C5,C4,no,N,18,,118754,21053,A2G
19,,SING,C5,C6,no,N,19,,118754,21053,A2G
20,,SING,C5,H5,no,N,20,,118754,21053,A2G
21,,SING,C6,O6,no,N,21,,118754,21053,A2G
22,,SING,C6,H6,no,N,22,,118754,21053,A2G
23,,SING,C7,N2,no,N,23,,118754,21053,A2G
24,,DOUB,O7,C7,no,N,24,,118754,21053,A2G
25,,SING,C8,C7,no,N,25,,118754,21053,A2G
26,,SING,C8,H8,no,N,26,,118754,21053,A2G
27,,SING,C8,H8A,no,N,27,,118754,21053,A2G
28,,SING,C8,H8B,no,N,28,,118754,21053,A2G
29,,SING,C6,H14,no,N,29,,118754,21053,A2G
30,,SING,O6,H15,no,N,30,,118754,21053,A2G
1,,SING,C1,C2,no,N,1,,118755,21053,FUC
2,,SING,C1,O1,no,N,2,,118755,21053,FUC
3,,SING,C1,O5,no,N,3,,118755,21053,FUC
4,,SING,C1,H1,no,N,4,,118755,21053,FUC
5,,SING,C2,C3,no,N,5,,118755,21053,FUC
6,,SING,C2,O2,no,N,6,,118755,21053,FUC
7,,SING,C2,H2,no,N,7,,118755,21053,FUC
8,,SING,C3,C4,no,N,8,,118755,21053,FUC
9,,SING,C3,O3,no,N,9,,118755,21053,FUC
10,,SING,C3,H3,no,N,10,,118755,21053,FUC
11,,SING,C4,C5,no,N,11,,118755,21053,FUC
12,,SING,C4,O4,no,N,12,,118755,21053,FUC
13,,SING,C4,H4,no,N,13,,118755,21053,FUC
14,,SING,C5,C6,no,N,14,,118755,21053,FUC
15,,SING,C5,O5,no,N,15,,118755,21053,FUC
16,,SING,C5,H5,no,N,16,,118755,21053,FUC
17,,SING,C6,H61,no,N,17,,118755,21053,FUC
18,,SING,C6,H62,no,N,18,,118755,21053,FUC
19,,SING,C6,H63,no,N,19,,118755,21053,FUC
20,,SING,O1,HO1,no,N,20,,118755,21053,FUC
21,,SING,O2,HO2,no,N,21,,118755,21053,FUC
22,,SING,O3,HO3,no,N,22,,118755,21053,FUC
23,,SING,O4,HO4,no,N,23,,118755,21053,FUC
1,,SING,C1,C2,no,N,1,,118774,21054,MAG
2,,SING,C1,O1,no,N,2,,118774,21054,MAG
3,,SING,C1,O5,no,N,3,,118774,21054,MAG
4,,SING,C1,H1,no,N,4,,118774,21054,MAG
5,,SING,C2,C3,no,N,5,,118774,21054,MAG
6,,SING,C2,N2,no,N,6,,118774,21054,MAG
7,,SING,C2,H2,no,N,7,,118774,21054,MAG
8,,SING,C3,C4,no,N,8,,118774,21054,MAG
9,,SING,C3,O3,no,N,9,,118774,21054,MAG
10,,SING,C3,H3,no,N,10,,118774,21054,MAG
11,,SING,C4,C5,no,N,11,,118774,21054,MAG
12,,SING,C4,O4,no,N,12,,118774,21054,MAG
13,,SING,C4,H4,no,N,13,,118774,21054,MAG
14,,SING,C5,C6,no,N,14,,118774,21054,MAG
15,,SING,C5,O5,no,N,15,,118774,21054,MAG
16,,SING,C5,H5,no,N,16,,118774,21054,MAG
17,,SING,C6,O6,no,N,17,,118774,21054,MAG
18,,SING,C6,H61,no,N,18,,118774,21054,MAG
19,,SING,C6,H62,no,N,19,,118774,21054,MAG
20,,SING,C7,C8,no,N,20,,118774,21054,MAG
21,,SING,C7,N2,no,N,21,,118774,21054,MAG
22,,DOUB,C7,O7,no,N,22,,118774,21054,MAG
23,,SING,C8,H81,no,N,23,,118774,21054,MAG
24,,SING,C8,H82,no,N,24,,118774,21054,MAG
25,,SING,C8,H83,no,N,25,,118774,21054,MAG
26,,SING,N2,HN2,no,N,26,,118774,21054,MAG
27,,SING,O1,CM,no,N,27,,118774,21054,MAG
28,,SING,O3,HO3,no,N,28,,118774,21054,MAG
29,,SING,O4,HO4,no,N,29,,118774,21054,MAG
30,,SING,O6,HO6,no,N,30,,118774,21054,MAG
31,,SING,CM,HM1,no,N,31,,118774,21054,MAG
32,,SING,CM,HM2,no,N,32,,118774,21054,MAG
33,,SING,CM,HM3,no,N,33,,118774,21054,MAG
1,,SING,C1,C2,no,N,1,,118775,21054,NAG
2,,SING,C1,O1,no,N,2,,118775,21054,NAG
3,,SING,C1,O5,no,N,3,,118775,21054,NAG
4,,SING,C1,H1,no,N,4,,118775,21054,NAG
5,,SING,C2,C3,no,N,5,,118775,21054,NAG
6,,SING,C2,N2,no,N,6,,118775,21054,NAG
7,,SING,C2,H2,no,N,7,,118775,21054,NAG
8,,SING,C3,C4,no,N,8,,118775,21054,NAG
9,,SING,C3,O3,no,N,9,,118775,21054,NAG
10,,SING,C3,H3,no,N,10,,118775,21054,NAG
11,,SING,C4,C5,no,N,11,,118775,21054,NAG
12,,SING,C4,O4,no,N,12,,118775,21054,NAG
13,,SING,C4,H4,no,N,13,,118775,21054,NAG
14,,SING,C5,C6,no,N,14,,118775,21054,NAG
15,,SING,C5,O5,no,N,15,,118775,21054,NAG
16,,SING,C5,H5,no,N,16,,118775,21054,NAG
17,,SING,C6,O6,no,N,17,,118775,21054,NAG
18,,SING,C6,H61,no,N,18,,118775,21054,NAG
19,,SING,C6,H62,no,N,19,,118775,21054,NAG
20,,SING,C7,C8,no,N,20,,118775,21054,NAG
21,,SING,C7,N2,no,N,21,,118775,21054,NAG
22,,DOUB,C7,O7,no,N,22,,118775,21054,NAG
23,,SING,C8,H81,no,N,23,,118775,21054,NAG
24,,SING,C8,H82,no,N,24,,118775,21054,NAG
25,,SING,C8,H83,no,N,25,,118775,21054,NAG
26,,SING,N2,HN2,no,N,26,,118775,21054,NAG
27,,SING,O1,HO1,no,N,27,,118775,21054,NAG
28,,SING,O3,HO3,no,N,28,,118775,21054,NAG
29,,SING,O4,HO4,no,N,29,,118775,21054,NAG
30,,SING,O6,HO6,no,N,30,,118775,21054,NAG
1,,SING,C1,C2,no,N,1,,118776,21054,FUC
2,,SING,C1,O1,no,N,2,,118776,21054,FUC
3,,SING,C1,O5,no,N,3,,118776,21054,FUC
4,,SING,C1,H1,no,N,4,,118776,21054,FUC
5,,SING,C2,C3,no,N,5,,118776,21054,FUC
6,,SING,C2,O2,no,N,6,,118776,21054,FUC
7,,SING,C2,H2,no,N,7,,118776,21054,FUC
8,,SING,C3,C4,no,N,8,,118776,21054,FUC
9,,SING,C3,O3,no,N,9,,118776,21054,FUC
10,,SING,C3,H3,no,N,10,,118776,21054,FUC
11,,SING,C4,C5,no,N,11,,118776,21054,FUC
12,,SING,C4,O4,no,N,12,,118776,21054,FUC
13,,SING,C4,H4,no,N,13,,118776,21054,FUC
14,,SING,C5,C6,no,N,14,,118776,21054,FUC
15,,SING,C5,O5,no,N,15,,118776,21054,FUC
16,,SING,C5,H5,no,N,16,,118776,21054,FUC
17,,SING,C6,H61,no,N,17,,118776,21054,FUC
18,,SING,C6,H62,no,N,18,,118776,21054,FUC
19,,SING,C6,H63,no,N,19,,118776,21054,FUC
20,,SING,O1,HO1,no,N,20,,118776,21054,FUC
21,,SING,O2,HO2,no,N,21,,118776,21054,FUC
22,,SING,O3,HO3,no,N,22,,118776,21054,FUC
23,,SING,O4,HO4,no,N,23,,118776,21054,FUC
1,,SING,N,HN1,no,N,1,,118829,21058,NH2
2,,SING,N,HN2,no,N,2,,118829,21058,NH2
1,,SING,N,HN1,no,N,1,,118844,21059,NH2
2,,SING,N,HN2,no,N,2,,118844,21059,NH2
1,,SING,N,HN1,no,N,1,,119185,21082,NH2
2,,SING,N,HN2,no,N,2,,119185,21082,NH2
1,,SING,N,CA,no,N,1,,119317,2118,NFA
2,,SING,N,H,no,N,2,,119317,2118,NFA
3,,SING,N,H2,no,N,3,,119317,2118,NFA
4,,SING,CA,C,no,N,4,,119317,2118,NFA
5,,SING,CA,CB,no,N,5,,119317,2118,NFA
6,,SING,CA,HA,no,N,6,,119317,2118,NFA
7,,DOUB,C,O,no,N,7,,119317,2118,NFA
8,,SING,C,NXT,no,N,8,,119317,2118,NFA
9,,SING,CB,CG,no,N,9,,119317,2118,NFA
10,,SING,CB,HB2,no,N,10,,119317,2118,NFA
11,,SING,CB,HB3,no,N,11,,119317,2118,NFA
12,,DOUB,CG,CD1,yes,N,12,,119317,2118,NFA
13,,SING,CG,CD2,yes,N,13,,119317,2118,NFA
14,,SING,CD1,CE1,yes,N,14,,119317,2118,NFA
15,,SING,CD1,HD1,no,N,15,,119317,2118,NFA
16,,DOUB,CD2,CE2,yes,N,16,,119317,2118,NFA
17,,SING,CD2,HD2,no,N,17,,119317,2118,NFA
18,,DOUB,CE1,CZ,yes,N,18,,119317,2118,NFA
19,,SING,CE1,HE1,no,N,19,,119317,2118,NFA
20,,SING,CE2,CZ,yes,N,20,,119317,2118,NFA
21,,SING,CE2,HE2,no,N,21,,119317,2118,NFA
22,,SING,CZ,HZ,no,N,22,,119317,2118,NFA
23,,SING,NXT,HXT1,no,N,23,,119317,2118,NFA
24,,SING,NXT,HXT2,no,N,24,,119317,2118,NFA
1,,SING,C1,C2,no,N,1,,119343,216,AAC
2,,SING,C1,O1,no,N,2,,119343,216,AAC
3,,DOUB,C1,O2,no,N,3,,119343,216,AAC
4,,SING,C2,N1,no,N,4,,119343,216,AAC
5,,SING,C2,HC21,no,N,5,,119343,216,AAC
6,,SING,C2,HC22,no,N,6,,119343,216,AAC
7,,SING,C3,C4,no,N,7,,119343,216,AAC
8,,SING,C3,N1,no,N,8,,119343,216,AAC
9,,DOUB,C3,O3,no,N,9,,119343,216,AAC
10,,SING,C4,HC41,no,N,10,,119343,216,AAC
11,,SING,C4,HC42,no,N,11,,119343,216,AAC
12,,SING,C4,HC43,no,N,12,,119343,216,AAC
13,,SING,N1,HN1,no,N,13,,119343,216,AAC
14,,SING,O1,HO1,no,N,14,,119343,216,AAC
1,,SING,FE,NA,no,N,1,,119344,216,HEC
2,,SING,FE,NB,no,N,2,,119344,216,HEC
3,,SING,FE,NC,no,N,3,,119344,216,HEC
4,,SING,FE,ND,no,N,4,,119344,216,HEC
5,,DOUB,CHA,C1A,no,N,5,,119344,216,HEC
6,,SING,CHA,C4D,no,N,6,,119344,216,HEC
7,,SING,CHA,HHA,no,N,7,,119344,216,HEC
8,,DOUB,CHB,C4A,no,N,8,,119344,216,HEC
9,,SING,CHB,C1B,no,N,9,,119344,216,HEC
10,,SING,CHB,HHB,no,N,10,,119344,216,HEC
11,,DOUB,CHC,C4B,no,N,11,,119344,216,HEC
12,,SING,CHC,C1C,no,N,12,,119344,216,HEC
13,,SING,CHC,HHC,no,N,13,,119344,216,HEC
14,,DOUB,CHD,C4C,no,N,14,,119344,216,HEC
15,,SING,CHD,C1D,no,N,15,,119344,216,HEC
16,,SING,CHD,HHD,no,N,16,,119344,216,HEC
17,,SING,NA,C1A,yes,N,17,,119344,216,HEC
18,,SING,NA,C4A,yes,N,18,,119344,216,HEC
19,,SING,C1A,C2A,yes,N,19,,119344,216,HEC
20,,DOUB,C2A,C3A,yes,N,20,,119344,216,HEC
21,,SING,C2A,CAA,no,N,21,,119344,216,HEC
22,,SING,C3A,C4A,yes,N,22,,119344,216,HEC
23,,SING,C3A,CMA,no,N,23,,119344,216,HEC
24,,SING,CMA,HMA1,no,N,24,,119344,216,HEC
25,,SING,CMA,HMA2,no,N,25,,119344,216,HEC
26,,SING,CMA,HMA3,no,N,26,,119344,216,HEC
27,,SING,CAA,CBA,no,N,27,,119344,216,HEC
28,,SING,CAA,HAA1,no,N,28,,119344,216,HEC
29,,SING,CAA,HAA2,no,N,29,,119344,216,HEC
30,,SING,CBA,CGA,no,N,30,,119344,216,HEC
31,,SING,CBA,HBA1,no,N,31,,119344,216,HEC
32,,SING,CBA,HBA2,no,N,32,,119344,216,HEC
33,,DOUB,CGA,O1A,no,N,33,,119344,216,HEC
34,,SING,CGA,O2A,no,N,34,,119344,216,HEC
35,,SING,O2A,H2A,no,N,35,,119344,216,HEC
36,,SING,NB,C1B,yes,N,36,,119344,216,HEC
37,,SING,NB,C4B,yes,N,37,,119344,216,HEC
38,,DOUB,C1B,C2B,yes,N,38,,119344,216,HEC
39,,SING,C2B,C3B,yes,N,39,,119344,216,HEC
40,,SING,C2B,CMB,no,N,40,,119344,216,HEC
41,,SING,C3B,C4B,yes,N,41,,119344,216,HEC
42,,DOUB,C3B,CAB,no,E,42,,119344,216,HEC
43,,SING,CMB,HMB1,no,N,43,,119344,216,HEC
44,,SING,CMB,HMB2,no,N,44,,119344,216,HEC
45,,SING,CMB,HMB3,no,N,45,,119344,216,HEC
46,,SING,CAB,CBB,no,N,46,,119344,216,HEC
47,,SING,CAB,HAB,no,N,47,,119344,216,HEC
48,,SING,CBB,HBB1,no,N,48,,119344,216,HEC
49,,SING,CBB,HBB2,no,N,49,,119344,216,HEC
50,,SING,CBB,HBB3,no,N,50,,119344,216,HEC
51,,SING,NC,C1C,yes,N,51,,119344,216,HEC
52,,SING,NC,C4C,yes,N,52,,119344,216,HEC
53,,DOUB,C1C,C2C,yes,N,53,,119344,216,HEC
54,,SING,C2C,C3C,yes,N,54,,119344,216,HEC
55,,SING,C2C,CMC,no,N,55,,119344,216,HEC
56,,SING,C3C,C4C,yes,N,56,,119344,216,HEC
57,,DOUB,C3C,CAC,no,E,57,,119344,216,HEC
58,,SING,CMC,HMC1,no,N,58,,119344,216,HEC
59,,SING,CMC,HMC2,no,N,59,,119344,216,HEC
60,,SING,CMC,HMC3,no,N,60,,119344,216,HEC
61,,SING,CAC,CBC,no,N,61,,119344,216,HEC
62,,SING,CAC,HAC,no,N,62,,119344,216,HEC
63,,SING,CBC,HBC1,no,N,63,,119344,216,HEC
64,,SING,CBC,HBC2,no,N,64,,119344,216,HEC
65,,SING,CBC,HBC3,no,N,65,,119344,216,HEC
66,,SING,ND,C1D,yes,N,66,,119344,216,HEC
67,,SING,ND,C4D,yes,N,67,,119344,216,HEC
68,,DOUB,C1D,C2D,yes,N,68,,119344,216,HEC
69,,SING,C2D,C3D,yes,N,69,,119344,216,HEC
70,,SING,C2D,CMD,no,N,70,,119344,216,HEC
71,,DOUB,C3D,C4D,yes,N,71,,119344,216,HEC
72,,SING,C3D,CAD,no,N,72,,119344,216,HEC
73,,SING,CMD,HMD1,no,N,73,,119344,216,HEC
74,,SING,CMD,HMD2,no,N,74,,119344,216,HEC
75,,SING,CMD,HMD3,no,N,75,,119344,216,HEC
76,,SING,CAD,CBD,no,N,76,,119344,216,HEC
77,,SING,CAD,HAD1,no,N,77,,119344,216,HEC
78,,SING,CAD,HAD2,no,N,78,,119344,216,HEC
79,,SING,CBD,CGD,no,N,79,,119344,216,HEC
80,,SING,CBD,HBD1,no,N,80,,119344,216,HEC
81,,SING,CBD,HBD2,no,N,81,,119344,216,HEC
82,,DOUB,CGD,O1D,no,N,82,,119344,216,HEC
83,,SING,CGD,O2D,no,N,83,,119344,216,HEC
84,,SING,O2D,H2D,no,N,84,,119344,216,HEC
1,,SING,C1,C2,no,N,1,,119384,217,AAC
2,,SING,C1,O1,no,N,2,,119384,217,AAC
3,,DOUB,C1,O2,no,N,3,,119384,217,AAC
4,,SING,C2,N1,no,N,4,,119384,217,AAC
5,,SING,C2,HC21,no,N,5,,119384,217,AAC
6,,SING,C2,HC22,no,N,6,,119384,217,AAC
7,,SING,C3,C4,no,N,7,,119384,217,AAC
8,,SING,C3,N1,no,N,8,,119384,217,AAC
9,,DOUB,C3,O3,no,N,9,,119384,217,AAC
10,,SING,C4,HC41,no,N,10,,119384,217,AAC
11,,SING,C4,HC42,no,N,11,,119384,217,AAC
12,,SING,C4,HC43,no,N,12,,119384,217,AAC
13,,SING,N1,HN1,no,N,13,,119384,217,AAC
14,,SING,O1,HO1,no,N,14,,119384,217,AAC
1,,SING,FE,NA,no,N,1,,119385,217,HEC
2,,SING,FE,NB,no,N,2,,119385,217,HEC
3,,SING,FE,NC,no,N,3,,119385,217,HEC
4,,SING,FE,ND,no,N,4,,119385,217,HEC
5,,DOUB,CHA,C1A,no,N,5,,119385,217,HEC
6,,SING,CHA,C4D,no,N,6,,119385,217,HEC
7,,SING,CHA,HHA,no,N,7,,119385,217,HEC
8,,DOUB,CHB,C4A,no,N,8,,119385,217,HEC
9,,SING,CHB,C1B,no,N,9,,119385,217,HEC
10,,SING,CHB,HHB,no,N,10,,119385,217,HEC
11,,DOUB,CHC,C4B,no,N,11,,119385,217,HEC
12,,SING,CHC,C1C,no,N,12,,119385,217,HEC
13,,SING,CHC,HHC,no,N,13,,119385,217,HEC
14,,DOUB,CHD,C4C,no,N,14,,119385,217,HEC
15,,SING,CHD,C1D,no,N,15,,119385,217,HEC
16,,SING,CHD,HHD,no,N,16,,119385,217,HEC
17,,SING,NA,C1A,yes,N,17,,119385,217,HEC
18,,SING,NA,C4A,yes,N,18,,119385,217,HEC
19,,SING,C1A,C2A,yes,N,19,,119385,217,HEC
20,,DOUB,C2A,C3A,yes,N,20,,119385,217,HEC
21,,SING,C2A,CAA,no,N,21,,119385,217,HEC
22,,SING,C3A,C4A,yes,N,22,,119385,217,HEC
23,,SING,C3A,CMA,no,N,23,,119385,217,HEC
24,,SING,CMA,HMA1,no,N,24,,119385,217,HEC
25,,SING,CMA,HMA2,no,N,25,,119385,217,HEC
26,,SING,CMA,HMA3,no,N,26,,119385,217,HEC
27,,SING,CAA,CBA,no,N,27,,119385,217,HEC
28,,SING,CAA,HAA1,no,N,28,,119385,217,HEC
29,,SING,CAA,HAA2,no,N,29,,119385,217,HEC
30,,SING,CBA,CGA,no,N,30,,119385,217,HEC
31,,SING,CBA,HBA1,no,N,31,,119385,217,HEC
32,,SING,CBA,HBA2,no,N,32,,119385,217,HEC
33,,DOUB,CGA,O1A,no,N,33,,119385,217,HEC
34,,SING,CGA,O2A,no,N,34,,119385,217,HEC
35,,SING,O2A,H2A,no,N,35,,119385,217,HEC
36,,SING,NB,C1B,yes,N,36,,119385,217,HEC
37,,SING,NB,C4B,yes,N,37,,119385,217,HEC
38,,DOUB,C1B,C2B,yes,N,38,,119385,217,HEC
39,,SING,C2B,C3B,yes,N,39,,119385,217,HEC
40,,SING,C2B,CMB,no,N,40,,119385,217,HEC
41,,SING,C3B,C4B,yes,N,41,,119385,217,HEC
42,,DOUB,C3B,CAB,no,E,42,,119385,217,HEC
43,,SING,CMB,HMB1,no,N,43,,119385,217,HEC
44,,SING,CMB,HMB2,no,N,44,,119385,217,HEC
45,,SING,CMB,HMB3,no,N,45,,119385,217,HEC
46,,SING,CAB,CBB,no,N,46,,119385,217,HEC
47,,SING,CAB,HAB,no,N,47,,119385,217,HEC
48,,SING,CBB,HBB1,no,N,48,,119385,217,HEC
49,,SING,CBB,HBB2,no,N,49,,119385,217,HEC
50,,SING,CBB,HBB3,no,N,50,,119385,217,HEC
51,,SING,NC,C1C,yes,N,51,,119385,217,HEC
52,,SING,NC,C4C,yes,N,52,,119385,217,HEC
53,,DOUB,C1C,C2C,yes,N,53,,119385,217,HEC
54,,SING,C2C,C3C,yes,N,54,,119385,217,HEC
55,,SING,C2C,CMC,no,N,55,,119385,217,HEC
56,,SING,C3C,C4C,yes,N,56,,119385,217,HEC
57,,DOUB,C3C,CAC,no,E,57,,119385,217,HEC
58,,SING,CMC,HMC1,no,N,58,,119385,217,HEC
59,,SING,CMC,HMC2,no,N,59,,119385,217,HEC
60,,SING,CMC,HMC3,no,N,60,,119385,217,HEC
61,,SING,CAC,CBC,no,N,61,,119385,217,HEC
62,,SING,CAC,HAC,no,N,62,,119385,217,HEC
63,,SING,CBC,HBC1,no,N,63,,119385,217,HEC
64,,SING,CBC,HBC2,no,N,64,,119385,217,HEC
65,,SING,CBC,HBC3,no,N,65,,119385,217,HEC
66,,SING,ND,C1D,yes,N,66,,119385,217,HEC
67,,SING,ND,C4D,yes,N,67,,119385,217,HEC
68,,DOUB,C1D,C2D,yes,N,68,,119385,217,HEC
69,,SING,C2D,C3D,yes,N,69,,119385,217,HEC
70,,SING,C2D,CMD,no,N,70,,119385,217,HEC
71,,DOUB,C3D,C4D,yes,N,71,,119385,217,HEC
72,,SING,C3D,CAD,no,N,72,,119385,217,HEC
73,,SING,CMD,HMD1,no,N,73,,119385,217,HEC
74,,SING,CMD,HMD2,no,N,74,,119385,217,HEC
75,,SING,CMD,HMD3,no,N,75,,119385,217,HEC
76,,SING,CAD,CBD,no,N,76,,119385,217,HEC
77,,SING,CAD,HAD1,no,N,77,,119385,217,HEC
78,,SING,CAD,HAD2,no,N,78,,119385,217,HEC
79,,SING,CBD,CGD,no,N,79,,119385,217,HEC
80,,SING,CBD,HBD1,no,N,80,,119385,217,HEC
81,,SING,CBD,HBD2,no,N,81,,119385,217,HEC
82,,DOUB,CGD,O1D,no,N,82,,119385,217,HEC
83,,SING,CGD,O2D,no,N,83,,119385,217,HEC
84,,SING,O2D,H2D,no,N,84,,119385,217,HEC
1,,SING,FE,NA,no,N,1,,119412,218,HEC
2,,SING,FE,NB,no,N,2,,119412,218,HEC
3,,SING,FE,NC,no,N,3,,119412,218,HEC
4,,SING,FE,ND,no,N,4,,119412,218,HEC
5,,DOUB,CHA,C1A,no,N,5,,119412,218,HEC
6,,SING,CHA,C4D,no,N,6,,119412,218,HEC
7,,SING,CHA,HHA,no,N,7,,119412,218,HEC
8,,DOUB,CHB,C4A,no,N,8,,119412,218,HEC
9,,SING,CHB,C1B,no,N,9,,119412,218,HEC
10,,SING,CHB,HHB,no,N,10,,119412,218,HEC
11,,DOUB,CHC,C4B,no,N,11,,119412,218,HEC
12,,SING,CHC,C1C,no,N,12,,119412,218,HEC
13,,SING,CHC,HHC,no,N,13,,119412,218,HEC
14,,DOUB,CHD,C4C,no,N,14,,119412,218,HEC
15,,SING,CHD,C1D,no,N,15,,119412,218,HEC
16,,SING,CHD,HHD,no,N,16,,119412,218,HEC
17,,SING,NA,C1A,yes,N,17,,119412,218,HEC
18,,SING,NA,C4A,yes,N,18,,119412,218,HEC
19,,SING,C1A,C2A,yes,N,19,,119412,218,HEC
20,,DOUB,C2A,C3A,yes,N,20,,119412,218,HEC
21,,SING,C2A,CAA,no,N,21,,119412,218,HEC
22,,SING,C3A,C4A,yes,N,22,,119412,218,HEC
23,,SING,C3A,CMA,no,N,23,,119412,218,HEC
24,,SING,CMA,HMA1,no,N,24,,119412,218,HEC
25,,SING,CMA,HMA2,no,N,25,,119412,218,HEC
26,,SING,CMA,HMA3,no,N,26,,119412,218,HEC
27,,SING,CAA,CBA,no,N,27,,119412,218,HEC
28,,SING,CAA,HAA1,no,N,28,,119412,218,HEC
29,,SING,CAA,HAA2,no,N,29,,119412,218,HEC
30,,SING,CBA,CGA,no,N,30,,119412,218,HEC
31,,SING,CBA,HBA1,no,N,31,,119412,218,HEC
32,,SING,CBA,HBA2,no,N,32,,119412,218,HEC
33,,DOUB,CGA,O1A,no,N,33,,119412,218,HEC
34,,SING,CGA,O2A,no,N,34,,119412,218,HEC
35,,SING,O2A,H2A,no,N,35,,119412,218,HEC
36,,SING,NB,C1B,yes,N,36,,119412,218,HEC
37,,SING,NB,C4B,yes,N,37,,119412,218,HEC
38,,DOUB,C1B,C2B,yes,N,38,,119412,218,HEC
39,,SING,C2B,C3B,yes,N,39,,119412,218,HEC
40,,SING,C2B,CMB,no,N,40,,119412,218,HEC
41,,SING,C3B,C4B,yes,N,41,,119412,218,HEC
42,,DOUB,C3B,CAB,no,E,42,,119412,218,HEC
43,,SING,CMB,HMB1,no,N,43,,119412,218,HEC
44,,SING,CMB,HMB2,no,N,44,,119412,218,HEC
45,,SING,CMB,HMB3,no,N,45,,119412,218,HEC
46,,SING,CAB,CBB,no,N,46,,119412,218,HEC
47,,SING,CAB,HAB,no,N,47,,119412,218,HEC
48,,SING,CBB,HBB1,no,N,48,,119412,218,HEC
49,,SING,CBB,HBB2,no,N,49,,119412,218,HEC
50,,SING,CBB,HBB3,no,N,50,,119412,218,HEC
51,,SING,NC,C1C,yes,N,51,,119412,218,HEC
52,,SING,NC,C4C,yes,N,52,,119412,218,HEC
53,,DOUB,C1C,C2C,yes,N,53,,119412,218,HEC
54,,SING,C2C,C3C,yes,N,54,,119412,218,HEC
55,,SING,C2C,CMC,no,N,55,,119412,218,HEC
56,,SING,C3C,C4C,yes,N,56,,119412,218,HEC
57,,DOUB,C3C,CAC,no,E,57,,119412,218,HEC
58,,SING,CMC,HMC1,no,N,58,,119412,218,HEC
59,,SING,CMC,HMC2,no,N,59,,119412,218,HEC
60,,SING,CMC,HMC3,no,N,60,,119412,218,HEC
61,,SING,CAC,CBC,no,N,61,,119412,218,HEC
62,,SING,CAC,HAC,no,N,62,,119412,218,HEC
63,,SING,CBC,HBC1,no,N,63,,119412,218,HEC
64,,SING,CBC,HBC2,no,N,64,,119412,218,HEC
65,,SING,CBC,HBC3,no,N,65,,119412,218,HEC
66,,SING,ND,C1D,yes,N,66,,119412,218,HEC
67,,SING,ND,C4D,yes,N,67,,119412,218,HEC
68,,DOUB,C1D,C2D,yes,N,68,,119412,218,HEC
69,,SING,C2D,C3D,yes,N,69,,119412,218,HEC
70,,SING,C2D,CMD,no,N,70,,119412,218,HEC
71,,DOUB,C3D,C4D,yes,N,71,,119412,218,HEC
72,,SING,C3D,CAD,no,N,72,,119412,218,HEC
73,,SING,CMD,HMD1,no,N,73,,119412,218,HEC
74,,SING,CMD,HMD2,no,N,74,,119412,218,HEC
75,,SING,CMD,HMD3,no,N,75,,119412,218,HEC
76,,SING,CAD,CBD,no,N,76,,119412,218,HEC
77,,SING,CAD,HAD1,no,N,77,,119412,218,HEC
78,,SING,CAD,HAD2,no,N,78,,119412,218,HEC
79,,SING,CBD,CGD,no,N,79,,119412,218,HEC
80,,SING,CBD,HBD1,no,N,80,,119412,218,HEC
81,,SING,CBD,HBD2,no,N,81,,119412,218,HEC
82,,DOUB,CGD,O1D,no,N,82,,119412,218,HEC
83,,SING,CGD,O2D,no,N,83,,119412,218,HEC
84,,SING,O2D,H2D,no,N,84,,119412,218,HEC
1,,SING,N,CA,no,N,1,,119413,218,M3L
2,,SING,N,H,no,N,2,,119413,218,M3L
3,,SING,N,H2,no,N,3,,119413,218,M3L
4,,SING,CA,CB,no,N,4,,119413,218,M3L
5,,SING,CA,C,no,N,5,,119413,218,M3L
6,,SING,CA,HA,no,N,6,,119413,218,M3L
7,,SING,CB,CG,no,N,7,,119413,218,M3L
8,,SING,CB,HB2,no,N,8,,119413,218,M3L
9,,SING,CB,HB3,no,N,9,,119413,218,M3L
10,,SING,CG,CD,no,N,10,,119413,218,M3L
11,,SING,CG,HG2,no,N,11,,119413,218,M3L
12,,SING,CG,HG3,no,N,12,,119413,218,M3L
13,,SING,CD,CE,no,N,13,,119413,218,M3L
14,,SING,CD,HD2,no,N,14,,119413,218,M3L
15,,SING,CD,HD3,no,N,15,,119413,218,M3L
16,,SING,CE,NZ,no,N,16,,119413,218,M3L
17,,SING,CE,HE2,no,N,17,,119413,218,M3L
18,,SING,CE,HE3,no,N,18,,119413,218,M3L
19,,SING,NZ,CM1,no,N,19,,119413,218,M3L
20,,SING,NZ,CM2,no,N,20,,119413,218,M3L
21,,SING,NZ,CM3,no,N,21,,119413,218,M3L
22,,DOUB,C,O,no,N,22,,119413,218,M3L
23,,SING,C,OXT,no,N,23,,119413,218,M3L
24,,SING,OXT,HXT,no,N,24,,119413,218,M3L
25,,SING,CM1,HM11,no,N,25,,119413,218,M3L
26,,SING,CM1,HM12,no,N,26,,119413,218,M3L
27,,SING,CM1,HM13,no,N,27,,119413,218,M3L
28,,SING,CM2,HM21,no,N,28,,119413,218,M3L
29,,SING,CM2,HM22,no,N,29,,119413,218,M3L
30,,SING,CM2,HM23,no,N,30,,119413,218,M3L
31,,SING,CM3,HM31,no,N,31,,119413,218,M3L
32,,SING,CM3,HM32,no,N,32,,119413,218,M3L
33,,SING,CM3,HM33,no,N,33,,119413,218,M3L
1,,SING,FE,NA,no,N,1,,119427,219,HEC
2,,SING,FE,NB,no,N,2,,119427,219,HEC
3,,SING,FE,NC,no,N,3,,119427,219,HEC
4,,SING,FE,ND,no,N,4,,119427,219,HEC
5,,DOUB,CHA,C1A,no,N,5,,119427,219,HEC
6,,SING,CHA,C4D,no,N,6,,119427,219,HEC
7,,SING,CHA,HHA,no,N,7,,119427,219,HEC
8,,DOUB,CHB,C4A,no,N,8,,119427,219,HEC
9,,SING,CHB,C1B,no,N,9,,119427,219,HEC
10,,SING,CHB,HHB,no,N,10,,119427,219,HEC
11,,DOUB,CHC,C4B,no,N,11,,119427,219,HEC
12,,SING,CHC,C1C,no,N,12,,119427,219,HEC
13,,SING,CHC,HHC,no,N,13,,119427,219,HEC
14,,DOUB,CHD,C4C,no,N,14,,119427,219,HEC
15,,SING,CHD,C1D,no,N,15,,119427,219,HEC
16,,SING,CHD,HHD,no,N,16,,119427,219,HEC
17,,SING,NA,C1A,yes,N,17,,119427,219,HEC
18,,SING,NA,C4A,yes,N,18,,119427,219,HEC
19,,SING,C1A,C2A,yes,N,19,,119427,219,HEC
20,,DOUB,C2A,C3A,yes,N,20,,119427,219,HEC
21,,SING,C2A,CAA,no,N,21,,119427,219,HEC
22,,SING,C3A,C4A,yes,N,22,,119427,219,HEC
23,,SING,C3A,CMA,no,N,23,,119427,219,HEC
24,,SING,CMA,HMA1,no,N,24,,119427,219,HEC
25,,SING,CMA,HMA2,no,N,25,,119427,219,HEC
26,,SING,CMA,HMA3,no,N,26,,119427,219,HEC
27,,SING,CAA,CBA,no,N,27,,119427,219,HEC
28,,SING,CAA,HAA1,no,N,28,,119427,219,HEC
29,,SING,CAA,HAA2,no,N,29,,119427,219,HEC
30,,SING,CBA,CGA,no,N,30,,119427,219,HEC
31,,SING,CBA,HBA1,no,N,31,,119427,219,HEC
32,,SING,CBA,HBA2,no,N,32,,119427,219,HEC
33,,DOUB,CGA,O1A,no,N,33,,119427,219,HEC
34,,SING,CGA,O2A,no,N,34,,119427,219,HEC
35,,SING,O2A,H2A,no,N,35,,119427,219,HEC
36,,SING,NB,C1B,yes,N,36,,119427,219,HEC
37,,SING,NB,C4B,yes,N,37,,119427,219,HEC
38,,DOUB,C1B,C2B,yes,N,38,,119427,219,HEC
39,,SING,C2B,C3B,yes,N,39,,119427,219,HEC
40,,SING,C2B,CMB,no,N,40,,119427,219,HEC
41,,SING,C3B,C4B,yes,N,41,,119427,219,HEC
42,,DOUB,C3B,CAB,no,E,42,,119427,219,HEC
43,,SING,CMB,HMB1,no,N,43,,119427,219,HEC
44,,SING,CMB,HMB2,no,N,44,,119427,219,HEC
45,,SING,CMB,HMB3,no,N,45,,119427,219,HEC
46,,SING,CAB,CBB,no,N,46,,119427,219,HEC
47,,SING,CAB,HAB,no,N,47,,119427,219,HEC
48,,SING,CBB,HBB1,no,N,48,,119427,219,HEC
49,,SING,CBB,HBB2,no,N,49,,119427,219,HEC
50,,SING,CBB,HBB3,no,N,50,,119427,219,HEC
51,,SING,NC,C1C,yes,N,51,,119427,219,HEC
52,,SING,NC,C4C,yes,N,52,,119427,219,HEC
53,,DOUB,C1C,C2C,yes,N,53,,119427,219,HEC
54,,SING,C2C,C3C,yes,N,54,,119427,219,HEC
55,,SING,C2C,CMC,no,N,55,,119427,219,HEC
56,,SING,C3C,C4C,yes,N,56,,119427,219,HEC
57,,DOUB,C3C,CAC,no,E,57,,119427,219,HEC
58,,SING,CMC,HMC1,no,N,58,,119427,219,HEC
59,,SING,CMC,HMC2,no,N,59,,119427,219,HEC
60,,SING,CMC,HMC3,no,N,60,,119427,219,HEC
61,,SING,CAC,CBC,no,N,61,,119427,219,HEC
62,,SING,CAC,HAC,no,N,62,,119427,219,HEC
63,,SING,CBC,HBC1,no,N,63,,119427,219,HEC
64,,SING,CBC,HBC2,no,N,64,,119427,219,HEC
65,,SING,CBC,HBC3,no,N,65,,119427,219,HEC
66,,SING,ND,C1D,yes,N,66,,119427,219,HEC
67,,SING,ND,C4D,yes,N,67,,119427,219,HEC
68,,DOUB,C1D,C2D,yes,N,68,,119427,219,HEC
69,,SING,C2D,C3D,yes,N,69,,119427,219,HEC
70,,SING,C2D,CMD,no,N,70,,119427,219,HEC
71,,DOUB,C3D,C4D,yes,N,71,,119427,219,HEC
72,,SING,C3D,CAD,no,N,72,,119427,219,HEC
73,,SING,CMD,HMD1,no,N,73,,119427,219,HEC
74,,SING,CMD,HMD2,no,N,74,,119427,219,HEC
75,,SING,CMD,HMD3,no,N,75,,119427,219,HEC
76,,SING,CAD,CBD,no,N,76,,119427,219,HEC
77,,SING,CAD,HAD1,no,N,77,,119427,219,HEC
78,,SING,CAD,HAD2,no,N,78,,119427,219,HEC
79,,SING,CBD,CGD,no,N,79,,119427,219,HEC
80,,SING,CBD,HBD1,no,N,80,,119427,219,HEC
81,,SING,CBD,HBD2,no,N,81,,119427,219,HEC
82,,DOUB,CGD,O1D,no,N,82,,119427,219,HEC
83,,SING,CGD,O2D,no,N,83,,119427,219,HEC
84,,SING,O2D,H2D,no,N,84,,119427,219,HEC
1,,SING,N,CA,no,N,1,,119428,219,M3L
2,,SING,N,H,no,N,2,,119428,219,M3L
3,,SING,N,H2,no,N,3,,119428,219,M3L
4,,SING,CA,CB,no,N,4,,119428,219,M3L
5,,SING,CA,C,no,N,5,,119428,219,M3L
6,,SING,CA,HA,no,N,6,,119428,219,M3L
7,,SING,CB,CG,no,N,7,,119428,219,M3L
8,,SING,CB,HB2,no,N,8,,119428,219,M3L
9,,SING,CB,HB3,no,N,9,,119428,219,M3L
10,,SING,CG,CD,no,N,10,,119428,219,M3L
11,,SING,CG,HG2,no,N,11,,119428,219,M3L
12,,SING,CG,HG3,no,N,12,,119428,219,M3L
13,,SING,CD,CE,no,N,13,,119428,219,M3L
14,,SING,CD,HD2,no,N,14,,119428,219,M3L
15,,SING,CD,HD3,no,N,15,,119428,219,M3L
16,,SING,CE,NZ,no,N,16,,119428,219,M3L
17,,SING,CE,HE2,no,N,17,,119428,219,M3L
18,,SING,CE,HE3,no,N,18,,119428,219,M3L
19,,SING,NZ,CM1,no,N,19,,119428,219,M3L
20,,SING,NZ,CM2,no,N,20,,119428,219,M3L
21,,SING,NZ,CM3,no,N,21,,119428,219,M3L
22,,DOUB,C,O,no,N,22,,119428,219,M3L
23,,SING,C,OXT,no,N,23,,119428,219,M3L
24,,SING,OXT,HXT,no,N,24,,119428,219,M3L
25,,SING,CM1,HM11,no,N,25,,119428,219,M3L
26,,SING,CM1,HM12,no,N,26,,119428,219,M3L
27,,SING,CM1,HM13,no,N,27,,119428,219,M3L
28,,SING,CM2,HM21,no,N,28,,119428,219,M3L
29,,SING,CM2,HM22,no,N,29,,119428,219,M3L
30,,SING,CM2,HM23,no,N,30,,119428,219,M3L
31,,SING,CM3,HM31,no,N,31,,119428,219,M3L
32,,SING,CM3,HM32,no,N,32,,119428,219,M3L
33,,SING,CM3,HM33,no,N,33,,119428,219,M3L
1,,DOUB,C,O,no,N,1,,119507,2199,ACE
2,,SING,C,CH3,no,N,2,,119507,2199,ACE
3,,SING,C,H,no,N,3,,119507,2199,ACE
4,,SING,CH3,H1,no,N,4,,119507,2199,ACE
5,,SING,CH3,H2,no,N,5,,119507,2199,ACE
6,,SING,CH3,H3,no,N,6,,119507,2199,ACE
1,,SING,N,CA,no,N,1,,119508,2199,NLE
2,,SING,N,H,no,N,2,,119508,2199,NLE
3,,SING,N,HN2,no,N,3,,119508,2199,NLE
4,,SING,CA,C,no,N,4,,119508,2199,NLE
5,,SING,CA,CB,no,N,5,,119508,2199,NLE
6,,SING,CA,HA,no,N,6,,119508,2199,NLE
7,,DOUB,C,O,no,N,7,,119508,2199,NLE
8,,SING,C,OXT,no,N,8,,119508,2199,NLE
9,,SING,OXT,HXT,no,N,9,,119508,2199,NLE
10,,SING,CB,CG,no,N,10,,119508,2199,NLE
11,,SING,CB,HB2,no,N,11,,119508,2199,NLE
12,,SING,CB,HB3,no,N,12,,119508,2199,NLE
13,,SING,CG,CD,no,N,13,,119508,2199,NLE
14,,SING,CG,HG2,no,N,14,,119508,2199,NLE
15,,SING,CG,HG3,no,N,15,,119508,2199,NLE
16,,SING,CD,CE,no,N,16,,119508,2199,NLE
17,,SING,CD,HD2,no,N,17,,119508,2199,NLE
18,,SING,CD,HD3,no,N,18,,119508,2199,NLE
19,,SING,CE,HE1,no,N,19,,119508,2199,NLE
20,,SING,CE,HE2,no,N,20,,119508,2199,NLE
21,,SING,CE,HE3,no,N,21,,119508,2199,NLE
1,,SING,N,HN1,no,N,1,,119509,2199,NH2
2,,SING,N,HN2,no,N,2,,119509,2199,NH2
1,,SING,C1,C2,no,N,1,,119523,220,AAC
2,,SING,C1,O1,no,N,2,,119523,220,AAC
3,,DOUB,C1,O2,no,N,3,,119523,220,AAC
4,,SING,C2,N1,no,N,4,,119523,220,AAC
5,,SING,C2,HC21,no,N,5,,119523,220,AAC
6,,SING,C2,HC22,no,N,6,,119523,220,AAC
7,,SING,C3,C4,no,N,7,,119523,220,AAC
8,,SING,C3,N1,no,N,8,,119523,220,AAC
9,,DOUB,C3,O3,no,N,9,,119523,220,AAC
10,,SING,C4,HC41,no,N,10,,119523,220,AAC
11,,SING,C4,HC42,no,N,11,,119523,220,AAC
12,,SING,C4,HC43,no,N,12,,119523,220,AAC
13,,SING,N1,HN1,no,N,13,,119523,220,AAC
14,,SING,O1,HO1,no,N,14,,119523,220,AAC
1,,SING,FE,NA,no,N,1,,119524,220,HEC
2,,SING,FE,NB,no,N,2,,119524,220,HEC
3,,SING,FE,NC,no,N,3,,119524,220,HEC
4,,SING,FE,ND,no,N,4,,119524,220,HEC
5,,DOUB,CHA,C1A,no,N,5,,119524,220,HEC
6,,SING,CHA,C4D,no,N,6,,119524,220,HEC
7,,SING,CHA,HHA,no,N,7,,119524,220,HEC
8,,DOUB,CHB,C4A,no,N,8,,119524,220,HEC
9,,SING,CHB,C1B,no,N,9,,119524,220,HEC
10,,SING,CHB,HHB,no,N,10,,119524,220,HEC
11,,DOUB,CHC,C4B,no,N,11,,119524,220,HEC
12,,SING,CHC,C1C,no,N,12,,119524,220,HEC
13,,SING,CHC,HHC,no,N,13,,119524,220,HEC
14,,DOUB,CHD,C4C,no,N,14,,119524,220,HEC
15,,SING,CHD,C1D,no,N,15,,119524,220,HEC
16,,SING,CHD,HHD,no,N,16,,119524,220,HEC
17,,SING,NA,C1A,yes,N,17,,119524,220,HEC
18,,SING,NA,C4A,yes,N,18,,119524,220,HEC
19,,SING,C1A,C2A,yes,N,19,,119524,220,HEC
20,,DOUB,C2A,C3A,yes,N,20,,119524,220,HEC
21,,SING,C2A,CAA,no,N,21,,119524,220,HEC
22,,SING,C3A,C4A,yes,N,22,,119524,220,HEC
23,,SING,C3A,CMA,no,N,23,,119524,220,HEC
24,,SING,CMA,HMA1,no,N,24,,119524,220,HEC
25,,SING,CMA,HMA2,no,N,25,,119524,220,HEC
26,,SING,CMA,HMA3,no,N,26,,119524,220,HEC
27,,SING,CAA,CBA,no,N,27,,119524,220,HEC
28,,SING,CAA,HAA1,no,N,28,,119524,220,HEC
29,,SING,CAA,HAA2,no,N,29,,119524,220,HEC
30,,SING,CBA,CGA,no,N,30,,119524,220,HEC
31,,SING,CBA,HBA1,no,N,31,,119524,220,HEC
32,,SING,CBA,HBA2,no,N,32,,119524,220,HEC
33,,DOUB,CGA,O1A,no,N,33,,119524,220,HEC
34,,SING,CGA,O2A,no,N,34,,119524,220,HEC
35,,SING,O2A,H2A,no,N,35,,119524,220,HEC
36,,SING,NB,C1B,yes,N,36,,119524,220,HEC
37,,SING,NB,C4B,yes,N,37,,119524,220,HEC
38,,DOUB,C1B,C2B,yes,N,38,,119524,220,HEC
39,,SING,C2B,C3B,yes,N,39,,119524,220,HEC
40,,SING,C2B,CMB,no,N,40,,119524,220,HEC
41,,SING,C3B,C4B,yes,N,41,,119524,220,HEC
42,,DOUB,C3B,CAB,no,E,42,,119524,220,HEC
43,,SING,CMB,HMB1,no,N,43,,119524,220,HEC
44,,SING,CMB,HMB2,no,N,44,,119524,220,HEC
45,,SING,CMB,HMB3,no,N,45,,119524,220,HEC
46,,SING,CAB,CBB,no,N,46,,119524,220,HEC
47,,SING,CAB,HAB,no,N,47,,119524,220,HEC
48,,SING,CBB,HBB1,no,N,48,,119524,220,HEC
49,,SING,CBB,HBB2,no,N,49,,119524,220,HEC
50,,SING,CBB,HBB3,no,N,50,,119524,220,HEC
51,,SING,NC,C1C,yes,N,51,,119524,220,HEC
52,,SING,NC,C4C,yes,N,52,,119524,220,HEC
53,,DOUB,C1C,C2C,yes,N,53,,119524,220,HEC
54,,SING,C2C,C3C,yes,N,54,,119524,220,HEC
55,,SING,C2C,CMC,no,N,55,,119524,220,HEC
56,,SING,C3C,C4C,yes,N,56,,119524,220,HEC
57,,DOUB,C3C,CAC,no,E,57,,119524,220,HEC
58,,SING,CMC,HMC1,no,N,58,,119524,220,HEC
59,,SING,CMC,HMC2,no,N,59,,119524,220,HEC
60,,SING,CMC,HMC3,no,N,60,,119524,220,HEC
61,,SING,CAC,CBC,no,N,61,,119524,220,HEC
62,,SING,CAC,HAC,no,N,62,,119524,220,HEC
63,,SING,CBC,HBC1,no,N,63,,119524,220,HEC
64,,SING,CBC,HBC2,no,N,64,,119524,220,HEC
65,,SING,CBC,HBC3,no,N,65,,119524,220,HEC
66,,SING,ND,C1D,yes,N,66,,119524,220,HEC
67,,SING,ND,C4D,yes,N,67,,119524,220,HEC
68,,DOUB,C1D,C2D,yes,N,68,,119524,220,HEC
69,,SING,C2D,C3D,yes,N,69,,119524,220,HEC
70,,SING,C2D,CMD,no,N,70,,119524,220,HEC
71,,DOUB,C3D,C4D,yes,N,71,,119524,220,HEC
72,,SING,C3D,CAD,no,N,72,,119524,220,HEC
73,,SING,CMD,HMD1,no,N,73,,119524,220,HEC
74,,SING,CMD,HMD2,no,N,74,,119524,220,HEC
75,,SING,CMD,HMD3,no,N,75,,119524,220,HEC
76,,SING,CAD,CBD,no,N,76,,119524,220,HEC
77,,SING,CAD,HAD1,no,N,77,,119524,220,HEC
78,,SING,CAD,HAD2,no,N,78,,119524,220,HEC
79,,SING,CBD,CGD,no,N,79,,119524,220,HEC
80,,SING,CBD,HBD1,no,N,80,,119524,220,HEC
81,,SING,CBD,HBD2,no,N,81,,119524,220,HEC
82,,DOUB,CGD,O1D,no,N,82,,119524,220,HEC
83,,SING,CGD,O2D,no,N,83,,119524,220,HEC
84,,SING,O2D,H2D,no,N,84,,119524,220,HEC
1,,DOUB,C,O,no,N,1,,119538,2200,ACE
2,,SING,C,CH3,no,N,2,,119538,2200,ACE
3,,SING,C,H,no,N,3,,119538,2200,ACE
4,,SING,CH3,H1,no,N,4,,119538,2200,ACE
5,,SING,CH3,H2,no,N,5,,119538,2200,ACE
6,,SING,CH3,H3,no,N,6,,119538,2200,ACE
1,,SING,N,CA,no,N,1,,119539,2200,NLE
2,,SING,N,H,no,N,2,,119539,2200,NLE
3,,SING,N,HN2,no,N,3,,119539,2200,NLE
4,,SING,CA,C,no,N,4,,119539,2200,NLE
5,,SING,CA,CB,no,N,5,,119539,2200,NLE
6,,SING,CA,HA,no,N,6,,119539,2200,NLE
7,,DOUB,C,O,no,N,7,,119539,2200,NLE
8,,SING,C,OXT,no,N,8,,119539,2200,NLE
9,,SING,OXT,HXT,no,N,9,,119539,2200,NLE
10,,SING,CB,CG,no,N,10,,119539,2200,NLE
11,,SING,CB,HB2,no,N,11,,119539,2200,NLE
12,,SING,CB,HB3,no,N,12,,119539,2200,NLE
13,,SING,CG,CD,no,N,13,,119539,2200,NLE
14,,SING,CG,HG2,no,N,14,,119539,2200,NLE
15,,SING,CG,HG3,no,N,15,,119539,2200,NLE
16,,SING,CD,CE,no,N,16,,119539,2200,NLE
17,,SING,CD,HD2,no,N,17,,119539,2200,NLE
18,,SING,CD,HD3,no,N,18,,119539,2200,NLE
19,,SING,CE,HE1,no,N,19,,119539,2200,NLE
20,,SING,CE,HE2,no,N,20,,119539,2200,NLE
21,,SING,CE,HE3,no,N,21,,119539,2200,NLE
1,,SING,N,HN1,no,N,1,,119540,2200,NH2
2,,SING,N,HN2,no,N,2,,119540,2200,NH2
1,,DOUB,C,O,no,N,1,,119565,2202,ACE
2,,SING,C,CH3,no,N,2,,119565,2202,ACE
3,,SING,C,H,no,N,3,,119565,2202,ACE
4,,SING,CH3,H1,no,N,4,,119565,2202,ACE
5,,SING,CH3,H2,no,N,5,,119565,2202,ACE
6,,SING,CH3,H3,no,N,6,,119565,2202,ACE
1,,SING,C1,N1,no,N,1,,119566,2202,GM1
2,,DOUB,C1,O1,no,N,2,,119566,2202,GM1
3,,SING,C1,C2,no,N,3,,119566,2202,GM1
4,,SING,N1,HN11,no,N,4,,119566,2202,GM1
5,,SING,N1,HN12,no,N,5,,119566,2202,GM1
6,,SING,C2,N2,no,N,6,,119566,2202,GM1
7,,SING,C2,H21,no,N,7,,119566,2202,GM1
8,,SING,C2,H22,no,N,8,,119566,2202,GM1
9,,SING,N2,HN21,no,N,9,,119566,2202,GM1
10,,SING,N2,HN22,no,N,10,,119566,2202,GM1
1,,DOUB,C,O,no,N,1,,119580,2203,ACE
2,,SING,C,CH3,no,N,2,,119580,2203,ACE
3,,SING,C,H,no,N,3,,119580,2203,ACE
4,,SING,CH3,H1,no,N,4,,119580,2203,ACE
5,,SING,CH3,H2,no,N,5,,119580,2203,ACE
6,,SING,CH3,H3,no,N,6,,119580,2203,ACE
1,,SING,C1,N1,no,N,1,,119581,2203,GM1
2,,DOUB,C1,O1,no,N,2,,119581,2203,GM1
3,,SING,C1,C2,no,N,3,,119581,2203,GM1
4,,SING,N1,HN11,no,N,4,,119581,2203,GM1
5,,SING,N1,HN12,no,N,5,,119581,2203,GM1
6,,SING,C2,N2,no,N,6,,119581,2203,GM1
7,,SING,C2,H21,no,N,7,,119581,2203,GM1
8,,SING,C2,H22,no,N,8,,119581,2203,GM1
9,,SING,N2,HN21,no,N,9,,119581,2203,GM1
10,,SING,N2,HN22,no,N,10,,119581,2203,GM1
1,,SING,C1,C2,no,N,1,,119673,221,AAC
2,,SING,C1,O1,no,N,2,,119673,221,AAC
3,,DOUB,C1,O2,no,N,3,,119673,221,AAC
4,,SING,C2,N1,no,N,4,,119673,221,AAC
5,,SING,C2,HC21,no,N,5,,119673,221,AAC
6,,SING,C2,HC22,no,N,6,,119673,221,AAC
7,,SING,C3,C4,no,N,7,,119673,221,AAC
8,,SING,C3,N1,no,N,8,,119673,221,AAC
9,,DOUB,C3,O3,no,N,9,,119673,221,AAC
10,,SING,C4,HC41,no,N,10,,119673,221,AAC
11,,SING,C4,HC42,no,N,11,,119673,221,AAC
12,,SING,C4,HC43,no,N,12,,119673,221,AAC
13,,SING,N1,HN1,no,N,13,,119673,221,AAC
14,,SING,O1,HO1,no,N,14,,119673,221,AAC
1,,SING,FE,NA,no,N,1,,119674,221,HEC
2,,SING,FE,NB,no,N,2,,119674,221,HEC
3,,SING,FE,NC,no,N,3,,119674,221,HEC
4,,SING,FE,ND,no,N,4,,119674,221,HEC
5,,DOUB,CHA,C1A,no,N,5,,119674,221,HEC
6,,SING,CHA,C4D,no,N,6,,119674,221,HEC
7,,SING,CHA,HHA,no,N,7,,119674,221,HEC
8,,DOUB,CHB,C4A,no,N,8,,119674,221,HEC
9,,SING,CHB,C1B,no,N,9,,119674,221,HEC
10,,SING,CHB,HHB,no,N,10,,119674,221,HEC
11,,DOUB,CHC,C4B,no,N,11,,119674,221,HEC
12,,SING,CHC,C1C,no,N,12,,119674,221,HEC
13,,SING,CHC,HHC,no,N,13,,119674,221,HEC
14,,DOUB,CHD,C4C,no,N,14,,119674,221,HEC
15,,SING,CHD,C1D,no,N,15,,119674,221,HEC
16,,SING,CHD,HHD,no,N,16,,119674,221,HEC
17,,SING,NA,C1A,yes,N,17,,119674,221,HEC
18,,SING,NA,C4A,yes,N,18,,119674,221,HEC
19,,SING,C1A,C2A,yes,N,19,,119674,221,HEC
20,,DOUB,C2A,C3A,yes,N,20,,119674,221,HEC
21,,SING,C2A,CAA,no,N,21,,119674,221,HEC
22,,SING,C3A,C4A,yes,N,22,,119674,221,HEC
23,,SING,C3A,CMA,no,N,23,,119674,221,HEC
24,,SING,CMA,HMA1,no,N,24,,119674,221,HEC
25,,SING,CMA,HMA2,no,N,25,,119674,221,HEC
26,,SING,CMA,HMA3,no,N,26,,119674,221,HEC
27,,SING,CAA,CBA,no,N,27,,119674,221,HEC
28,,SING,CAA,HAA1,no,N,28,,119674,221,HEC
29,,SING,CAA,HAA2,no,N,29,,119674,221,HEC
30,,SING,CBA,CGA,no,N,30,,119674,221,HEC
31,,SING,CBA,HBA1,no,N,31,,119674,221,HEC
32,,SING,CBA,HBA2,no,N,32,,119674,221,HEC
33,,DOUB,CGA,O1A,no,N,33,,119674,221,HEC
34,,SING,CGA,O2A,no,N,34,,119674,221,HEC
35,,SING,O2A,H2A,no,N,35,,119674,221,HEC
36,,SING,NB,C1B,yes,N,36,,119674,221,HEC
37,,SING,NB,C4B,yes,N,37,,119674,221,HEC
38,,DOUB,C1B,C2B,yes,N,38,,119674,221,HEC
39,,SING,C2B,C3B,yes,N,39,,119674,221,HEC
40,,SING,C2B,CMB,no,N,40,,119674,221,HEC
41,,SING,C3B,C4B,yes,N,41,,119674,221,HEC
42,,DOUB,C3B,CAB,no,E,42,,119674,221,HEC
43,,SING,CMB,HMB1,no,N,43,,119674,221,HEC
44,,SING,CMB,HMB2,no,N,44,,119674,221,HEC
45,,SING,CMB,HMB3,no,N,45,,119674,221,HEC
46,,SING,CAB,CBB,no,N,46,,119674,221,HEC
47,,SING,CAB,HAB,no,N,47,,119674,221,HEC
48,,SING,CBB,HBB1,no,N,48,,119674,221,HEC
49,,SING,CBB,HBB2,no,N,49,,119674,221,HEC
50,,SING,CBB,HBB3,no,N,50,,119674,221,HEC
51,,SING,NC,C1C,yes,N,51,,119674,221,HEC
52,,SING,NC,C4C,yes,N,52,,119674,221,HEC
53,,DOUB,C1C,C2C,yes,N,53,,119674,221,HEC
54,,SING,C2C,C3C,yes,N,54,,119674,221,HEC
55,,SING,C2C,CMC,no,N,55,,119674,221,HEC
56,,SING,C3C,C4C,yes,N,56,,119674,221,HEC
57,,DOUB,C3C,CAC,no,E,57,,119674,221,HEC
58,,SING,CMC,HMC1,no,N,58,,119674,221,HEC
59,,SING,CMC,HMC2,no,N,59,,119674,221,HEC
60,,SING,CMC,HMC3,no,N,60,,119674,221,HEC
61,,SING,CAC,CBC,no,N,61,,119674,221,HEC
62,,SING,CAC,HAC,no,N,62,,119674,221,HEC
63,,SING,CBC,HBC1,no,N,63,,119674,221,HEC
64,,SING,CBC,HBC2,no,N,64,,119674,221,HEC
65,,SING,CBC,HBC3,no,N,65,,119674,221,HEC
66,,SING,ND,C1D,yes,N,66,,119674,221,HEC
67,,SING,ND,C4D,yes,N,67,,119674,221,HEC
68,,DOUB,C1D,C2D,yes,N,68,,119674,221,HEC
69,,SING,C2D,C3D,yes,N,69,,119674,221,HEC
70,,SING,C2D,CMD,no,N,70,,119674,221,HEC
71,,DOUB,C3D,C4D,yes,N,71,,119674,221,HEC
72,,SING,C3D,CAD,no,N,72,,119674,221,HEC
73,,SING,CMD,HMD1,no,N,73,,119674,221,HEC
74,,SING,CMD,HMD2,no,N,74,,119674,221,HEC
75,,SING,CMD,HMD3,no,N,75,,119674,221,HEC
76,,SING,CAD,CBD,no,N,76,,119674,221,HEC
77,,SING,CAD,HAD1,no,N,77,,119674,221,HEC
78,,SING,CAD,HAD2,no,N,78,,119674,221,HEC
79,,SING,CBD,CGD,no,N,79,,119674,221,HEC
80,,SING,CBD,HBD1,no,N,80,,119674,221,HEC
81,,SING,CBD,HBD2,no,N,81,,119674,221,HEC
82,,DOUB,CGD,O1D,no,N,82,,119674,221,HEC
83,,SING,CGD,O2D,no,N,83,,119674,221,HEC
84,,SING,O2D,H2D,no,N,84,,119674,221,HEC
1,,SING,C1A,C2A,no,N,1,,119701,2218,SAC
2,,DOUB,C1A,OAC,no,N,2,,119701,2218,SAC
3,,SING,C1A,N,no,N,3,,119701,2218,SAC
4,,SING,C2A,H2A1,no,N,4,,119701,2218,SAC
5,,SING,C2A,H2A2,no,N,5,,119701,2218,SAC
6,,SING,C2A,H2A3,no,N,6,,119701,2218,SAC
7,,SING,N,CA,no,N,7,,119701,2218,SAC
8,,SING,N,H,no,N,8,,119701,2218,SAC
9,,SING,CA,C,no,N,9,,119701,2218,SAC
10,,SING,CA,CB,no,N,10,,119701,2218,SAC
11,,SING,CA,HA,no,N,11,,119701,2218,SAC
12,,DOUB,C,O,no,N,12,,119701,2218,SAC
13,,SING,C,OXT,no,N,13,,119701,2218,SAC
14,,SING,OXT,HXT,no,N,14,,119701,2218,SAC
15,,SING,CB,OG,no,N,15,,119701,2218,SAC
16,,SING,CB,HB2,no,N,16,,119701,2218,SAC
17,,SING,CB,HB3,no,N,17,,119701,2218,SAC
18,,SING,OG,HG,no,N,18,,119701,2218,SAC
1,,SING,FE,NA,no,N,1,,119728,222,HEC
2,,SING,FE,NB,no,N,2,,119728,222,HEC
3,,SING,FE,NC,no,N,3,,119728,222,HEC
4,,SING,FE,ND,no,N,4,,119728,222,HEC
5,,DOUB,CHA,C1A,no,N,5,,119728,222,HEC
6,,SING,CHA,C4D,no,N,6,,119728,222,HEC
7,,SING,CHA,HHA,no,N,7,,119728,222,HEC
8,,DOUB,CHB,C4A,no,N,8,,119728,222,HEC
9,,SING,CHB,C1B,no,N,9,,119728,222,HEC
10,,SING,CHB,HHB,no,N,10,,119728,222,HEC
11,,DOUB,CHC,C4B,no,N,11,,119728,222,HEC
12,,SING,CHC,C1C,no,N,12,,119728,222,HEC
13,,SING,CHC,HHC,no,N,13,,119728,222,HEC
14,,DOUB,CHD,C4C,no,N,14,,119728,222,HEC
15,,SING,CHD,C1D,no,N,15,,119728,222,HEC
16,,SING,CHD,HHD,no,N,16,,119728,222,HEC
17,,SING,NA,C1A,yes,N,17,,119728,222,HEC
18,,SING,NA,C4A,yes,N,18,,119728,222,HEC
19,,SING,C1A,C2A,yes,N,19,,119728,222,HEC
20,,DOUB,C2A,C3A,yes,N,20,,119728,222,HEC
21,,SING,C2A,CAA,no,N,21,,119728,222,HEC
22,,SING,C3A,C4A,yes,N,22,,119728,222,HEC
23,,SING,C3A,CMA,no,N,23,,119728,222,HEC
24,,SING,CMA,HMA1,no,N,24,,119728,222,HEC
25,,SING,CMA,HMA2,no,N,25,,119728,222,HEC
26,,SING,CMA,HMA3,no,N,26,,119728,222,HEC
27,,SING,CAA,CBA,no,N,27,,119728,222,HEC
28,,SING,CAA,HAA1,no,N,28,,119728,222,HEC
29,,SING,CAA,HAA2,no,N,29,,119728,222,HEC
30,,SING,CBA,CGA,no,N,30,,119728,222,HEC
31,,SING,CBA,HBA1,no,N,31,,119728,222,HEC
32,,SING,CBA,HBA2,no,N,32,,119728,222,HEC
33,,DOUB,CGA,O1A,no,N,33,,119728,222,HEC
34,,SING,CGA,O2A,no,N,34,,119728,222,HEC
35,,SING,O2A,H2A,no,N,35,,119728,222,HEC
36,,SING,NB,C1B,yes,N,36,,119728,222,HEC
37,,SING,NB,C4B,yes,N,37,,119728,222,HEC
38,,DOUB,C1B,C2B,yes,N,38,,119728,222,HEC
39,,SING,C2B,C3B,yes,N,39,,119728,222,HEC
40,,SING,C2B,CMB,no,N,40,,119728,222,HEC
41,,SING,C3B,C4B,yes,N,41,,119728,222,HEC
42,,DOUB,C3B,CAB,no,E,42,,119728,222,HEC
43,,SING,CMB,HMB1,no,N,43,,119728,222,HEC
44,,SING,CMB,HMB2,no,N,44,,119728,222,HEC
45,,SING,CMB,HMB3,no,N,45,,119728,222,HEC
46,,SING,CAB,CBB,no,N,46,,119728,222,HEC
47,,SING,CAB,HAB,no,N,47,,119728,222,HEC
48,,SING,CBB,HBB1,no,N,48,,119728,222,HEC
49,,SING,CBB,HBB2,no,N,49,,119728,222,HEC
50,,SING,CBB,HBB3,no,N,50,,119728,222,HEC
51,,SING,NC,C1C,yes,N,51,,119728,222,HEC
52,,SING,NC,C4C,yes,N,52,,119728,222,HEC
53,,DOUB,C1C,C2C,yes,N,53,,119728,222,HEC
54,,SING,C2C,C3C,yes,N,54,,119728,222,HEC
55,,SING,C2C,CMC,no,N,55,,119728,222,HEC
56,,SING,C3C,C4C,yes,N,56,,119728,222,HEC
57,,DOUB,C3C,CAC,no,E,57,,119728,222,HEC
58,,SING,CMC,HMC1,no,N,58,,119728,222,HEC
59,,SING,CMC,HMC2,no,N,59,,119728,222,HEC
60,,SING,CMC,HMC3,no,N,60,,119728,222,HEC
61,,SING,CAC,CBC,no,N,61,,119728,222,HEC
62,,SING,CAC,HAC,no,N,62,,119728,222,HEC
63,,SING,CBC,HBC1,no,N,63,,119728,222,HEC
64,,SING,CBC,HBC2,no,N,64,,119728,222,HEC
65,,SING,CBC,HBC3,no,N,65,,119728,222,HEC
66,,SING,ND,C1D,yes,N,66,,119728,222,HEC
67,,SING,ND,C4D,yes,N,67,,119728,222,HEC
68,,DOUB,C1D,C2D,yes,N,68,,119728,222,HEC
69,,SING,C2D,C3D,yes,N,69,,119728,222,HEC
70,,SING,C2D,CMD,no,N,70,,119728,222,HEC
71,,DOUB,C3D,C4D,yes,N,71,,119728,222,HEC
72,,SING,C3D,CAD,no,N,72,,119728,222,HEC
73,,SING,CMD,HMD1,no,N,73,,119728,222,HEC
74,,SING,CMD,HMD2,no,N,74,,119728,222,HEC
75,,SING,CMD,HMD3,no,N,75,,119728,222,HEC
76,,SING,CAD,CBD,no,N,76,,119728,222,HEC
77,,SING,CAD,HAD1,no,N,77,,119728,222,HEC
78,,SING,CAD,HAD2,no,N,78,,119728,222,HEC
79,,SING,CBD,CGD,no,N,79,,119728,222,HEC
80,,SING,CBD,HBD1,no,N,80,,119728,222,HEC
81,,SING,CBD,HBD2,no,N,81,,119728,222,HEC
82,,DOUB,CGD,O1D,no,N,82,,119728,222,HEC
83,,SING,CGD,O2D,no,N,83,,119728,222,HEC
84,,SING,O2D,H2D,no,N,84,,119728,222,HEC
1,,SING,N,CA,no,N,1,,119729,222,M3L
2,,SING,N,H,no,N,2,,119729,222,M3L
3,,SING,N,H2,no,N,3,,119729,222,M3L
4,,SING,CA,CB,no,N,4,,119729,222,M3L
5,,SING,CA,C,no,N,5,,119729,222,M3L
6,,SING,CA,HA,no,N,6,,119729,222,M3L
7,,SING,CB,CG,no,N,7,,119729,222,M3L
8,,SING,CB,HB2,no,N,8,,119729,222,M3L
9,,SING,CB,HB3,no,N,9,,119729,222,M3L
10,,SING,CG,CD,no,N,10,,119729,222,M3L
11,,SING,CG,HG2,no,N,11,,119729,222,M3L
12,,SING,CG,HG3,no,N,12,,119729,222,M3L
13,,SING,CD,CE,no,N,13,,119729,222,M3L
14,,SING,CD,HD2,no,N,14,,119729,222,M3L
15,,SING,CD,HD3,no,N,15,,119729,222,M3L
16,,SING,CE,NZ,no,N,16,,119729,222,M3L
17,,SING,CE,HE2,no,N,17,,119729,222,M3L
18,,SING,CE,HE3,no,N,18,,119729,222,M3L
19,,SING,NZ,CM1,no,N,19,,119729,222,M3L
20,,SING,NZ,CM2,no,N,20,,119729,222,M3L
21,,SING,NZ,CM3,no,N,21,,119729,222,M3L
22,,DOUB,C,O,no,N,22,,119729,222,M3L
23,,SING,C,OXT,no,N,23,,119729,222,M3L
24,,SING,OXT,HXT,no,N,24,,119729,222,M3L
25,,SING,CM1,HM11,no,N,25,,119729,222,M3L
26,,SING,CM1,HM12,no,N,26,,119729,222,M3L
27,,SING,CM1,HM13,no,N,27,,119729,222,M3L
28,,SING,CM2,HM21,no,N,28,,119729,222,M3L
29,,SING,CM2,HM22,no,N,29,,119729,222,M3L
30,,SING,CM2,HM23,no,N,30,,119729,222,M3L
31,,SING,CM3,HM31,no,N,31,,119729,222,M3L
32,,SING,CM3,HM32,no,N,32,,119729,222,M3L
33,,SING,CM3,HM33,no,N,33,,119729,222,M3L
1,,SING,N,CA,no,N,1,,119782,2223,TYC
2,,SING,N,H0,no,N,2,,119782,2223,TYC
3,,SING,N,H,no,N,3,,119782,2223,TYC
4,,SING,CA,C,no,N,4,,119782,2223,TYC
5,,SING,CA,CB,no,N,5,,119782,2223,TYC
6,,SING,CA,HA,no,N,6,,119782,2223,TYC
7,,DOUB,C,O,no,N,7,,119782,2223,TYC
8,,SING,C,NXT,no,N,8,,119782,2223,TYC
9,,SING,CB,CG,no,N,9,,119782,2223,TYC
10,,SING,CB,HB1,no,N,10,,119782,2223,TYC
11,,SING,CB,HB2,no,N,11,,119782,2223,TYC
12,,DOUB,CG,CD1,yes,N,12,,119782,2223,TYC
13,,SING,CG,CD2,yes,N,13,,119782,2223,TYC
14,,SING,CD1,CE1,yes,N,14,,119782,2223,TYC
15,,SING,CD1,HD1,no,N,15,,119782,2223,TYC
16,,DOUB,CD2,CE2,yes,N,16,,119782,2223,TYC
17,,SING,CD2,HD2,no,N,17,,119782,2223,TYC
18,,DOUB,CE1,CZ,yes,N,18,,119782,2223,TYC
19,,SING,CE1,HE1,no,N,19,,119782,2223,TYC
20,,SING,CE2,CZ,yes,N,20,,119782,2223,TYC
21,,SING,CE2,HE2,no,N,21,,119782,2223,TYC
22,,SING,OH,CZ,no,N,22,,119782,2223,TYC
23,,SING,OH,HH,no,N,23,,119782,2223,TYC
24,,SING,NXT,HT21,no,N,24,,119782,2223,TYC
25,,SING,NXT,HT22,no,N,25,,119782,2223,TYC
1,,SING,FE,NA,no,N,1,,119874,223,HEC
2,,SING,FE,NB,no,N,2,,119874,223,HEC
3,,SING,FE,NC,no,N,3,,119874,223,HEC
4,,SING,FE,ND,no,N,4,,119874,223,HEC
5,,DOUB,CHA,C1A,no,N,5,,119874,223,HEC
6,,SING,CHA,C4D,no,N,6,,119874,223,HEC
7,,SING,CHA,HHA,no,N,7,,119874,223,HEC
8,,DOUB,CHB,C4A,no,N,8,,119874,223,HEC
9,,SING,CHB,C1B,no,N,9,,119874,223,HEC
10,,SING,CHB,HHB,no,N,10,,119874,223,HEC
11,,DOUB,CHC,C4B,no,N,11,,119874,223,HEC
12,,SING,CHC,C1C,no,N,12,,119874,223,HEC
13,,SING,CHC,HHC,no,N,13,,119874,223,HEC
14,,DOUB,CHD,C4C,no,N,14,,119874,223,HEC
15,,SING,CHD,C1D,no,N,15,,119874,223,HEC
16,,SING,CHD,HHD,no,N,16,,119874,223,HEC
17,,SING,NA,C1A,yes,N,17,,119874,223,HEC
18,,SING,NA,C4A,yes,N,18,,119874,223,HEC
19,,SING,C1A,C2A,yes,N,19,,119874,223,HEC
20,,DOUB,C2A,C3A,yes,N,20,,119874,223,HEC
21,,SING,C2A,CAA,no,N,21,,119874,223,HEC
22,,SING,C3A,C4A,yes,N,22,,119874,223,HEC
23,,SING,C3A,CMA,no,N,23,,119874,223,HEC
24,,SING,CMA,HMA1,no,N,24,,119874,223,HEC
25,,SING,CMA,HMA2,no,N,25,,119874,223,HEC
26,,SING,CMA,HMA3,no,N,26,,119874,223,HEC
27,,SING,CAA,CBA,no,N,27,,119874,223,HEC
28,,SING,CAA,HAA1,no,N,28,,119874,223,HEC
29,,SING,CAA,HAA2,no,N,29,,119874,223,HEC
30,,SING,CBA,CGA,no,N,30,,119874,223,HEC
31,,SING,CBA,HBA1,no,N,31,,119874,223,HEC
32,,SING,CBA,HBA2,no,N,32,,119874,223,HEC
33,,DOUB,CGA,O1A,no,N,33,,119874,223,HEC
34,,SING,CGA,O2A,no,N,34,,119874,223,HEC
35,,SING,O2A,H2A,no,N,35,,119874,223,HEC
36,,SING,NB,C1B,yes,N,36,,119874,223,HEC
37,,SING,NB,C4B,yes,N,37,,119874,223,HEC
38,,DOUB,C1B,C2B,yes,N,38,,119874,223,HEC
39,,SING,C2B,C3B,yes,N,39,,119874,223,HEC
40,,SING,C2B,CMB,no,N,40,,119874,223,HEC
41,,SING,C3B,C4B,yes,N,41,,119874,223,HEC
42,,DOUB,C3B,CAB,no,E,42,,119874,223,HEC
43,,SING,CMB,HMB1,no,N,43,,119874,223,HEC
44,,SING,CMB,HMB2,no,N,44,,119874,223,HEC
45,,SING,CMB,HMB3,no,N,45,,119874,223,HEC
46,,SING,CAB,CBB,no,N,46,,119874,223,HEC
47,,SING,CAB,HAB,no,N,47,,119874,223,HEC
48,,SING,CBB,HBB1,no,N,48,,119874,223,HEC
49,,SING,CBB,HBB2,no,N,49,,119874,223,HEC
50,,SING,CBB,HBB3,no,N,50,,119874,223,HEC
51,,SING,NC,C1C,yes,N,51,,119874,223,HEC
52,,SING,NC,C4C,yes,N,52,,119874,223,HEC
53,,DOUB,C1C,C2C,yes,N,53,,119874,223,HEC
54,,SING,C2C,C3C,yes,N,54,,119874,223,HEC
55,,SING,C2C,CMC,no,N,55,,119874,223,HEC
56,,SING,C3C,C4C,yes,N,56,,119874,223,HEC
57,,DOUB,C3C,CAC,no,E,57,,119874,223,HEC
58,,SING,CMC,HMC1,no,N,58,,119874,223,HEC
59,,SING,CMC,HMC2,no,N,59,,119874,223,HEC
60,,SING,CMC,HMC3,no,N,60,,119874,223,HEC
61,,SING,CAC,CBC,no,N,61,,119874,223,HEC
62,,SING,CAC,HAC,no,N,62,,119874,223,HEC
63,,SING,CBC,HBC1,no,N,63,,119874,223,HEC
64,,SING,CBC,HBC2,no,N,64,,119874,223,HEC
65,,SING,CBC,HBC3,no,N,65,,119874,223,HEC
66,,SING,ND,C1D,yes,N,66,,119874,223,HEC
67,,SING,ND,C4D,yes,N,67,,119874,223,HEC
68,,DOUB,C1D,C2D,yes,N,68,,119874,223,HEC
69,,SING,C2D,C3D,yes,N,69,,119874,223,HEC
70,,SING,C2D,CMD,no,N,70,,119874,223,HEC
71,,DOUB,C3D,C4D,yes,N,71,,119874,223,HEC
72,,SING,C3D,CAD,no,N,72,,119874,223,HEC
73,,SING,CMD,HMD1,no,N,73,,119874,223,HEC
74,,SING,CMD,HMD2,no,N,74,,119874,223,HEC
75,,SING,CMD,HMD3,no,N,75,,119874,223,HEC
76,,SING,CAD,CBD,no,N,76,,119874,223,HEC
77,,SING,CAD,HAD1,no,N,77,,119874,223,HEC
78,,SING,CAD,HAD2,no,N,78,,119874,223,HEC
79,,SING,CBD,CGD,no,N,79,,119874,223,HEC
80,,SING,CBD,HBD1,no,N,80,,119874,223,HEC
81,,SING,CBD,HBD2,no,N,81,,119874,223,HEC
82,,DOUB,CGD,O1D,no,N,82,,119874,223,HEC
83,,SING,CGD,O2D,no,N,83,,119874,223,HEC
84,,SING,O2D,H2D,no,N,84,,119874,223,HEC
1,,SING,N,CA,no,N,1,,119875,223,M3L
2,,SING,N,H,no,N,2,,119875,223,M3L
3,,SING,N,H2,no,N,3,,119875,223,M3L
4,,SING,CA,CB,no,N,4,,119875,223,M3L
5,,SING,CA,C,no,N,5,,119875,223,M3L
6,,SING,CA,HA,no,N,6,,119875,223,M3L
7,,SING,CB,CG,no,N,7,,119875,223,M3L
8,,SING,CB,HB2,no,N,8,,119875,223,M3L
9,,SING,CB,HB3,no,N,9,,119875,223,M3L
10,,SING,CG,CD,no,N,10,,119875,223,M3L
11,,SING,CG,HG2,no,N,11,,119875,223,M3L
12,,SING,CG,HG3,no,N,12,,119875,223,M3L
13,,SING,CD,CE,no,N,13,,119875,223,M3L
14,,SING,CD,HD2,no,N,14,,119875,223,M3L
15,,SING,CD,HD3,no,N,15,,119875,223,M3L
16,,SING,CE,NZ,no,N,16,,119875,223,M3L
17,,SING,CE,HE2,no,N,17,,119875,223,M3L
18,,SING,CE,HE3,no,N,18,,119875,223,M3L
19,,SING,NZ,CM1,no,N,19,,119875,223,M3L
20,,SING,NZ,CM2,no,N,20,,119875,223,M3L
21,,SING,NZ,CM3,no,N,21,,119875,223,M3L
22,,DOUB,C,O,no,N,22,,119875,223,M3L
23,,SING,C,OXT,no,N,23,,119875,223,M3L
24,,SING,OXT,HXT,no,N,24,,119875,223,M3L
25,,SING,CM1,HM11,no,N,25,,119875,223,M3L
26,,SING,CM1,HM12,no,N,26,,119875,223,M3L
27,,SING,CM1,HM13,no,N,27,,119875,223,M3L
28,,SING,CM2,HM21,no,N,28,,119875,223,M3L
29,,SING,CM2,HM22,no,N,29,,119875,223,M3L
30,,SING,CM2,HM23,no,N,30,,119875,223,M3L
31,,SING,CM3,HM31,no,N,31,,119875,223,M3L
32,,SING,CM3,HM32,no,N,32,,119875,223,M3L
33,,SING,CM3,HM33,no,N,33,,119875,223,M3L
1,,SING,C1,C2,no,N,1,,119967,224,AAC
2,,SING,C1,O1,no,N,2,,119967,224,AAC
3,,DOUB,C1,O2,no,N,3,,119967,224,AAC
4,,SING,C2,N1,no,N,4,,119967,224,AAC
5,,SING,C2,HC21,no,N,5,,119967,224,AAC
6,,SING,C2,HC22,no,N,6,,119967,224,AAC
7,,SING,C3,C4,no,N,7,,119967,224,AAC
8,,SING,C3,N1,no,N,8,,119967,224,AAC
9,,DOUB,C3,O3,no,N,9,,119967,224,AAC
10,,SING,C4,HC41,no,N,10,,119967,224,AAC
11,,SING,C4,HC42,no,N,11,,119967,224,AAC
12,,SING,C4,HC43,no,N,12,,119967,224,AAC
13,,SING,N1,HN1,no,N,13,,119967,224,AAC
14,,SING,O1,HO1,no,N,14,,119967,224,AAC
1,,SING,FE,NA,no,N,1,,119968,224,HEC
2,,SING,FE,NB,no,N,2,,119968,224,HEC
3,,SING,FE,NC,no,N,3,,119968,224,HEC
4,,SING,FE,ND,no,N,4,,119968,224,HEC
5,,DOUB,CHA,C1A,no,N,5,,119968,224,HEC
6,,SING,CHA,C4D,no,N,6,,119968,224,HEC
7,,SING,CHA,HHA,no,N,7,,119968,224,HEC
8,,DOUB,CHB,C4A,no,N,8,,119968,224,HEC
9,,SING,CHB,C1B,no,N,9,,119968,224,HEC
10,,SING,CHB,HHB,no,N,10,,119968,224,HEC
11,,DOUB,CHC,C4B,no,N,11,,119968,224,HEC
12,,SING,CHC,C1C,no,N,12,,119968,224,HEC
13,,SING,CHC,HHC,no,N,13,,119968,224,HEC
14,,DOUB,CHD,C4C,no,N,14,,119968,224,HEC
15,,SING,CHD,C1D,no,N,15,,119968,224,HEC
16,,SING,CHD,HHD,no,N,16,,119968,224,HEC
17,,SING,NA,C1A,yes,N,17,,119968,224,HEC
18,,SING,NA,C4A,yes,N,18,,119968,224,HEC
19,,SING,C1A,C2A,yes,N,19,,119968,224,HEC
20,,DOUB,C2A,C3A,yes,N,20,,119968,224,HEC
21,,SING,C2A,CAA,no,N,21,,119968,224,HEC
22,,SING,C3A,C4A,yes,N,22,,119968,224,HEC
23,,SING,C3A,CMA,no,N,23,,119968,224,HEC
24,,SING,CMA,HMA1,no,N,24,,119968,224,HEC
25,,SING,CMA,HMA2,no,N,25,,119968,224,HEC
26,,SING,CMA,HMA3,no,N,26,,119968,224,HEC
27,,SING,CAA,CBA,no,N,27,,119968,224,HEC
28,,SING,CAA,HAA1,no,N,28,,119968,224,HEC
29,,SING,CAA,HAA2,no,N,29,,119968,224,HEC
30,,SING,CBA,CGA,no,N,30,,119968,224,HEC
31,,SING,CBA,HBA1,no,N,31,,119968,224,HEC
32,,SING,CBA,HBA2,no,N,32,,119968,224,HEC
33,,DOUB,CGA,O1A,no,N,33,,119968,224,HEC
34,,SING,CGA,O2A,no,N,34,,119968,224,HEC
35,,SING,O2A,H2A,no,N,35,,119968,224,HEC
36,,SING,NB,C1B,yes,N,36,,119968,224,HEC
37,,SING,NB,C4B,yes,N,37,,119968,224,HEC
38,,DOUB,C1B,C2B,yes,N,38,,119968,224,HEC
39,,SING,C2B,C3B,yes,N,39,,119968,224,HEC
40,,SING,C2B,CMB,no,N,40,,119968,224,HEC
41,,SING,C3B,C4B,yes,N,41,,119968,224,HEC
42,,DOUB,C3B,CAB,no,E,42,,119968,224,HEC
43,,SING,CMB,HMB1,no,N,43,,119968,224,HEC
44,,SING,CMB,HMB2,no,N,44,,119968,224,HEC
45,,SING,CMB,HMB3,no,N,45,,119968,224,HEC
46,,SING,CAB,CBB,no,N,46,,119968,224,HEC
47,,SING,CAB,HAB,no,N,47,,119968,224,HEC
48,,SING,CBB,HBB1,no,N,48,,119968,224,HEC
49,,SING,CBB,HBB2,no,N,49,,119968,224,HEC
50,,SING,CBB,HBB3,no,N,50,,119968,224,HEC
51,,SING,NC,C1C,yes,N,51,,119968,224,HEC
52,,SING,NC,C4C,yes,N,52,,119968,224,HEC
53,,DOUB,C1C,C2C,yes,N,53,,119968,224,HEC
54,,SING,C2C,C3C,yes,N,54,,119968,224,HEC
55,,SING,C2C,CMC,no,N,55,,119968,224,HEC
56,,SING,C3C,C4C,yes,N,56,,119968,224,HEC
57,,DOUB,C3C,CAC,no,E,57,,119968,224,HEC
58,,SING,CMC,HMC1,no,N,58,,119968,224,HEC
59,,SING,CMC,HMC2,no,N,59,,119968,224,HEC
60,,SING,CMC,HMC3,no,N,60,,119968,224,HEC
61,,SING,CAC,CBC,no,N,61,,119968,224,HEC
62,,SING,CAC,HAC,no,N,62,,119968,224,HEC
63,,SING,CBC,HBC1,no,N,63,,119968,224,HEC
64,,SING,CBC,HBC2,no,N,64,,119968,224,HEC
65,,SING,CBC,HBC3,no,N,65,,119968,224,HEC
66,,SING,ND,C1D,yes,N,66,,119968,224,HEC
67,,SING,ND,C4D,yes,N,67,,119968,224,HEC
68,,DOUB,C1D,C2D,yes,N,68,,119968,224,HEC
69,,SING,C2D,C3D,yes,N,69,,119968,224,HEC
70,,SING,C2D,CMD,no,N,70,,119968,224,HEC
71,,DOUB,C3D,C4D,yes,N,71,,119968,224,HEC
72,,SING,C3D,CAD,no,N,72,,119968,224,HEC
73,,SING,CMD,HMD1,no,N,73,,119968,224,HEC
74,,SING,CMD,HMD2,no,N,74,,119968,224,HEC
75,,SING,CMD,HMD3,no,N,75,,119968,224,HEC
76,,SING,CAD,CBD,no,N,76,,119968,224,HEC
77,,SING,CAD,HAD1,no,N,77,,119968,224,HEC
78,,SING,CAD,HAD2,no,N,78,,119968,224,HEC
79,,SING,CBD,CGD,no,N,79,,119968,224,HEC
80,,SING,CBD,HBD1,no,N,80,,119968,224,HEC
81,,SING,CBD,HBD2,no,N,81,,119968,224,HEC
82,,DOUB,CGD,O1D,no,N,82,,119968,224,HEC
83,,SING,CGD,O2D,no,N,83,,119968,224,HEC
84,,SING,O2D,H2D,no,N,84,,119968,224,HEC
1,,SING,C1,C2,no,N,1,,120008,225,AAC
2,,SING,C1,O1,no,N,2,,120008,225,AAC
3,,DOUB,C1,O2,no,N,3,,120008,225,AAC
4,,SING,C2,N1,no,N,4,,120008,225,AAC
5,,SING,C2,HC21,no,N,5,,120008,225,AAC
6,,SING,C2,HC22,no,N,6,,120008,225,AAC
7,,SING,C3,C4,no,N,7,,120008,225,AAC
8,,SING,C3,N1,no,N,8,,120008,225,AAC
9,,DOUB,C3,O3,no,N,9,,120008,225,AAC
10,,SING,C4,HC41,no,N,10,,120008,225,AAC
11,,SING,C4,HC42,no,N,11,,120008,225,AAC
12,,SING,C4,HC43,no,N,12,,120008,225,AAC
13,,SING,N1,HN1,no,N,13,,120008,225,AAC
14,,SING,O1,HO1,no,N,14,,120008,225,AAC
1,,SING,FE,NA,no,N,1,,120009,225,HEC
2,,SING,FE,NB,no,N,2,,120009,225,HEC
3,,SING,FE,NC,no,N,3,,120009,225,HEC
4,,SING,FE,ND,no,N,4,,120009,225,HEC
5,,DOUB,CHA,C1A,no,N,5,,120009,225,HEC
6,,SING,CHA,C4D,no,N,6,,120009,225,HEC
7,,SING,CHA,HHA,no,N,7,,120009,225,HEC
8,,DOUB,CHB,C4A,no,N,8,,120009,225,HEC
9,,SING,CHB,C1B,no,N,9,,120009,225,HEC
10,,SING,CHB,HHB,no,N,10,,120009,225,HEC
11,,DOUB,CHC,C4B,no,N,11,,120009,225,HEC
12,,SING,CHC,C1C,no,N,12,,120009,225,HEC
13,,SING,CHC,HHC,no,N,13,,120009,225,HEC
14,,DOUB,CHD,C4C,no,N,14,,120009,225,HEC
15,,SING,CHD,C1D,no,N,15,,120009,225,HEC
16,,SING,CHD,HHD,no,N,16,,120009,225,HEC
17,,SING,NA,C1A,yes,N,17,,120009,225,HEC
18,,SING,NA,C4A,yes,N,18,,120009,225,HEC
19,,SING,C1A,C2A,yes,N,19,,120009,225,HEC
20,,DOUB,C2A,C3A,yes,N,20,,120009,225,HEC
21,,SING,C2A,CAA,no,N,21,,120009,225,HEC
22,,SING,C3A,C4A,yes,N,22,,120009,225,HEC
23,,SING,C3A,CMA,no,N,23,,120009,225,HEC
24,,SING,CMA,HMA1,no,N,24,,120009,225,HEC
25,,SING,CMA,HMA2,no,N,25,,120009,225,HEC
26,,SING,CMA,HMA3,no,N,26,,120009,225,HEC
27,,SING,CAA,CBA,no,N,27,,120009,225,HEC
28,,SING,CAA,HAA1,no,N,28,,120009,225,HEC
29,,SING,CAA,HAA2,no,N,29,,120009,225,HEC
30,,SING,CBA,CGA,no,N,30,,120009,225,HEC
31,,SING,CBA,HBA1,no,N,31,,120009,225,HEC
32,,SING,CBA,HBA2,no,N,32,,120009,225,HEC
33,,DOUB,CGA,O1A,no,N,33,,120009,225,HEC
34,,SING,CGA,O2A,no,N,34,,120009,225,HEC
35,,SING,O2A,H2A,no,N,35,,120009,225,HEC
36,,SING,NB,C1B,yes,N,36,,120009,225,HEC
37,,SING,NB,C4B,yes,N,37,,120009,225,HEC
38,,DOUB,C1B,C2B,yes,N,38,,120009,225,HEC
39,,SING,C2B,C3B,yes,N,39,,120009,225,HEC
40,,SING,C2B,CMB,no,N,40,,120009,225,HEC
41,,SING,C3B,C4B,yes,N,41,,120009,225,HEC
42,,DOUB,C3B,CAB,no,E,42,,120009,225,HEC
43,,SING,CMB,HMB1,no,N,43,,120009,225,HEC
44,,SING,CMB,HMB2,no,N,44,,120009,225,HEC
45,,SING,CMB,HMB3,no,N,45,,120009,225,HEC
46,,SING,CAB,CBB,no,N,46,,120009,225,HEC
47,,SING,CAB,HAB,no,N,47,,120009,225,HEC
48,,SING,CBB,HBB1,no,N,48,,120009,225,HEC
49,,SING,CBB,HBB2,no,N,49,,120009,225,HEC
50,,SING,CBB,HBB3,no,N,50,,120009,225,HEC
51,,SING,NC,C1C,yes,N,51,,120009,225,HEC
52,,SING,NC,C4C,yes,N,52,,120009,225,HEC
53,,DOUB,C1C,C2C,yes,N,53,,120009,225,HEC
54,,SING,C2C,C3C,yes,N,54,,120009,225,HEC
55,,SING,C2C,CMC,no,N,55,,120009,225,HEC
56,,SING,C3C,C4C,yes,N,56,,120009,225,HEC
57,,DOUB,C3C,CAC,no,E,57,,120009,225,HEC
58,,SING,CMC,HMC1,no,N,58,,120009,225,HEC
59,,SING,CMC,HMC2,no,N,59,,120009,225,HEC
60,,SING,CMC,HMC3,no,N,60,,120009,225,HEC
61,,SING,CAC,CBC,no,N,61,,120009,225,HEC
62,,SING,CAC,HAC,no,N,62,,120009,225,HEC
63,,SING,CBC,HBC1,no,N,63,,120009,225,HEC
64,,SING,CBC,HBC2,no,N,64,,120009,225,HEC
65,,SING,CBC,HBC3,no,N,65,,120009,225,HEC
66,,SING,ND,C1D,yes,N,66,,120009,225,HEC
67,,SING,ND,C4D,yes,N,67,,120009,225,HEC
68,,DOUB,C1D,C2D,yes,N,68,,120009,225,HEC
69,,SING,C2D,C3D,yes,N,69,,120009,225,HEC
70,,SING,C2D,CMD,no,N,70,,120009,225,HEC
71,,DOUB,C3D,C4D,yes,N,71,,120009,225,HEC
72,,SING,C3D,CAD,no,N,72,,120009,225,HEC
73,,SING,CMD,HMD1,no,N,73,,120009,225,HEC
74,,SING,CMD,HMD2,no,N,74,,120009,225,HEC
75,,SING,CMD,HMD3,no,N,75,,120009,225,HEC
76,,SING,CAD,CBD,no,N,76,,120009,225,HEC
77,,SING,CAD,HAD1,no,N,77,,120009,225,HEC
78,,SING,CAD,HAD2,no,N,78,,120009,225,HEC
79,,SING,CBD,CGD,no,N,79,,120009,225,HEC
80,,SING,CBD,HBD1,no,N,80,,120009,225,HEC
81,,SING,CBD,HBD2,no,N,81,,120009,225,HEC
82,,DOUB,CGD,O1D,no,N,82,,120009,225,HEC
83,,SING,CGD,O2D,no,N,83,,120009,225,HEC
84,,SING,O2D,H2D,no,N,84,,120009,225,HEC
1,,SING,FE,NA,no,N,1,,120023,226,HEC
2,,SING,FE,NB,no,N,2,,120023,226,HEC
3,,SING,FE,NC,no,N,3,,120023,226,HEC
4,,SING,FE,ND,no,N,4,,120023,226,HEC
5,,DOUB,CHA,C1A,no,N,5,,120023,226,HEC
6,,SING,CHA,C4D,no,N,6,,120023,226,HEC
7,,SING,CHA,HHA,no,N,7,,120023,226,HEC
8,,DOUB,CHB,C4A,no,N,8,,120023,226,HEC
9,,SING,CHB,C1B,no,N,9,,120023,226,HEC
10,,SING,CHB,HHB,no,N,10,,120023,226,HEC
11,,DOUB,CHC,C4B,no,N,11,,120023,226,HEC
12,,SING,CHC,C1C,no,N,12,,120023,226,HEC
13,,SING,CHC,HHC,no,N,13,,120023,226,HEC
14,,DOUB,CHD,C4C,no,N,14,,120023,226,HEC
15,,SING,CHD,C1D,no,N,15,,120023,226,HEC
16,,SING,CHD,HHD,no,N,16,,120023,226,HEC
17,,SING,NA,C1A,yes,N,17,,120023,226,HEC
18,,SING,NA,C4A,yes,N,18,,120023,226,HEC
19,,SING,C1A,C2A,yes,N,19,,120023,226,HEC
20,,DOUB,C2A,C3A,yes,N,20,,120023,226,HEC
21,,SING,C2A,CAA,no,N,21,,120023,226,HEC
22,,SING,C3A,C4A,yes,N,22,,120023,226,HEC
23,,SING,C3A,CMA,no,N,23,,120023,226,HEC
24,,SING,CMA,HMA1,no,N,24,,120023,226,HEC
25,,SING,CMA,HMA2,no,N,25,,120023,226,HEC
26,,SING,CMA,HMA3,no,N,26,,120023,226,HEC
27,,SING,CAA,CBA,no,N,27,,120023,226,HEC
28,,SING,CAA,HAA1,no,N,28,,120023,226,HEC
29,,SING,CAA,HAA2,no,N,29,,120023,226,HEC
30,,SING,CBA,CGA,no,N,30,,120023,226,HEC
31,,SING,CBA,HBA1,no,N,31,,120023,226,HEC
32,,SING,CBA,HBA2,no,N,32,,120023,226,HEC
33,,DOUB,CGA,O1A,no,N,33,,120023,226,HEC
34,,SING,CGA,O2A,no,N,34,,120023,226,HEC
35,,SING,O2A,H2A,no,N,35,,120023,226,HEC
36,,SING,NB,C1B,yes,N,36,,120023,226,HEC
37,,SING,NB,C4B,yes,N,37,,120023,226,HEC
38,,DOUB,C1B,C2B,yes,N,38,,120023,226,HEC
39,,SING,C2B,C3B,yes,N,39,,120023,226,HEC
40,,SING,C2B,CMB,no,N,40,,120023,226,HEC
41,,SING,C3B,C4B,yes,N,41,,120023,226,HEC
42,,DOUB,C3B,CAB,no,E,42,,120023,226,HEC
43,,SING,CMB,HMB1,no,N,43,,120023,226,HEC
44,,SING,CMB,HMB2,no,N,44,,120023,226,HEC
45,,SING,CMB,HMB3,no,N,45,,120023,226,HEC
46,,SING,CAB,CBB,no,N,46,,120023,226,HEC
47,,SING,CAB,HAB,no,N,47,,120023,226,HEC
48,,SING,CBB,HBB1,no,N,48,,120023,226,HEC
49,,SING,CBB,HBB2,no,N,49,,120023,226,HEC
50,,SING,CBB,HBB3,no,N,50,,120023,226,HEC
51,,SING,NC,C1C,yes,N,51,,120023,226,HEC
52,,SING,NC,C4C,yes,N,52,,120023,226,HEC
53,,DOUB,C1C,C2C,yes,N,53,,120023,226,HEC
54,,SING,C2C,C3C,yes,N,54,,120023,226,HEC
55,,SING,C2C,CMC,no,N,55,,120023,226,HEC
56,,SING,C3C,C4C,yes,N,56,,120023,226,HEC
57,,DOUB,C3C,CAC,no,E,57,,120023,226,HEC
58,,SING,CMC,HMC1,no,N,58,,120023,226,HEC
59,,SING,CMC,HMC2,no,N,59,,120023,226,HEC
60,,SING,CMC,HMC3,no,N,60,,120023,226,HEC
61,,SING,CAC,CBC,no,N,61,,120023,226,HEC
62,,SING,CAC,HAC,no,N,62,,120023,226,HEC
63,,SING,CBC,HBC1,no,N,63,,120023,226,HEC
64,,SING,CBC,HBC2,no,N,64,,120023,226,HEC
65,,SING,CBC,HBC3,no,N,65,,120023,226,HEC
66,,SING,ND,C1D,yes,N,66,,120023,226,HEC
67,,SING,ND,C4D,yes,N,67,,120023,226,HEC
68,,DOUB,C1D,C2D,yes,N,68,,120023,226,HEC
69,,SING,C2D,C3D,yes,N,69,,120023,226,HEC
70,,SING,C2D,CMD,no,N,70,,120023,226,HEC
71,,DOUB,C3D,C4D,yes,N,71,,120023,226,HEC
72,,SING,C3D,CAD,no,N,72,,120023,226,HEC
73,,SING,CMD,HMD1,no,N,73,,120023,226,HEC
74,,SING,CMD,HMD2,no,N,74,,120023,226,HEC
75,,SING,CMD,HMD3,no,N,75,,120023,226,HEC
76,,SING,CAD,CBD,no,N,76,,120023,226,HEC
77,,SING,CAD,HAD1,no,N,77,,120023,226,HEC
78,,SING,CAD,HAD2,no,N,78,,120023,226,HEC
79,,SING,CBD,CGD,no,N,79,,120023,226,HEC
80,,SING,CBD,HBD1,no,N,80,,120023,226,HEC
81,,SING,CBD,HBD2,no,N,81,,120023,226,HEC
82,,DOUB,CGD,O1D,no,N,82,,120023,226,HEC
83,,SING,CGD,O2D,no,N,83,,120023,226,HEC
84,,SING,O2D,H2D,no,N,84,,120023,226,HEC
1,,SING,N,CA,no,N,1,,120024,226,M3L
2,,SING,N,H,no,N,2,,120024,226,M3L
3,,SING,N,H2,no,N,3,,120024,226,M3L
4,,SING,CA,CB,no,N,4,,120024,226,M3L
5,,SING,CA,C,no,N,5,,120024,226,M3L
6,,SING,CA,HA,no,N,6,,120024,226,M3L
7,,SING,CB,CG,no,N,7,,120024,226,M3L
8,,SING,CB,HB2,no,N,8,,120024,226,M3L
9,,SING,CB,HB3,no,N,9,,120024,226,M3L
10,,SING,CG,CD,no,N,10,,120024,226,M3L
11,,SING,CG,HG2,no,N,11,,120024,226,M3L
12,,SING,CG,HG3,no,N,12,,120024,226,M3L
13,,SING,CD,CE,no,N,13,,120024,226,M3L
14,,SING,CD,HD2,no,N,14,,120024,226,M3L
15,,SING,CD,HD3,no,N,15,,120024,226,M3L
16,,SING,CE,NZ,no,N,16,,120024,226,M3L
17,,SING,CE,HE2,no,N,17,,120024,226,M3L
18,,SING,CE,HE3,no,N,18,,120024,226,M3L
19,,SING,NZ,CM1,no,N,19,,120024,226,M3L
20,,SING,NZ,CM2,no,N,20,,120024,226,M3L
21,,SING,NZ,CM3,no,N,21,,120024,226,M3L
22,,DOUB,C,O,no,N,22,,120024,226,M3L
23,,SING,C,OXT,no,N,23,,120024,226,M3L
24,,SING,OXT,HXT,no,N,24,,120024,226,M3L
25,,SING,CM1,HM11,no,N,25,,120024,226,M3L
26,,SING,CM1,HM12,no,N,26,,120024,226,M3L
27,,SING,CM1,HM13,no,N,27,,120024,226,M3L
28,,SING,CM2,HM21,no,N,28,,120024,226,M3L
29,,SING,CM2,HM22,no,N,29,,120024,226,M3L
30,,SING,CM2,HM23,no,N,30,,120024,226,M3L
31,,SING,CM3,HM31,no,N,31,,120024,226,M3L
32,,SING,CM3,HM32,no,N,32,,120024,226,M3L
33,,SING,CM3,HM33,no,N,33,,120024,226,M3L
1,,SING,N,HN1,no,N,1,,120088,2266,NH2
2,,SING,N,HN2,no,N,2,,120088,2266,NH2
1,,SING,N,HN1,no,N,1,,120100,2267,NH2
2,,SING,N,HN2,no,N,2,,120100,2267,NH2
1,,SING,N,HN1,no,N,1,,120114,2268,NH2
2,,SING,N,HN2,no,N,2,,120114,2268,NH2
1,,SING,N,HN1,no,N,1,,120128,2269,NH2
2,,SING,N,HN2,no,N,2,,120128,2269,NH2
1,,SING,FE,NA,no,N,1,,120142,227,HEC
2,,SING,FE,NB,no,N,2,,120142,227,HEC
3,,SING,FE,NC,no,N,3,,120142,227,HEC
4,,SING,FE,ND,no,N,4,,120142,227,HEC
5,,DOUB,CHA,C1A,no,N,5,,120142,227,HEC
6,,SING,CHA,C4D,no,N,6,,120142,227,HEC
7,,SING,CHA,HHA,no,N,7,,120142,227,HEC
8,,DOUB,CHB,C4A,no,N,8,,120142,227,HEC
9,,SING,CHB,C1B,no,N,9,,120142,227,HEC
10,,SING,CHB,HHB,no,N,10,,120142,227,HEC
11,,DOUB,CHC,C4B,no,N,11,,120142,227,HEC
12,,SING,CHC,C1C,no,N,12,,120142,227,HEC
13,,SING,CHC,HHC,no,N,13,,120142,227,HEC
14,,DOUB,CHD,C4C,no,N,14,,120142,227,HEC
15,,SING,CHD,C1D,no,N,15,,120142,227,HEC
16,,SING,CHD,HHD,no,N,16,,120142,227,HEC
17,,SING,NA,C1A,yes,N,17,,120142,227,HEC
18,,SING,NA,C4A,yes,N,18,,120142,227,HEC
19,,SING,C1A,C2A,yes,N,19,,120142,227,HEC
20,,DOUB,C2A,C3A,yes,N,20,,120142,227,HEC
21,,SING,C2A,CAA,no,N,21,,120142,227,HEC
22,,SING,C3A,C4A,yes,N,22,,120142,227,HEC
23,,SING,C3A,CMA,no,N,23,,120142,227,HEC
24,,SING,CMA,HMA1,no,N,24,,120142,227,HEC
25,,SING,CMA,HMA2,no,N,25,,120142,227,HEC
26,,SING,CMA,HMA3,no,N,26,,120142,227,HEC
27,,SING,CAA,CBA,no,N,27,,120142,227,HEC
28,,SING,CAA,HAA1,no,N,28,,120142,227,HEC
29,,SING,CAA,HAA2,no,N,29,,120142,227,HEC
30,,SING,CBA,CGA,no,N,30,,120142,227,HEC
31,,SING,CBA,HBA1,no,N,31,,120142,227,HEC
32,,SING,CBA,HBA2,no,N,32,,120142,227,HEC
33,,DOUB,CGA,O1A,no,N,33,,120142,227,HEC
34,,SING,CGA,O2A,no,N,34,,120142,227,HEC
35,,SING,O2A,H2A,no,N,35,,120142,227,HEC
36,,SING,NB,C1B,yes,N,36,,120142,227,HEC
37,,SING,NB,C4B,yes,N,37,,120142,227,HEC
38,,DOUB,C1B,C2B,yes,N,38,,120142,227,HEC
39,,SING,C2B,C3B,yes,N,39,,120142,227,HEC
40,,SING,C2B,CMB,no,N,40,,120142,227,HEC
41,,SING,C3B,C4B,yes,N,41,,120142,227,HEC
42,,DOUB,C3B,CAB,no,E,42,,120142,227,HEC
43,,SING,CMB,HMB1,no,N,43,,120142,227,HEC
44,,SING,CMB,HMB2,no,N,44,,120142,227,HEC
45,,SING,CMB,HMB3,no,N,45,,120142,227,HEC
46,,SING,CAB,CBB,no,N,46,,120142,227,HEC
47,,SING,CAB,HAB,no,N,47,,120142,227,HEC
48,,SING,CBB,HBB1,no,N,48,,120142,227,HEC
49,,SING,CBB,HBB2,no,N,49,,120142,227,HEC
50,,SING,CBB,HBB3,no,N,50,,120142,227,HEC
51,,SING,NC,C1C,yes,N,51,,120142,227,HEC
52,,SING,NC,C4C,yes,N,52,,120142,227,HEC
53,,DOUB,C1C,C2C,yes,N,53,,120142,227,HEC
54,,SING,C2C,C3C,yes,N,54,,120142,227,HEC
55,,SING,C2C,CMC,no,N,55,,120142,227,HEC
56,,SING,C3C,C4C,yes,N,56,,120142,227,HEC
57,,DOUB,C3C,CAC,no,E,57,,120142,227,HEC
58,,SING,CMC,HMC1,no,N,58,,120142,227,HEC
59,,SING,CMC,HMC2,no,N,59,,120142,227,HEC
60,,SING,CMC,HMC3,no,N,60,,120142,227,HEC
61,,SING,CAC,CBC,no,N,61,,120142,227,HEC
62,,SING,CAC,HAC,no,N,62,,120142,227,HEC
63,,SING,CBC,HBC1,no,N,63,,120142,227,HEC
64,,SING,CBC,HBC2,no,N,64,,120142,227,HEC
65,,SING,CBC,HBC3,no,N,65,,120142,227,HEC
66,,SING,ND,C1D,yes,N,66,,120142,227,HEC
67,,SING,ND,C4D,yes,N,67,,120142,227,HEC
68,,DOUB,C1D,C2D,yes,N,68,,120142,227,HEC
69,,SING,C2D,C3D,yes,N,69,,120142,227,HEC
70,,SING,C2D,CMD,no,N,70,,120142,227,HEC
71,,DOUB,C3D,C4D,yes,N,71,,120142,227,HEC
72,,SING,C3D,CAD,no,N,72,,120142,227,HEC
73,,SING,CMD,HMD1,no,N,73,,120142,227,HEC
74,,SING,CMD,HMD2,no,N,74,,120142,227,HEC
75,,SING,CMD,HMD3,no,N,75,,120142,227,HEC
76,,SING,CAD,CBD,no,N,76,,120142,227,HEC
77,,SING,CAD,HAD1,no,N,77,,120142,227,HEC
78,,SING,CAD,HAD2,no,N,78,,120142,227,HEC
79,,SING,CBD,CGD,no,N,79,,120142,227,HEC
80,,SING,CBD,HBD1,no,N,80,,120142,227,HEC
81,,SING,CBD,HBD2,no,N,81,,120142,227,HEC
82,,DOUB,CGD,O1D,no,N,82,,120142,227,HEC
83,,SING,CGD,O2D,no,N,83,,120142,227,HEC
84,,SING,O2D,H2D,no,N,84,,120142,227,HEC
1,,SING,N,CA,no,N,1,,120143,227,M3L
2,,SING,N,H,no,N,2,,120143,227,M3L
3,,SING,N,H2,no,N,3,,120143,227,M3L
4,,SING,CA,CB,no,N,4,,120143,227,M3L
5,,SING,CA,C,no,N,5,,120143,227,M3L
6,,SING,CA,HA,no,N,6,,120143,227,M3L
7,,SING,CB,CG,no,N,7,,120143,227,M3L
8,,SING,CB,HB2,no,N,8,,120143,227,M3L
9,,SING,CB,HB3,no,N,9,,120143,227,M3L
10,,SING,CG,CD,no,N,10,,120143,227,M3L
11,,SING,CG,HG2,no,N,11,,120143,227,M3L
12,,SING,CG,HG3,no,N,12,,120143,227,M3L
13,,SING,CD,CE,no,N,13,,120143,227,M3L
14,,SING,CD,HD2,no,N,14,,120143,227,M3L
15,,SING,CD,HD3,no,N,15,,120143,227,M3L
16,,SING,CE,NZ,no,N,16,,120143,227,M3L
17,,SING,CE,HE2,no,N,17,,120143,227,M3L
18,,SING,CE,HE3,no,N,18,,120143,227,M3L
19,,SING,NZ,CM1,no,N,19,,120143,227,M3L
20,,SING,NZ,CM2,no,N,20,,120143,227,M3L
21,,SING,NZ,CM3,no,N,21,,120143,227,M3L
22,,DOUB,C,O,no,N,22,,120143,227,M3L
23,,SING,C,OXT,no,N,23,,120143,227,M3L
24,,SING,OXT,HXT,no,N,24,,120143,227,M3L
25,,SING,CM1,HM11,no,N,25,,120143,227,M3L
26,,SING,CM1,HM12,no,N,26,,120143,227,M3L
27,,SING,CM1,HM13,no,N,27,,120143,227,M3L
28,,SING,CM2,HM21,no,N,28,,120143,227,M3L
29,,SING,CM2,HM22,no,N,29,,120143,227,M3L
30,,SING,CM2,HM23,no,N,30,,120143,227,M3L
31,,SING,CM3,HM31,no,N,31,,120143,227,M3L
32,,SING,CM3,HM32,no,N,32,,120143,227,M3L
33,,SING,CM3,HM33,no,N,33,,120143,227,M3L
1,,SING,N,HN1,no,N,1,,120157,2270,NH2
2,,SING,N,HN2,no,N,2,,120157,2270,NH2
1,,SING,N,HN1,no,N,1,,120171,2271,NH2
2,,SING,N,HN2,no,N,2,,120171,2271,NH2
1,,SING,N,CA,no,N,1,,120185,2272,SET
2,,SING,N,H,no,N,2,,120185,2272,SET
3,,SING,N,H2,no,N,3,,120185,2272,SET
4,,SING,CA,CB,no,N,4,,120185,2272,SET
5,,SING,CA,C,no,N,5,,120185,2272,SET
6,,SING,CA,HA,no,N,6,,120185,2272,SET
7,,SING,CB,OG,no,N,7,,120185,2272,SET
8,,SING,CB,HB2,no,N,8,,120185,2272,SET
9,,SING,CB,HB3,no,N,9,,120185,2272,SET
10,,SING,OG,HG,no,N,10,,120185,2272,SET
11,,SING,NT,C,no,N,11,,120185,2272,SET
12,,SING,NT,HNT1,no,N,12,,120185,2272,SET
13,,SING,NT,HNT2,no,N,13,,120185,2272,SET
14,,DOUB,C,O,no,N,14,,120185,2272,SET
1,,SING,N,CA,no,N,1,,120223,2276,PCA
2,,SING,N,CD,no,N,2,,120223,2276,PCA
3,,SING,N,H,no,N,3,,120223,2276,PCA
4,,SING,CA,CB,no,N,4,,120223,2276,PCA
5,,SING,CA,C,no,N,5,,120223,2276,PCA
6,,SING,CA,HA,no,N,6,,120223,2276,PCA
7,,SING,CB,CG,no,N,7,,120223,2276,PCA
8,,SING,CB,HB2,no,N,8,,120223,2276,PCA
9,,SING,CB,HB3,no,N,9,,120223,2276,PCA
10,,SING,CG,CD,no,N,10,,120223,2276,PCA
11,,SING,CG,HG2,no,N,11,,120223,2276,PCA
12,,SING,CG,HG3,no,N,12,,120223,2276,PCA
13,,DOUB,CD,OE,no,N,13,,120223,2276,PCA
14,,DOUB,C,O,no,N,14,,120223,2276,PCA
15,,SING,C,OXT,no,N,15,,120223,2276,PCA
16,,SING,OXT,HXT,no,N,16,,120223,2276,PCA
1,,SING,N,CA,no,N,1,,120224,2276,DPN
2,,SING,N,H,no,N,2,,120224,2276,DPN
3,,SING,N,H2,no,N,3,,120224,2276,DPN
4,,SING,CA,C,no,N,4,,120224,2276,DPN
5,,SING,CA,CB,no,N,5,,120224,2276,DPN
6,,SING,CA,HA,no,N,6,,120224,2276,DPN
7,,DOUB,C,O,no,N,7,,120224,2276,DPN
8,,SING,C,OXT,no,N,8,,120224,2276,DPN
9,,SING,OXT,HXT,no,N,9,,120224,2276,DPN
10,,SING,CB,CG,no,N,10,,120224,2276,DPN
11,,SING,CB,HB2,no,N,11,,120224,2276,DPN
12,,SING,CB,HB3,no,N,12,,120224,2276,DPN
13,,DOUB,CG,CD1,yes,N,13,,120224,2276,DPN
14,,SING,CG,CD2,yes,N,14,,120224,2276,DPN
15,,SING,CD1,CE1,yes,N,15,,120224,2276,DPN
16,,SING,CD1,HD1,no,N,16,,120224,2276,DPN
17,,DOUB,CD2,CE2,yes,N,17,,120224,2276,DPN
18,,SING,CD2,HD2,no,N,18,,120224,2276,DPN
19,,DOUB,CE1,CZ,yes,N,19,,120224,2276,DPN
20,,SING,CE1,HE1,no,N,20,,120224,2276,DPN
21,,SING,CE2,CZ,yes,N,21,,120224,2276,DPN
22,,SING,CE2,HE2,no,N,22,,120224,2276,DPN
23,,SING,CZ,HZ,no,N,23,,120224,2276,DPN
1,,SING,CD1,CG,no,N,1,,120225,2276,NLW
2,,SING,CG,CD2,no,N,2,,120225,2276,NLW
3,,SING,CG,CB,no,N,3,,120225,2276,NLW
4,,SING,CB,CA,no,N,4,,120225,2276,NLW
5,,SING,N,CA,no,N,5,,120225,2276,NLW
6,,SING,CA,C,no,N,6,,120225,2276,NLW
7,,SING,C,NH2,no,N,7,,120225,2276,NLW
8,,DOUB,C,O,no,N,8,,120225,2276,NLW
9,,SING,CD2,H1,no,N,9,,120225,2276,NLW
10,,SING,CD2,H2,no,N,10,,120225,2276,NLW
11,,SING,CD2,H3,no,N,11,,120225,2276,NLW
12,,SING,CG,H4,no,N,12,,120225,2276,NLW
13,,SING,CD1,H5,no,N,13,,120225,2276,NLW
14,,SING,CD1,H6,no,N,14,,120225,2276,NLW
15,,SING,CD1,H7,no,N,15,,120225,2276,NLW
16,,SING,CB,H8,no,N,16,,120225,2276,NLW
17,,SING,CB,H9,no,N,17,,120225,2276,NLW
18,,SING,CA,H10,no,N,18,,120225,2276,NLW
19,,SING,N,H11,no,N,19,,120225,2276,NLW
20,,SING,N,H12,no,N,20,,120225,2276,NLW
21,,SING,NH2,H14,no,N,21,,120225,2276,NLW
22,,SING,NH2,H15,no,N,22,,120225,2276,NLW
1,,SING,N,CA,no,N,1,,120241,2277,DAB
2,,SING,N,H,no,N,2,,120241,2277,DAB
3,,SING,N,H2,no,N,3,,120241,2277,DAB
4,,SING,CA,C,no,N,4,,120241,2277,DAB
5,,SING,CA,CB,no,N,5,,120241,2277,DAB
6,,SING,CA,HA,no,N,6,,120241,2277,DAB
7,,DOUB,C,O,no,N,7,,120241,2277,DAB
8,,SING,C,OXT,no,N,8,,120241,2277,DAB
9,,SING,CB,CG,no,N,9,,120241,2277,DAB
10,,SING,CB,HB2,no,N,10,,120241,2277,DAB
11,,SING,CB,HB3,no,N,11,,120241,2277,DAB
12,,SING,CG,ND,no,N,12,,120241,2277,DAB
13,,SING,CG,HG2,no,N,13,,120241,2277,DAB
14,,SING,CG,HG3,no,N,14,,120241,2277,DAB
15,,SING,ND,HD1,no,N,15,,120241,2277,DAB
16,,SING,ND,HD2,no,N,16,,120241,2277,DAB
17,,SING,OXT,HXT,no,N,17,,120241,2277,DAB
1,,SING,FE,NA,no,N,1,,120286,228,HEC
2,,SING,FE,NB,no,N,2,,120286,228,HEC
3,,SING,FE,NC,no,N,3,,120286,228,HEC
4,,SING,FE,ND,no,N,4,,120286,228,HEC
5,,DOUB,CHA,C1A,no,N,5,,120286,228,HEC
6,,SING,CHA,C4D,no,N,6,,120286,228,HEC
7,,SING,CHA,HHA,no,N,7,,120286,228,HEC
8,,DOUB,CHB,C4A,no,N,8,,120286,228,HEC
9,,SING,CHB,C1B,no,N,9,,120286,228,HEC
10,,SING,CHB,HHB,no,N,10,,120286,228,HEC
11,,DOUB,CHC,C4B,no,N,11,,120286,228,HEC
12,,SING,CHC,C1C,no,N,12,,120286,228,HEC
13,,SING,CHC,HHC,no,N,13,,120286,228,HEC
14,,DOUB,CHD,C4C,no,N,14,,120286,228,HEC
15,,SING,CHD,C1D,no,N,15,,120286,228,HEC
16,,SING,CHD,HHD,no,N,16,,120286,228,HEC
17,,SING,NA,C1A,yes,N,17,,120286,228,HEC
18,,SING,NA,C4A,yes,N,18,,120286,228,HEC
19,,SING,C1A,C2A,yes,N,19,,120286,228,HEC
20,,DOUB,C2A,C3A,yes,N,20,,120286,228,HEC
21,,SING,C2A,CAA,no,N,21,,120286,228,HEC
22,,SING,C3A,C4A,yes,N,22,,120286,228,HEC
23,,SING,C3A,CMA,no,N,23,,120286,228,HEC
24,,SING,CMA,HMA1,no,N,24,,120286,228,HEC
25,,SING,CMA,HMA2,no,N,25,,120286,228,HEC
26,,SING,CMA,HMA3,no,N,26,,120286,228,HEC
27,,SING,CAA,CBA,no,N,27,,120286,228,HEC
28,,SING,CAA,HAA1,no,N,28,,120286,228,HEC
29,,SING,CAA,HAA2,no,N,29,,120286,228,HEC
30,,SING,CBA,CGA,no,N,30,,120286,228,HEC
31,,SING,CBA,HBA1,no,N,31,,120286,228,HEC
32,,SING,CBA,HBA2,no,N,32,,120286,228,HEC
33,,DOUB,CGA,O1A,no,N,33,,120286,228,HEC
34,,SING,CGA,O2A,no,N,34,,120286,228,HEC
35,,SING,O2A,H2A,no,N,35,,120286,228,HEC
36,,SING,NB,C1B,yes,N,36,,120286,228,HEC
37,,SING,NB,C4B,yes,N,37,,120286,228,HEC
38,,DOUB,C1B,C2B,yes,N,38,,120286,228,HEC
39,,SING,C2B,C3B,yes,N,39,,120286,228,HEC
40,,SING,C2B,CMB,no,N,40,,120286,228,HEC
41,,SING,C3B,C4B,yes,N,41,,120286,228,HEC
42,,DOUB,C3B,CAB,no,E,42,,120286,228,HEC
43,,SING,CMB,HMB1,no,N,43,,120286,228,HEC
44,,SING,CMB,HMB2,no,N,44,,120286,228,HEC
45,,SING,CMB,HMB3,no,N,45,,120286,228,HEC
46,,SING,CAB,CBB,no,N,46,,120286,228,HEC
47,,SING,CAB,HAB,no,N,47,,120286,228,HEC
48,,SING,CBB,HBB1,no,N,48,,120286,228,HEC
49,,SING,CBB,HBB2,no,N,49,,120286,228,HEC
50,,SING,CBB,HBB3,no,N,50,,120286,228,HEC
51,,SING,NC,C1C,yes,N,51,,120286,228,HEC
52,,SING,NC,C4C,yes,N,52,,120286,228,HEC
53,,DOUB,C1C,C2C,yes,N,53,,120286,228,HEC
54,,SING,C2C,C3C,yes,N,54,,120286,228,HEC
55,,SING,C2C,CMC,no,N,55,,120286,228,HEC
56,,SING,C3C,C4C,yes,N,56,,120286,228,HEC
57,,DOUB,C3C,CAC,no,E,57,,120286,228,HEC
58,,SING,CMC,HMC1,no,N,58,,120286,228,HEC
59,,SING,CMC,HMC2,no,N,59,,120286,228,HEC
60,,SING,CMC,HMC3,no,N,60,,120286,228,HEC
61,,SING,CAC,CBC,no,N,61,,120286,228,HEC
62,,SING,CAC,HAC,no,N,62,,120286,228,HEC
63,,SING,CBC,HBC1,no,N,63,,120286,228,HEC
64,,SING,CBC,HBC2,no,N,64,,120286,228,HEC
65,,SING,CBC,HBC3,no,N,65,,120286,228,HEC
66,,SING,ND,C1D,yes,N,66,,120286,228,HEC
67,,SING,ND,C4D,yes,N,67,,120286,228,HEC
68,,DOUB,C1D,C2D,yes,N,68,,120286,228,HEC
69,,SING,C2D,C3D,yes,N,69,,120286,228,HEC
70,,SING,C2D,CMD,no,N,70,,120286,228,HEC
71,,DOUB,C3D,C4D,yes,N,71,,120286,228,HEC
72,,SING,C3D,CAD,no,N,72,,120286,228,HEC
73,,SING,CMD,HMD1,no,N,73,,120286,228,HEC
74,,SING,CMD,HMD2,no,N,74,,120286,228,HEC
75,,SING,CMD,HMD3,no,N,75,,120286,228,HEC
76,,SING,CAD,CBD,no,N,76,,120286,228,HEC
77,,SING,CAD,HAD1,no,N,77,,120286,228,HEC
78,,SING,CAD,HAD2,no,N,78,,120286,228,HEC
79,,SING,CBD,CGD,no,N,79,,120286,228,HEC
80,,SING,CBD,HBD1,no,N,80,,120286,228,HEC
81,,SING,CBD,HBD2,no,N,81,,120286,228,HEC
82,,DOUB,CGD,O1D,no,N,82,,120286,228,HEC
83,,SING,CGD,O2D,no,N,83,,120286,228,HEC
84,,SING,O2D,H2D,no,N,84,,120286,228,HEC
1,,SING,N,CA,no,N,1,,120311,2282,NLE
2,,SING,N,H,no,N,2,,120311,2282,NLE
3,,SING,N,HN2,no,N,3,,120311,2282,NLE
4,,SING,CA,C,no,N,4,,120311,2282,NLE
5,,SING,CA,CB,no,N,5,,120311,2282,NLE
6,,SING,CA,HA,no,N,6,,120311,2282,NLE
7,,DOUB,C,O,no,N,7,,120311,2282,NLE
8,,SING,C,OXT,no,N,8,,120311,2282,NLE
9,,SING,OXT,HXT,no,N,9,,120311,2282,NLE
10,,SING,CB,CG,no,N,10,,120311,2282,NLE
11,,SING,CB,HB2,no,N,11,,120311,2282,NLE
12,,SING,CB,HB3,no,N,12,,120311,2282,NLE
13,,SING,CG,CD,no,N,13,,120311,2282,NLE
14,,SING,CG,HG2,no,N,14,,120311,2282,NLE
15,,SING,CG,HG3,no,N,15,,120311,2282,NLE
16,,SING,CD,CE,no,N,16,,120311,2282,NLE
17,,SING,CD,HD2,no,N,17,,120311,2282,NLE
18,,SING,CD,HD3,no,N,18,,120311,2282,NLE
19,,SING,CE,HE1,no,N,19,,120311,2282,NLE
20,,SING,CE,HE2,no,N,20,,120311,2282,NLE
21,,SING,CE,HE3,no,N,21,,120311,2282,NLE
1,,SING,FE,NA,no,N,1,,120378,229,HEC
2,,SING,FE,NB,no,N,2,,120378,229,HEC
3,,SING,FE,NC,no,N,3,,120378,229,HEC
4,,SING,FE,ND,no,N,4,,120378,229,HEC
5,,DOUB,CHA,C1A,no,N,5,,120378,229,HEC
6,,SING,CHA,C4D,no,N,6,,120378,229,HEC
7,,SING,CHA,HHA,no,N,7,,120378,229,HEC
8,,DOUB,CHB,C4A,no,N,8,,120378,229,HEC
9,,SING,CHB,C1B,no,N,9,,120378,229,HEC
10,,SING,CHB,HHB,no,N,10,,120378,229,HEC
11,,DOUB,CHC,C4B,no,N,11,,120378,229,HEC
12,,SING,CHC,C1C,no,N,12,,120378,229,HEC
13,,SING,CHC,HHC,no,N,13,,120378,229,HEC
14,,DOUB,CHD,C4C,no,N,14,,120378,229,HEC
15,,SING,CHD,C1D,no,N,15,,120378,229,HEC
16,,SING,CHD,HHD,no,N,16,,120378,229,HEC
17,,SING,NA,C1A,yes,N,17,,120378,229,HEC
18,,SING,NA,C4A,yes,N,18,,120378,229,HEC
19,,SING,C1A,C2A,yes,N,19,,120378,229,HEC
20,,DOUB,C2A,C3A,yes,N,20,,120378,229,HEC
21,,SING,C2A,CAA,no,N,21,,120378,229,HEC
22,,SING,C3A,C4A,yes,N,22,,120378,229,HEC
23,,SING,C3A,CMA,no,N,23,,120378,229,HEC
24,,SING,CMA,HMA1,no,N,24,,120378,229,HEC
25,,SING,CMA,HMA2,no,N,25,,120378,229,HEC
26,,SING,CMA,HMA3,no,N,26,,120378,229,HEC
27,,SING,CAA,CBA,no,N,27,,120378,229,HEC
28,,SING,CAA,HAA1,no,N,28,,120378,229,HEC
29,,SING,CAA,HAA2,no,N,29,,120378,229,HEC
30,,SING,CBA,CGA,no,N,30,,120378,229,HEC
31,,SING,CBA,HBA1,no,N,31,,120378,229,HEC
32,,SING,CBA,HBA2,no,N,32,,120378,229,HEC
33,,DOUB,CGA,O1A,no,N,33,,120378,229,HEC
34,,SING,CGA,O2A,no,N,34,,120378,229,HEC
35,,SING,O2A,H2A,no,N,35,,120378,229,HEC
36,,SING,NB,C1B,yes,N,36,,120378,229,HEC
37,,SING,NB,C4B,yes,N,37,,120378,229,HEC
38,,DOUB,C1B,C2B,yes,N,38,,120378,229,HEC
39,,SING,C2B,C3B,yes,N,39,,120378,229,HEC
40,,SING,C2B,CMB,no,N,40,,120378,229,HEC
41,,SING,C3B,C4B,yes,N,41,,120378,229,HEC
42,,DOUB,C3B,CAB,no,E,42,,120378,229,HEC
43,,SING,CMB,HMB1,no,N,43,,120378,229,HEC
44,,SING,CMB,HMB2,no,N,44,,120378,229,HEC
45,,SING,CMB,HMB3,no,N,45,,120378,229,HEC
46,,SING,CAB,CBB,no,N,46,,120378,229,HEC
47,,SING,CAB,HAB,no,N,47,,120378,229,HEC
48,,SING,CBB,HBB1,no,N,48,,120378,229,HEC
49,,SING,CBB,HBB2,no,N,49,,120378,229,HEC
50,,SING,CBB,HBB3,no,N,50,,120378,229,HEC
51,,SING,NC,C1C,yes,N,51,,120378,229,HEC
52,,SING,NC,C4C,yes,N,52,,120378,229,HEC
53,,DOUB,C1C,C2C,yes,N,53,,120378,229,HEC
54,,SING,C2C,C3C,yes,N,54,,120378,229,HEC
55,,SING,C2C,CMC,no,N,55,,120378,229,HEC
56,,SING,C3C,C4C,yes,N,56,,120378,229,HEC
57,,DOUB,C3C,CAC,no,E,57,,120378,229,HEC
58,,SING,CMC,HMC1,no,N,58,,120378,229,HEC
59,,SING,CMC,HMC2,no,N,59,,120378,229,HEC
60,,SING,CMC,HMC3,no,N,60,,120378,229,HEC
61,,SING,CAC,CBC,no,N,61,,120378,229,HEC
62,,SING,CAC,HAC,no,N,62,,120378,229,HEC
63,,SING,CBC,HBC1,no,N,63,,120378,229,HEC
64,,SING,CBC,HBC2,no,N,64,,120378,229,HEC
65,,SING,CBC,HBC3,no,N,65,,120378,229,HEC
66,,SING,ND,C1D,yes,N,66,,120378,229,HEC
67,,SING,ND,C4D,yes,N,67,,120378,229,HEC
68,,DOUB,C1D,C2D,yes,N,68,,120378,229,HEC
69,,SING,C2D,C3D,yes,N,69,,120378,229,HEC
70,,SING,C2D,CMD,no,N,70,,120378,229,HEC
71,,DOUB,C3D,C4D,yes,N,71,,120378,229,HEC
72,,SING,C3D,CAD,no,N,72,,120378,229,HEC
73,,SING,CMD,HMD1,no,N,73,,120378,229,HEC
74,,SING,CMD,HMD2,no,N,74,,120378,229,HEC
75,,SING,CMD,HMD3,no,N,75,,120378,229,HEC
76,,SING,CAD,CBD,no,N,76,,120378,229,HEC
77,,SING,CAD,HAD1,no,N,77,,120378,229,HEC
78,,SING,CAD,HAD2,no,N,78,,120378,229,HEC
79,,SING,CBD,CGD,no,N,79,,120378,229,HEC
80,,SING,CBD,HBD1,no,N,80,,120378,229,HEC
81,,SING,CBD,HBD2,no,N,81,,120378,229,HEC
82,,DOUB,CGD,O1D,no,N,82,,120378,229,HEC
83,,SING,CGD,O2D,no,N,83,,120378,229,HEC
84,,SING,O2D,H2D,no,N,84,,120378,229,HEC
1,,SING,N,CA,no,N,1,,120379,229,M3L
2,,SING,N,H,no,N,2,,120379,229,M3L
3,,SING,N,H2,no,N,3,,120379,229,M3L
4,,SING,CA,CB,no,N,4,,120379,229,M3L
5,,SING,CA,C,no,N,5,,120379,229,M3L
6,,SING,CA,HA,no,N,6,,120379,229,M3L
7,,SING,CB,CG,no,N,7,,120379,229,M3L
8,,SING,CB,HB2,no,N,8,,120379,229,M3L
9,,SING,CB,HB3,no,N,9,,120379,229,M3L
10,,SING,CG,CD,no,N,10,,120379,229,M3L
11,,SING,CG,HG2,no,N,11,,120379,229,M3L
12,,SING,CG,HG3,no,N,12,,120379,229,M3L
13,,SING,CD,CE,no,N,13,,120379,229,M3L
14,,SING,CD,HD2,no,N,14,,120379,229,M3L
15,,SING,CD,HD3,no,N,15,,120379,229,M3L
16,,SING,CE,NZ,no,N,16,,120379,229,M3L
17,,SING,CE,HE2,no,N,17,,120379,229,M3L
18,,SING,CE,HE3,no,N,18,,120379,229,M3L
19,,SING,NZ,CM1,no,N,19,,120379,229,M3L
20,,SING,NZ,CM2,no,N,20,,120379,229,M3L
21,,SING,NZ,CM3,no,N,21,,120379,229,M3L
22,,DOUB,C,O,no,N,22,,120379,229,M3L
23,,SING,C,OXT,no,N,23,,120379,229,M3L
24,,SING,OXT,HXT,no,N,24,,120379,229,M3L
25,,SING,CM1,HM11,no,N,25,,120379,229,M3L
26,,SING,CM1,HM12,no,N,26,,120379,229,M3L
27,,SING,CM1,HM13,no,N,27,,120379,229,M3L
28,,SING,CM2,HM21,no,N,28,,120379,229,M3L
29,,SING,CM2,HM22,no,N,29,,120379,229,M3L
30,,SING,CM2,HM23,no,N,30,,120379,229,M3L
31,,SING,CM3,HM31,no,N,31,,120379,229,M3L
32,,SING,CM3,HM32,no,N,32,,120379,229,M3L
33,,SING,CM3,HM33,no,N,33,,120379,229,M3L
1,,SING,CT2,CT1,no,N,1,,120406,2324,AME
2,,SING,CT2,HT23,no,N,2,,120406,2324,AME
3,,SING,CT2,HT22,no,N,3,,120406,2324,AME
4,,SING,CT2,HT21,no,N,4,,120406,2324,AME
5,,DOUB,CT1,OT,no,N,5,,120406,2324,AME
6,,SING,CT1,N,no,N,6,,120406,2324,AME
7,,SING,CB,CG,no,N,7,,120406,2324,AME
8,,SING,CB,CA,no,N,8,,120406,2324,AME
9,,SING,CB,HB2,no,N,9,,120406,2324,AME
10,,SING,CB,HB1,no,N,10,,120406,2324,AME
11,,SING,CG,SD,no,N,11,,120406,2324,AME
12,,SING,CG,HG2,no,N,12,,120406,2324,AME
13,,SING,CG,HG1,no,N,13,,120406,2324,AME
14,,SING,SD,CE,no,N,14,,120406,2324,AME
15,,SING,CE,HE3,no,N,15,,120406,2324,AME
16,,SING,CE,HE2,no,N,16,,120406,2324,AME
17,,SING,CE,HE1,no,N,17,,120406,2324,AME
18,,DOUB,C,O,no,N,18,,120406,2324,AME
19,,SING,C,OXT,no,N,19,,120406,2324,AME
20,,SING,C,CA,no,N,20,,120406,2324,AME
21,,SING,OXT,HO,no,N,21,,120406,2324,AME
22,,SING,N,CA,no,N,22,,120406,2324,AME
23,,SING,N,HN1,no,N,23,,120406,2324,AME
24,,SING,CA,HA,no,N,24,,120406,2324,AME
1,,SING,CT2,CT1,no,N,1,,120420,2325,AME
2,,SING,CT2,HT23,no,N,2,,120420,2325,AME
3,,SING,CT2,HT22,no,N,3,,120420,2325,AME
4,,SING,CT2,HT21,no,N,4,,120420,2325,AME
5,,DOUB,CT1,OT,no,N,5,,120420,2325,AME
6,,SING,CT1,N,no,N,6,,120420,2325,AME
7,,SING,CB,CG,no,N,7,,120420,2325,AME
8,,SING,CB,CA,no,N,8,,120420,2325,AME
9,,SING,CB,HB2,no,N,9,,120420,2325,AME
10,,SING,CB,HB1,no,N,10,,120420,2325,AME
11,,SING,CG,SD,no,N,11,,120420,2325,AME
12,,SING,CG,HG2,no,N,12,,120420,2325,AME
13,,SING,CG,HG1,no,N,13,,120420,2325,AME
14,,SING,SD,CE,no,N,14,,120420,2325,AME
15,,SING,CE,HE3,no,N,15,,120420,2325,AME
16,,SING,CE,HE2,no,N,16,,120420,2325,AME
17,,SING,CE,HE1,no,N,17,,120420,2325,AME
18,,DOUB,C,O,no,N,18,,120420,2325,AME
19,,SING,C,OXT,no,N,19,,120420,2325,AME
20,,SING,C,CA,no,N,20,,120420,2325,AME
21,,SING,OXT,HO,no,N,21,,120420,2325,AME
22,,SING,N,CA,no,N,22,,120420,2325,AME
23,,SING,N,HN1,no,N,23,,120420,2325,AME
24,,SING,CA,HA,no,N,24,,120420,2325,AME
1,,SING,CT2,CT1,no,N,1,,120434,2326,AME
2,,SING,CT2,HT23,no,N,2,,120434,2326,AME
3,,SING,CT2,HT22,no,N,3,,120434,2326,AME
4,,SING,CT2,HT21,no,N,4,,120434,2326,AME
5,,DOUB,CT1,OT,no,N,5,,120434,2326,AME
6,,SING,CT1,N,no,N,6,,120434,2326,AME
7,,SING,CB,CG,no,N,7,,120434,2326,AME
8,,SING,CB,CA,no,N,8,,120434,2326,AME
9,,SING,CB,HB2,no,N,9,,120434,2326,AME
10,,SING,CB,HB1,no,N,10,,120434,2326,AME
11,,SING,CG,SD,no,N,11,,120434,2326,AME
12,,SING,CG,HG2,no,N,12,,120434,2326,AME
13,,SING,CG,HG1,no,N,13,,120434,2326,AME
14,,SING,SD,CE,no,N,14,,120434,2326,AME
15,,SING,CE,HE3,no,N,15,,120434,2326,AME
16,,SING,CE,HE2,no,N,16,,120434,2326,AME
17,,SING,CE,HE1,no,N,17,,120434,2326,AME
18,,DOUB,C,O,no,N,18,,120434,2326,AME
19,,SING,C,OXT,no,N,19,,120434,2326,AME
20,,SING,C,CA,no,N,20,,120434,2326,AME
21,,SING,OXT,HO,no,N,21,,120434,2326,AME
22,,SING,N,CA,no,N,22,,120434,2326,AME
23,,SING,N,HN1,no,N,23,,120434,2326,AME
24,,SING,CA,HA,no,N,24,,120434,2326,AME
1,,DOUB,C,O,no,N,1,,120461,2328,ACE
2,,SING,C,CH3,no,N,2,,120461,2328,ACE
3,,SING,C,H,no,N,3,,120461,2328,ACE
4,,SING,CH3,H1,no,N,4,,120461,2328,ACE
5,,SING,CH3,H2,no,N,5,,120461,2328,ACE
6,,SING,CH3,H3,no,N,6,,120461,2328,ACE
1,,SING,N,HN1,no,N,1,,120462,2328,NH2
2,,SING,N,HN2,no,N,2,,120462,2328,NH2
1,,DOUB,C,O,no,N,1,,120476,2329,ACE
2,,SING,C,CH3,no,N,2,,120476,2329,ACE
3,,SING,C,H,no,N,3,,120476,2329,ACE
4,,SING,CH3,H1,no,N,4,,120476,2329,ACE
5,,SING,CH3,H2,no,N,5,,120476,2329,ACE
6,,SING,CH3,H3,no,N,6,,120476,2329,ACE
1,,SING,N,HN1,no,N,1,,120477,2329,NH2
2,,SING,N,HN2,no,N,2,,120477,2329,NH2
1,,SING,FE,NA,no,N,1,,120489,233,HEC
2,,SING,FE,NB,no,N,2,,120489,233,HEC
3,,SING,FE,NC,no,N,3,,120489,233,HEC
4,,SING,FE,ND,no,N,4,,120489,233,HEC
5,,DOUB,CHA,C1A,no,N,5,,120489,233,HEC
6,,SING,CHA,C4D,no,N,6,,120489,233,HEC
7,,SING,CHA,HHA,no,N,7,,120489,233,HEC
8,,DOUB,CHB,C4A,no,N,8,,120489,233,HEC
9,,SING,CHB,C1B,no,N,9,,120489,233,HEC
10,,SING,CHB,HHB,no,N,10,,120489,233,HEC
11,,DOUB,CHC,C4B,no,N,11,,120489,233,HEC
12,,SING,CHC,C1C,no,N,12,,120489,233,HEC
13,,SING,CHC,HHC,no,N,13,,120489,233,HEC
14,,DOUB,CHD,C4C,no,N,14,,120489,233,HEC
15,,SING,CHD,C1D,no,N,15,,120489,233,HEC
16,,SING,CHD,HHD,no,N,16,,120489,233,HEC
17,,SING,NA,C1A,yes,N,17,,120489,233,HEC
18,,SING,NA,C4A,yes,N,18,,120489,233,HEC
19,,SING,C1A,C2A,yes,N,19,,120489,233,HEC
20,,DOUB,C2A,C3A,yes,N,20,,120489,233,HEC
21,,SING,C2A,CAA,no,N,21,,120489,233,HEC
22,,SING,C3A,C4A,yes,N,22,,120489,233,HEC
23,,SING,C3A,CMA,no,N,23,,120489,233,HEC
24,,SING,CMA,HMA1,no,N,24,,120489,233,HEC
25,,SING,CMA,HMA2,no,N,25,,120489,233,HEC
26,,SING,CMA,HMA3,no,N,26,,120489,233,HEC
27,,SING,CAA,CBA,no,N,27,,120489,233,HEC
28,,SING,CAA,HAA1,no,N,28,,120489,233,HEC
29,,SING,CAA,HAA2,no,N,29,,120489,233,HEC
30,,SING,CBA,CGA,no,N,30,,120489,233,HEC
31,,SING,CBA,HBA1,no,N,31,,120489,233,HEC
32,,SING,CBA,HBA2,no,N,32,,120489,233,HEC
33,,DOUB,CGA,O1A,no,N,33,,120489,233,HEC
34,,SING,CGA,O2A,no,N,34,,120489,233,HEC
35,,SING,O2A,H2A,no,N,35,,120489,233,HEC
36,,SING,NB,C1B,yes,N,36,,120489,233,HEC
37,,SING,NB,C4B,yes,N,37,,120489,233,HEC
38,,DOUB,C1B,C2B,yes,N,38,,120489,233,HEC
39,,SING,C2B,C3B,yes,N,39,,120489,233,HEC
40,,SING,C2B,CMB,no,N,40,,120489,233,HEC
41,,SING,C3B,C4B,yes,N,41,,120489,233,HEC
42,,DOUB,C3B,CAB,no,E,42,,120489,233,HEC
43,,SING,CMB,HMB1,no,N,43,,120489,233,HEC
44,,SING,CMB,HMB2,no,N,44,,120489,233,HEC
45,,SING,CMB,HMB3,no,N,45,,120489,233,HEC
46,,SING,CAB,CBB,no,N,46,,120489,233,HEC
47,,SING,CAB,HAB,no,N,47,,120489,233,HEC
48,,SING,CBB,HBB1,no,N,48,,120489,233,HEC
49,,SING,CBB,HBB2,no,N,49,,120489,233,HEC
50,,SING,CBB,HBB3,no,N,50,,120489,233,HEC
51,,SING,NC,C1C,yes,N,51,,120489,233,HEC
52,,SING,NC,C4C,yes,N,52,,120489,233,HEC
53,,DOUB,C1C,C2C,yes,N,53,,120489,233,HEC
54,,SING,C2C,C3C,yes,N,54,,120489,233,HEC
55,,SING,C2C,CMC,no,N,55,,120489,233,HEC
56,,SING,C3C,C4C,yes,N,56,,120489,233,HEC
57,,DOUB,C3C,CAC,no,E,57,,120489,233,HEC
58,,SING,CMC,HMC1,no,N,58,,120489,233,HEC
59,,SING,CMC,HMC2,no,N,59,,120489,233,HEC
60,,SING,CMC,HMC3,no,N,60,,120489,233,HEC
61,,SING,CAC,CBC,no,N,61,,120489,233,HEC
62,,SING,CAC,HAC,no,N,62,,120489,233,HEC
63,,SING,CBC,HBC1,no,N,63,,120489,233,HEC
64,,SING,CBC,HBC2,no,N,64,,120489,233,HEC
65,,SING,CBC,HBC3,no,N,65,,120489,233,HEC
66,,SING,ND,C1D,yes,N,66,,120489,233,HEC
67,,SING,ND,C4D,yes,N,67,,120489,233,HEC
68,,DOUB,C1D,C2D,yes,N,68,,120489,233,HEC
69,,SING,C2D,C3D,yes,N,69,,120489,233,HEC
70,,SING,C2D,CMD,no,N,70,,120489,233,HEC
71,,DOUB,C3D,C4D,yes,N,71,,120489,233,HEC
72,,SING,C3D,CAD,no,N,72,,120489,233,HEC
73,,SING,CMD,HMD1,no,N,73,,120489,233,HEC
74,,SING,CMD,HMD2,no,N,74,,120489,233,HEC
75,,SING,CMD,HMD3,no,N,75,,120489,233,HEC
76,,SING,CAD,CBD,no,N,76,,120489,233,HEC
77,,SING,CAD,HAD1,no,N,77,,120489,233,HEC
78,,SING,CAD,HAD2,no,N,78,,120489,233,HEC
79,,SING,CBD,CGD,no,N,79,,120489,233,HEC
80,,SING,CBD,HBD1,no,N,80,,120489,233,HEC
81,,SING,CBD,HBD2,no,N,81,,120489,233,HEC
82,,DOUB,CGD,O1D,no,N,82,,120489,233,HEC
83,,SING,CGD,O2D,no,N,83,,120489,233,HEC
84,,SING,O2D,H2D,no,N,84,,120489,233,HEC
1,,SING,N,CA,no,N,1,,120490,233,M3L
2,,SING,N,H,no,N,2,,120490,233,M3L
3,,SING,N,H2,no,N,3,,120490,233,M3L
4,,SING,CA,CB,no,N,4,,120490,233,M3L
5,,SING,CA,C,no,N,5,,120490,233,M3L
6,,SING,CA,HA,no,N,6,,120490,233,M3L
7,,SING,CB,CG,no,N,7,,120490,233,M3L
8,,SING,CB,HB2,no,N,8,,120490,233,M3L
9,,SING,CB,HB3,no,N,9,,120490,233,M3L
10,,SING,CG,CD,no,N,10,,120490,233,M3L
11,,SING,CG,HG2,no,N,11,,120490,233,M3L
12,,SING,CG,HG3,no,N,12,,120490,233,M3L
13,,SING,CD,CE,no,N,13,,120490,233,M3L
14,,SING,CD,HD2,no,N,14,,120490,233,M3L
15,,SING,CD,HD3,no,N,15,,120490,233,M3L
16,,SING,CE,NZ,no,N,16,,120490,233,M3L
17,,SING,CE,HE2,no,N,17,,120490,233,M3L
18,,SING,CE,HE3,no,N,18,,120490,233,M3L
19,,SING,NZ,CM1,no,N,19,,120490,233,M3L
20,,SING,NZ,CM2,no,N,20,,120490,233,M3L
21,,SING,NZ,CM3,no,N,21,,120490,233,M3L
22,,DOUB,C,O,no,N,22,,120490,233,M3L
23,,SING,C,OXT,no,N,23,,120490,233,M3L
24,,SING,OXT,HXT,no,N,24,,120490,233,M3L
25,,SING,CM1,HM11,no,N,25,,120490,233,M3L
26,,SING,CM1,HM12,no,N,26,,120490,233,M3L
27,,SING,CM1,HM13,no,N,27,,120490,233,M3L
28,,SING,CM2,HM21,no,N,28,,120490,233,M3L
29,,SING,CM2,HM22,no,N,29,,120490,233,M3L
30,,SING,CM2,HM23,no,N,30,,120490,233,M3L
31,,SING,CM3,HM31,no,N,31,,120490,233,M3L
32,,SING,CM3,HM32,no,N,32,,120490,233,M3L
33,,SING,CM3,HM33,no,N,33,,120490,233,M3L
1,,SING,FE,NA,no,N,1,,120531,234,HEC
2,,SING,FE,NB,no,N,2,,120531,234,HEC
3,,SING,FE,NC,no,N,3,,120531,234,HEC
4,,SING,FE,ND,no,N,4,,120531,234,HEC
5,,DOUB,CHA,C1A,no,N,5,,120531,234,HEC
6,,SING,CHA,C4D,no,N,6,,120531,234,HEC
7,,SING,CHA,HHA,no,N,7,,120531,234,HEC
8,,DOUB,CHB,C4A,no,N,8,,120531,234,HEC
9,,SING,CHB,C1B,no,N,9,,120531,234,HEC
10,,SING,CHB,HHB,no,N,10,,120531,234,HEC
11,,DOUB,CHC,C4B,no,N,11,,120531,234,HEC
12,,SING,CHC,C1C,no,N,12,,120531,234,HEC
13,,SING,CHC,HHC,no,N,13,,120531,234,HEC
14,,DOUB,CHD,C4C,no,N,14,,120531,234,HEC
15,,SING,CHD,C1D,no,N,15,,120531,234,HEC
16,,SING,CHD,HHD,no,N,16,,120531,234,HEC
17,,SING,NA,C1A,yes,N,17,,120531,234,HEC
18,,SING,NA,C4A,yes,N,18,,120531,234,HEC
19,,SING,C1A,C2A,yes,N,19,,120531,234,HEC
20,,DOUB,C2A,C3A,yes,N,20,,120531,234,HEC
21,,SING,C2A,CAA,no,N,21,,120531,234,HEC
22,,SING,C3A,C4A,yes,N,22,,120531,234,HEC
23,,SING,C3A,CMA,no,N,23,,120531,234,HEC
24,,SING,CMA,HMA1,no,N,24,,120531,234,HEC
25,,SING,CMA,HMA2,no,N,25,,120531,234,HEC
26,,SING,CMA,HMA3,no,N,26,,120531,234,HEC
27,,SING,CAA,CBA,no,N,27,,120531,234,HEC
28,,SING,CAA,HAA1,no,N,28,,120531,234,HEC
29,,SING,CAA,HAA2,no,N,29,,120531,234,HEC
30,,SING,CBA,CGA,no,N,30,,120531,234,HEC
31,,SING,CBA,HBA1,no,N,31,,120531,234,HEC
32,,SING,CBA,HBA2,no,N,32,,120531,234,HEC
33,,DOUB,CGA,O1A,no,N,33,,120531,234,HEC
34,,SING,CGA,O2A,no,N,34,,120531,234,HEC
35,,SING,O2A,H2A,no,N,35,,120531,234,HEC
36,,SING,NB,C1B,yes,N,36,,120531,234,HEC
37,,SING,NB,C4B,yes,N,37,,120531,234,HEC
38,,DOUB,C1B,C2B,yes,N,38,,120531,234,HEC
39,,SING,C2B,C3B,yes,N,39,,120531,234,HEC
40,,SING,C2B,CMB,no,N,40,,120531,234,HEC
41,,SING,C3B,C4B,yes,N,41,,120531,234,HEC
42,,DOUB,C3B,CAB,no,E,42,,120531,234,HEC
43,,SING,CMB,HMB1,no,N,43,,120531,234,HEC
44,,SING,CMB,HMB2,no,N,44,,120531,234,HEC
45,,SING,CMB,HMB3,no,N,45,,120531,234,HEC
46,,SING,CAB,CBB,no,N,46,,120531,234,HEC
47,,SING,CAB,HAB,no,N,47,,120531,234,HEC
48,,SING,CBB,HBB1,no,N,48,,120531,234,HEC
49,,SING,CBB,HBB2,no,N,49,,120531,234,HEC
50,,SING,CBB,HBB3,no,N,50,,120531,234,HEC
51,,SING,NC,C1C,yes,N,51,,120531,234,HEC
52,,SING,NC,C4C,yes,N,52,,120531,234,HEC
53,,DOUB,C1C,C2C,yes,N,53,,120531,234,HEC
54,,SING,C2C,C3C,yes,N,54,,120531,234,HEC
55,,SING,C2C,CMC,no,N,55,,120531,234,HEC
56,,SING,C3C,C4C,yes,N,56,,120531,234,HEC
57,,DOUB,C3C,CAC,no,E,57,,120531,234,HEC
58,,SING,CMC,HMC1,no,N,58,,120531,234,HEC
59,,SING,CMC,HMC2,no,N,59,,120531,234,HEC
60,,SING,CMC,HMC3,no,N,60,,120531,234,HEC
61,,SING,CAC,CBC,no,N,61,,120531,234,HEC
62,,SING,CAC,HAC,no,N,62,,120531,234,HEC
63,,SING,CBC,HBC1,no,N,63,,120531,234,HEC
64,,SING,CBC,HBC2,no,N,64,,120531,234,HEC
65,,SING,CBC,HBC3,no,N,65,,120531,234,HEC
66,,SING,ND,C1D,yes,N,66,,120531,234,HEC
67,,SING,ND,C4D,yes,N,67,,120531,234,HEC
68,,DOUB,C1D,C2D,yes,N,68,,120531,234,HEC
69,,SING,C2D,C3D,yes,N,69,,120531,234,HEC
70,,SING,C2D,CMD,no,N,70,,120531,234,HEC
71,,DOUB,C3D,C4D,yes,N,71,,120531,234,HEC
72,,SING,C3D,CAD,no,N,72,,120531,234,HEC
73,,SING,CMD,HMD1,no,N,73,,120531,234,HEC
74,,SING,CMD,HMD2,no,N,74,,120531,234,HEC
75,,SING,CMD,HMD3,no,N,75,,120531,234,HEC
76,,SING,CAD,CBD,no,N,76,,120531,234,HEC
77,,SING,CAD,HAD1,no,N,77,,120531,234,HEC
78,,SING,CAD,HAD2,no,N,78,,120531,234,HEC
79,,SING,CBD,CGD,no,N,79,,120531,234,HEC
80,,SING,CBD,HBD1,no,N,80,,120531,234,HEC
81,,SING,CBD,HBD2,no,N,81,,120531,234,HEC
82,,DOUB,CGD,O1D,no,N,82,,120531,234,HEC
83,,SING,CGD,O2D,no,N,83,,120531,234,HEC
84,,SING,O2D,H2D,no,N,84,,120531,234,HEC
1,,SING,FE,NA,no,N,1,,120598,235,HEC
2,,SING,FE,NB,no,N,2,,120598,235,HEC
3,,SING,FE,NC,no,N,3,,120598,235,HEC
4,,SING,FE,ND,no,N,4,,120598,235,HEC
5,,DOUB,CHA,C1A,no,N,5,,120598,235,HEC
6,,SING,CHA,C4D,no,N,6,,120598,235,HEC
7,,SING,CHA,HHA,no,N,7,,120598,235,HEC
8,,DOUB,CHB,C4A,no,N,8,,120598,235,HEC
9,,SING,CHB,C1B,no,N,9,,120598,235,HEC
10,,SING,CHB,HHB,no,N,10,,120598,235,HEC
11,,DOUB,CHC,C4B,no,N,11,,120598,235,HEC
12,,SING,CHC,C1C,no,N,12,,120598,235,HEC
13,,SING,CHC,HHC,no,N,13,,120598,235,HEC
14,,DOUB,CHD,C4C,no,N,14,,120598,235,HEC
15,,SING,CHD,C1D,no,N,15,,120598,235,HEC
16,,SING,CHD,HHD,no,N,16,,120598,235,HEC
17,,SING,NA,C1A,yes,N,17,,120598,235,HEC
18,,SING,NA,C4A,yes,N,18,,120598,235,HEC
19,,SING,C1A,C2A,yes,N,19,,120598,235,HEC
20,,DOUB,C2A,C3A,yes,N,20,,120598,235,HEC
21,,SING,C2A,CAA,no,N,21,,120598,235,HEC
22,,SING,C3A,C4A,yes,N,22,,120598,235,HEC
23,,SING,C3A,CMA,no,N,23,,120598,235,HEC
24,,SING,CMA,HMA1,no,N,24,,120598,235,HEC
25,,SING,CMA,HMA2,no,N,25,,120598,235,HEC
26,,SING,CMA,HMA3,no,N,26,,120598,235,HEC
27,,SING,CAA,CBA,no,N,27,,120598,235,HEC
28,,SING,CAA,HAA1,no,N,28,,120598,235,HEC
29,,SING,CAA,HAA2,no,N,29,,120598,235,HEC
30,,SING,CBA,CGA,no,N,30,,120598,235,HEC
31,,SING,CBA,HBA1,no,N,31,,120598,235,HEC
32,,SING,CBA,HBA2,no,N,32,,120598,235,HEC
33,,DOUB,CGA,O1A,no,N,33,,120598,235,HEC
34,,SING,CGA,O2A,no,N,34,,120598,235,HEC
35,,SING,O2A,H2A,no,N,35,,120598,235,HEC
36,,SING,NB,C1B,yes,N,36,,120598,235,HEC
37,,SING,NB,C4B,yes,N,37,,120598,235,HEC
38,,DOUB,C1B,C2B,yes,N,38,,120598,235,HEC
39,,SING,C2B,C3B,yes,N,39,,120598,235,HEC
40,,SING,C2B,CMB,no,N,40,,120598,235,HEC
41,,SING,C3B,C4B,yes,N,41,,120598,235,HEC
42,,DOUB,C3B,CAB,no,E,42,,120598,235,HEC
43,,SING,CMB,HMB1,no,N,43,,120598,235,HEC
44,,SING,CMB,HMB2,no,N,44,,120598,235,HEC
45,,SING,CMB,HMB3,no,N,45,,120598,235,HEC
46,,SING,CAB,CBB,no,N,46,,120598,235,HEC
47,,SING,CAB,HAB,no,N,47,,120598,235,HEC
48,,SING,CBB,HBB1,no,N,48,,120598,235,HEC
49,,SING,CBB,HBB2,no,N,49,,120598,235,HEC
50,,SING,CBB,HBB3,no,N,50,,120598,235,HEC
51,,SING,NC,C1C,yes,N,51,,120598,235,HEC
52,,SING,NC,C4C,yes,N,52,,120598,235,HEC
53,,DOUB,C1C,C2C,yes,N,53,,120598,235,HEC
54,,SING,C2C,C3C,yes,N,54,,120598,235,HEC
55,,SING,C2C,CMC,no,N,55,,120598,235,HEC
56,,SING,C3C,C4C,yes,N,56,,120598,235,HEC
57,,DOUB,C3C,CAC,no,E,57,,120598,235,HEC
58,,SING,CMC,HMC1,no,N,58,,120598,235,HEC
59,,SING,CMC,HMC2,no,N,59,,120598,235,HEC
60,,SING,CMC,HMC3,no,N,60,,120598,235,HEC
61,,SING,CAC,CBC,no,N,61,,120598,235,HEC
62,,SING,CAC,HAC,no,N,62,,120598,235,HEC
63,,SING,CBC,HBC1,no,N,63,,120598,235,HEC
64,,SING,CBC,HBC2,no,N,64,,120598,235,HEC
65,,SING,CBC,HBC3,no,N,65,,120598,235,HEC
66,,SING,ND,C1D,yes,N,66,,120598,235,HEC
67,,SING,ND,C4D,yes,N,67,,120598,235,HEC
68,,DOUB,C1D,C2D,yes,N,68,,120598,235,HEC
69,,SING,C2D,C3D,yes,N,69,,120598,235,HEC
70,,SING,C2D,CMD,no,N,70,,120598,235,HEC
71,,DOUB,C3D,C4D,yes,N,71,,120598,235,HEC
72,,SING,C3D,CAD,no,N,72,,120598,235,HEC
73,,SING,CMD,HMD1,no,N,73,,120598,235,HEC
74,,SING,CMD,HMD2,no,N,74,,120598,235,HEC
75,,SING,CMD,HMD3,no,N,75,,120598,235,HEC
76,,SING,CAD,CBD,no,N,76,,120598,235,HEC
77,,SING,CAD,HAD1,no,N,77,,120598,235,HEC
78,,SING,CAD,HAD2,no,N,78,,120598,235,HEC
79,,SING,CBD,CGD,no,N,79,,120598,235,HEC
80,,SING,CBD,HBD1,no,N,80,,120598,235,HEC
81,,SING,CBD,HBD2,no,N,81,,120598,235,HEC
82,,DOUB,CGD,O1D,no,N,82,,120598,235,HEC
83,,SING,CGD,O2D,no,N,83,,120598,235,HEC
84,,SING,O2D,H2D,no,N,84,,120598,235,HEC
1,,SING,N,CA,no,N,1,,120599,235,M3L
2,,SING,N,H,no,N,2,,120599,235,M3L
3,,SING,N,H2,no,N,3,,120599,235,M3L
4,,SING,CA,CB,no,N,4,,120599,235,M3L
5,,SING,CA,C,no,N,5,,120599,235,M3L
6,,SING,CA,HA,no,N,6,,120599,235,M3L
7,,SING,CB,CG,no,N,7,,120599,235,M3L
8,,SING,CB,HB2,no,N,8,,120599,235,M3L
9,,SING,CB,HB3,no,N,9,,120599,235,M3L
10,,SING,CG,CD,no,N,10,,120599,235,M3L
11,,SING,CG,HG2,no,N,11,,120599,235,M3L
12,,SING,CG,HG3,no,N,12,,120599,235,M3L
13,,SING,CD,CE,no,N,13,,120599,235,M3L
14,,SING,CD,HD2,no,N,14,,120599,235,M3L
15,,SING,CD,HD3,no,N,15,,120599,235,M3L
16,,SING,CE,NZ,no,N,16,,120599,235,M3L
17,,SING,CE,HE2,no,N,17,,120599,235,M3L
18,,SING,CE,HE3,no,N,18,,120599,235,M3L
19,,SING,NZ,CM1,no,N,19,,120599,235,M3L
20,,SING,NZ,CM2,no,N,20,,120599,235,M3L
21,,SING,NZ,CM3,no,N,21,,120599,235,M3L
22,,DOUB,C,O,no,N,22,,120599,235,M3L
23,,SING,C,OXT,no,N,23,,120599,235,M3L
24,,SING,OXT,HXT,no,N,24,,120599,235,M3L
25,,SING,CM1,HM11,no,N,25,,120599,235,M3L
26,,SING,CM1,HM12,no,N,26,,120599,235,M3L
27,,SING,CM1,HM13,no,N,27,,120599,235,M3L
28,,SING,CM2,HM21,no,N,28,,120599,235,M3L
29,,SING,CM2,HM22,no,N,29,,120599,235,M3L
30,,SING,CM2,HM23,no,N,30,,120599,235,M3L
31,,SING,CM3,HM31,no,N,31,,120599,235,M3L
32,,SING,CM3,HM32,no,N,32,,120599,235,M3L
33,,SING,CM3,HM33,no,N,33,,120599,235,M3L
1,,SING,C1,C2,no,N,1,,120653,2366,AAC
2,,SING,C1,O1,no,N,2,,120653,2366,AAC
3,,DOUB,C1,O2,no,N,3,,120653,2366,AAC
4,,SING,C2,N1,no,N,4,,120653,2366,AAC
5,,SING,C2,HC21,no,N,5,,120653,2366,AAC
6,,SING,C2,HC22,no,N,6,,120653,2366,AAC
7,,SING,C3,C4,no,N,7,,120653,2366,AAC
8,,SING,C3,N1,no,N,8,,120653,2366,AAC
9,,DOUB,C3,O3,no,N,9,,120653,2366,AAC
10,,SING,C4,HC41,no,N,10,,120653,2366,AAC
11,,SING,C4,HC42,no,N,11,,120653,2366,AAC
12,,SING,C4,HC43,no,N,12,,120653,2366,AAC
13,,SING,N1,HN1,no,N,13,,120653,2366,AAC
14,,SING,O1,HO1,no,N,14,,120653,2366,AAC
1,,SING,FE,NA,no,N,1,,120654,2366,HEC
2,,SING,FE,NB,no,N,2,,120654,2366,HEC
3,,SING,FE,NC,no,N,3,,120654,2366,HEC
4,,SING,FE,ND,no,N,4,,120654,2366,HEC
5,,DOUB,CHA,C1A,no,N,5,,120654,2366,HEC
6,,SING,CHA,C4D,no,N,6,,120654,2366,HEC
7,,SING,CHA,HHA,no,N,7,,120654,2366,HEC
8,,DOUB,CHB,C4A,no,N,8,,120654,2366,HEC
9,,SING,CHB,C1B,no,N,9,,120654,2366,HEC
10,,SING,CHB,HHB,no,N,10,,120654,2366,HEC
11,,DOUB,CHC,C4B,no,N,11,,120654,2366,HEC
12,,SING,CHC,C1C,no,N,12,,120654,2366,HEC
13,,SING,CHC,HHC,no,N,13,,120654,2366,HEC
14,,DOUB,CHD,C4C,no,N,14,,120654,2366,HEC
15,,SING,CHD,C1D,no,N,15,,120654,2366,HEC
16,,SING,CHD,HHD,no,N,16,,120654,2366,HEC
17,,SING,NA,C1A,yes,N,17,,120654,2366,HEC
18,,SING,NA,C4A,yes,N,18,,120654,2366,HEC
19,,SING,C1A,C2A,yes,N,19,,120654,2366,HEC
20,,DOUB,C2A,C3A,yes,N,20,,120654,2366,HEC
21,,SING,C2A,CAA,no,N,21,,120654,2366,HEC
22,,SING,C3A,C4A,yes,N,22,,120654,2366,HEC
23,,SING,C3A,CMA,no,N,23,,120654,2366,HEC
24,,SING,CMA,HMA1,no,N,24,,120654,2366,HEC
25,,SING,CMA,HMA2,no,N,25,,120654,2366,HEC
26,,SING,CMA,HMA3,no,N,26,,120654,2366,HEC
27,,SING,CAA,CBA,no,N,27,,120654,2366,HEC
28,,SING,CAA,HAA1,no,N,28,,120654,2366,HEC
29,,SING,CAA,HAA2,no,N,29,,120654,2366,HEC
30,,SING,CBA,CGA,no,N,30,,120654,2366,HEC
31,,SING,CBA,HBA1,no,N,31,,120654,2366,HEC
32,,SING,CBA,HBA2,no,N,32,,120654,2366,HEC
33,,DOUB,CGA,O1A,no,N,33,,120654,2366,HEC
34,,SING,CGA,O2A,no,N,34,,120654,2366,HEC
35,,SING,O2A,H2A,no,N,35,,120654,2366,HEC
36,,SING,NB,C1B,yes,N,36,,120654,2366,HEC
37,,SING,NB,C4B,yes,N,37,,120654,2366,HEC
38,,DOUB,C1B,C2B,yes,N,38,,120654,2366,HEC
39,,SING,C2B,C3B,yes,N,39,,120654,2366,HEC
40,,SING,C2B,CMB,no,N,40,,120654,2366,HEC
41,,SING,C3B,C4B,yes,N,41,,120654,2366,HEC
42,,DOUB,C3B,CAB,no,E,42,,120654,2366,HEC
43,,SING,CMB,HMB1,no,N,43,,120654,2366,HEC
44,,SING,CMB,HMB2,no,N,44,,120654,2366,HEC
45,,SING,CMB,HMB3,no,N,45,,120654,2366,HEC
46,,SING,CAB,CBB,no,N,46,,120654,2366,HEC
47,,SING,CAB,HAB,no,N,47,,120654,2366,HEC
48,,SING,CBB,HBB1,no,N,48,,120654,2366,HEC
49,,SING,CBB,HBB2,no,N,49,,120654,2366,HEC
50,,SING,CBB,HBB3,no,N,50,,120654,2366,HEC
51,,SING,NC,C1C,yes,N,51,,120654,2366,HEC
52,,SING,NC,C4C,yes,N,52,,120654,2366,HEC
53,,DOUB,C1C,C2C,yes,N,53,,120654,2366,HEC
54,,SING,C2C,C3C,yes,N,54,,120654,2366,HEC
55,,SING,C2C,CMC,no,N,55,,120654,2366,HEC
56,,SING,C3C,C4C,yes,N,56,,120654,2366,HEC
57,,DOUB,C3C,CAC,no,E,57,,120654,2366,HEC
58,,SING,CMC,HMC1,no,N,58,,120654,2366,HEC
59,,SING,CMC,HMC2,no,N,59,,120654,2366,HEC
60,,SING,CMC,HMC3,no,N,60,,120654,2366,HEC
61,,SING,CAC,CBC,no,N,61,,120654,2366,HEC
62,,SING,CAC,HAC,no,N,62,,120654,2366,HEC
63,,SING,CBC,HBC1,no,N,63,,120654,2366,HEC
64,,SING,CBC,HBC2,no,N,64,,120654,2366,HEC
65,,SING,CBC,HBC3,no,N,65,,120654,2366,HEC
66,,SING,ND,C1D,yes,N,66,,120654,2366,HEC
67,,SING,ND,C4D,yes,N,67,,120654,2366,HEC
68,,DOUB,C1D,C2D,yes,N,68,,120654,2366,HEC
69,,SING,C2D,C3D,yes,N,69,,120654,2366,HEC
70,,SING,C2D,CMD,no,N,70,,120654,2366,HEC
71,,DOUB,C3D,C4D,yes,N,71,,120654,2366,HEC
72,,SING,C3D,CAD,no,N,72,,120654,2366,HEC
73,,SING,CMD,HMD1,no,N,73,,120654,2366,HEC
74,,SING,CMD,HMD2,no,N,74,,120654,2366,HEC
75,,SING,CMD,HMD3,no,N,75,,120654,2366,HEC
2,,SING,N,H,,,,,240394,6146,DHB_2
76,,SING,CAD,CBD,no,N,76,,120654,2366,HEC
77,,SING,CAD,HAD1,no,N,77,,120654,2366,HEC
78,,SING,CAD,HAD2,no,N,78,,120654,2366,HEC
79,,SING,CBD,CGD,no,N,79,,120654,2366,HEC
80,,SING,CBD,HBD1,no,N,80,,120654,2366,HEC
81,,SING,CBD,HBD2,no,N,81,,120654,2366,HEC
82,,DOUB,CGD,O1D,no,N,82,,120654,2366,HEC
83,,SING,CGD,O2D,no,N,83,,120654,2366,HEC
84,,SING,O2D,H2D,no,N,84,,120654,2366,HEC
1,,SING,C1,N2,no,N,1,,120669,2367,ACC
2,,SING,C1,C3,no,N,2,,120669,2367,ACC
3,,DOUB,C1,O6,no,N,3,,120669,2367,ACC
4,,SING,N2,C4,no,N,4,,120669,2367,ACC
5,,SING,N2,H2,no,N,5,,120669,2367,ACC
6,,SING,C3,N7,no,N,6,,120669,2367,ACC
7,,SING,C3,C35,no,N,7,,120669,2367,ACC
8,,SING,C3,H3,no,N,8,,120669,2367,ACC
9,,SING,C4,C5,no,N,9,,120669,2367,ACC
10,,SING,C4,C23,no,N,10,,120669,2367,ACC
11,,SING,C4,H4,no,N,11,,120669,2367,ACC
12,,SING,C5,S41,no,N,12,,120669,2367,ACC
13,,SING,C5,H52,no,N,13,,120669,2367,ACC
14,,SING,C5,H51,no,N,14,,120669,2367,ACC
15,,SING,N7,C8,no,N,15,,120669,2367,ACC
16,,SING,N7,H7,no,N,16,,120669,2367,ACC
17,,SING,C8,C9,no,N,17,,120669,2367,ACC
18,,DOUB,C8,O27,no,N,18,,120669,2367,ACC
19,,SING,C9,C10,no,N,19,,120669,2367,ACC
20,,SING,C9,H92,no,N,20,,120669,2367,ACC
21,,SING,C9,H91,no,N,21,,120669,2367,ACC
22,,SING,C10,C13,no,N,22,,120669,2367,ACC
23,,SING,C10,H102,no,N,23,,120669,2367,ACC
24,,SING,C10,H101,no,N,24,,120669,2367,ACC
25,,SING,C13,C16,no,N,25,,120669,2367,ACC
26,,SING,C13,H132,no,N,26,,120669,2367,ACC
27,,SING,C13,H131,no,N,27,,120669,2367,ACC
28,,SING,C16,N19,no,N,28,,120669,2367,ACC
29,,SING,C16,C20,no,N,29,,120669,2367,ACC
30,,SING,C16,H16,no,N,30,,120669,2367,ACC
31,,SING,N19,H193,no,N,31,,120669,2367,ACC
32,,SING,N19,H192,no,N,32,,120669,2367,ACC
33,,SING,N19,H191,no,N,33,,120669,2367,ACC
34,,SING,C20,O21,no,N,34,,120669,2367,ACC
35,,DOUB,C20,O22,no,N,35,,120669,2367,ACC
36,,SING,O21,H21,no,N,36,,120669,2367,ACC
37,,SING,C23,O25,no,N,37,,120669,2367,ACC
38,,DOUB,C23,O26,no,N,38,,120669,2367,ACC
39,,SING,O25,H25,no,N,39,,120669,2367,ACC
40,,SING,C35,S37,no,N,40,,120669,2367,ACC
41,,SING,C35,H352,no,N,41,,120669,2367,ACC
42,,SING,C35,H351,no,N,42,,120669,2367,ACC
43,,SING,S37,H37,no,N,43,,120669,2367,ACC
44,,SING,S41,C42,no,N,44,,120669,2367,ACC
45,,SING,C42,H423,no,N,45,,120669,2367,ACC
46,,SING,C42,H422,no,N,46,,120669,2367,ACC
47,,SING,C42,H421,no,N,47,,120669,2367,ACC
1,,SING,FE,NA,no,N,1,,120670,2367,HEC
2,,SING,FE,NB,no,N,2,,120670,2367,HEC
3,,SING,FE,NC,no,N,3,,120670,2367,HEC
4,,SING,FE,ND,no,N,4,,120670,2367,HEC
5,,DOUB,CHA,C1A,no,N,5,,120670,2367,HEC
6,,SING,CHA,C4D,no,N,6,,120670,2367,HEC
7,,SING,CHA,HHA,no,N,7,,120670,2367,HEC
8,,DOUB,CHB,C4A,no,N,8,,120670,2367,HEC
9,,SING,CHB,C1B,no,N,9,,120670,2367,HEC
10,,SING,CHB,HHB,no,N,10,,120670,2367,HEC
11,,DOUB,CHC,C4B,no,N,11,,120670,2367,HEC
12,,SING,CHC,C1C,no,N,12,,120670,2367,HEC
13,,SING,CHC,HHC,no,N,13,,120670,2367,HEC
14,,DOUB,CHD,C4C,no,N,14,,120670,2367,HEC
15,,SING,CHD,C1D,no,N,15,,120670,2367,HEC
16,,SING,CHD,HHD,no,N,16,,120670,2367,HEC
17,,SING,NA,C1A,yes,N,17,,120670,2367,HEC
18,,SING,NA,C4A,yes,N,18,,120670,2367,HEC
19,,SING,C1A,C2A,yes,N,19,,120670,2367,HEC
20,,DOUB,C2A,C3A,yes,N,20,,120670,2367,HEC
21,,SING,C2A,CAA,no,N,21,,120670,2367,HEC
22,,SING,C3A,C4A,yes,N,22,,120670,2367,HEC
23,,SING,C3A,CMA,no,N,23,,120670,2367,HEC
24,,SING,CMA,HMA1,no,N,24,,120670,2367,HEC
25,,SING,CMA,HMA2,no,N,25,,120670,2367,HEC
26,,SING,CMA,HMA3,no,N,26,,120670,2367,HEC
27,,SING,CAA,CBA,no,N,27,,120670,2367,HEC
28,,SING,CAA,HAA1,no,N,28,,120670,2367,HEC
29,,SING,CAA,HAA2,no,N,29,,120670,2367,HEC
30,,SING,CBA,CGA,no,N,30,,120670,2367,HEC
31,,SING,CBA,HBA1,no,N,31,,120670,2367,HEC
32,,SING,CBA,HBA2,no,N,32,,120670,2367,HEC
33,,DOUB,CGA,O1A,no,N,33,,120670,2367,HEC
34,,SING,CGA,O2A,no,N,34,,120670,2367,HEC
35,,SING,O2A,H2A,no,N,35,,120670,2367,HEC
36,,SING,NB,C1B,yes,N,36,,120670,2367,HEC
37,,SING,NB,C4B,yes,N,37,,120670,2367,HEC
38,,DOUB,C1B,C2B,yes,N,38,,120670,2367,HEC
39,,SING,C2B,C3B,yes,N,39,,120670,2367,HEC
40,,SING,C2B,CMB,no,N,40,,120670,2367,HEC
41,,SING,C3B,C4B,yes,N,41,,120670,2367,HEC
42,,DOUB,C3B,CAB,no,E,42,,120670,2367,HEC
43,,SING,CMB,HMB1,no,N,43,,120670,2367,HEC
44,,SING,CMB,HMB2,no,N,44,,120670,2367,HEC
45,,SING,CMB,HMB3,no,N,45,,120670,2367,HEC
46,,SING,CAB,CBB,no,N,46,,120670,2367,HEC
47,,SING,CAB,HAB,no,N,47,,120670,2367,HEC
48,,SING,CBB,HBB1,no,N,48,,120670,2367,HEC
49,,SING,CBB,HBB2,no,N,49,,120670,2367,HEC
50,,SING,CBB,HBB3,no,N,50,,120670,2367,HEC
51,,SING,NC,C1C,yes,N,51,,120670,2367,HEC
52,,SING,NC,C4C,yes,N,52,,120670,2367,HEC
53,,DOUB,C1C,C2C,yes,N,53,,120670,2367,HEC
54,,SING,C2C,C3C,yes,N,54,,120670,2367,HEC
55,,SING,C2C,CMC,no,N,55,,120670,2367,HEC
56,,SING,C3C,C4C,yes,N,56,,120670,2367,HEC
57,,DOUB,C3C,CAC,no,E,57,,120670,2367,HEC
58,,SING,CMC,HMC1,no,N,58,,120670,2367,HEC
59,,SING,CMC,HMC2,no,N,59,,120670,2367,HEC
60,,SING,CMC,HMC3,no,N,60,,120670,2367,HEC
61,,SING,CAC,CBC,no,N,61,,120670,2367,HEC
62,,SING,CAC,HAC,no,N,62,,120670,2367,HEC
63,,SING,CBC,HBC1,no,N,63,,120670,2367,HEC
64,,SING,CBC,HBC2,no,N,64,,120670,2367,HEC
65,,SING,CBC,HBC3,no,N,65,,120670,2367,HEC
66,,SING,ND,C1D,yes,N,66,,120670,2367,HEC
67,,SING,ND,C4D,yes,N,67,,120670,2367,HEC
68,,DOUB,C1D,C2D,yes,N,68,,120670,2367,HEC
69,,SING,C2D,C3D,yes,N,69,,120670,2367,HEC
70,,SING,C2D,CMD,no,N,70,,120670,2367,HEC
71,,DOUB,C3D,C4D,yes,N,71,,120670,2367,HEC
72,,SING,C3D,CAD,no,N,72,,120670,2367,HEC
73,,SING,CMD,HMD1,no,N,73,,120670,2367,HEC
74,,SING,CMD,HMD2,no,N,74,,120670,2367,HEC
75,,SING,CMD,HMD3,no,N,75,,120670,2367,HEC
76,,SING,CAD,CBD,no,N,76,,120670,2367,HEC
77,,SING,CAD,HAD1,no,N,77,,120670,2367,HEC
78,,SING,CAD,HAD2,no,N,78,,120670,2367,HEC
79,,SING,CBD,CGD,no,N,79,,120670,2367,HEC
80,,SING,CBD,HBD1,no,N,80,,120670,2367,HEC
81,,SING,CBD,HBD2,no,N,81,,120670,2367,HEC
82,,DOUB,CGD,O1D,no,N,82,,120670,2367,HEC
83,,SING,CGD,O2D,no,N,83,,120670,2367,HEC
84,,SING,O2D,H2D,no,N,84,,120670,2367,HEC
1,,SING,C1,N2,no,N,1,,120685,2368,ACC
2,,SING,C1,C3,no,N,2,,120685,2368,ACC
3,,DOUB,C1,O6,no,N,3,,120685,2368,ACC
4,,SING,N2,C4,no,N,4,,120685,2368,ACC
5,,SING,N2,H2,no,N,5,,120685,2368,ACC
6,,SING,C3,N7,no,N,6,,120685,2368,ACC
7,,SING,C3,C35,no,N,7,,120685,2368,ACC
8,,SING,C3,H3,no,N,8,,120685,2368,ACC
9,,SING,C4,C5,no,N,9,,120685,2368,ACC
10,,SING,C4,C23,no,N,10,,120685,2368,ACC
11,,SING,C4,H4,no,N,11,,120685,2368,ACC
12,,SING,C5,S41,no,N,12,,120685,2368,ACC
13,,SING,C5,H52,no,N,13,,120685,2368,ACC
14,,SING,C5,H51,no,N,14,,120685,2368,ACC
15,,SING,N7,C8,no,N,15,,120685,2368,ACC
16,,SING,N7,H7,no,N,16,,120685,2368,ACC
17,,SING,C8,C9,no,N,17,,120685,2368,ACC
18,,DOUB,C8,O27,no,N,18,,120685,2368,ACC
19,,SING,C9,C10,no,N,19,,120685,2368,ACC
20,,SING,C9,H92,no,N,20,,120685,2368,ACC
21,,SING,C9,H91,no,N,21,,120685,2368,ACC
22,,SING,C10,C13,no,N,22,,120685,2368,ACC
23,,SING,C10,H102,no,N,23,,120685,2368,ACC
24,,SING,C10,H101,no,N,24,,120685,2368,ACC
25,,SING,C13,C16,no,N,25,,120685,2368,ACC
26,,SING,C13,H132,no,N,26,,120685,2368,ACC
27,,SING,C13,H131,no,N,27,,120685,2368,ACC
28,,SING,C16,N19,no,N,28,,120685,2368,ACC
29,,SING,C16,C20,no,N,29,,120685,2368,ACC
30,,SING,C16,H16,no,N,30,,120685,2368,ACC
31,,SING,N19,H193,no,N,31,,120685,2368,ACC
32,,SING,N19,H192,no,N,32,,120685,2368,ACC
33,,SING,N19,H191,no,N,33,,120685,2368,ACC
34,,SING,C20,O21,no,N,34,,120685,2368,ACC
35,,DOUB,C20,O22,no,N,35,,120685,2368,ACC
36,,SING,O21,H21,no,N,36,,120685,2368,ACC
37,,SING,C23,O25,no,N,37,,120685,2368,ACC
38,,DOUB,C23,O26,no,N,38,,120685,2368,ACC
39,,SING,O25,H25,no,N,39,,120685,2368,ACC
40,,SING,C35,S37,no,N,40,,120685,2368,ACC
41,,SING,C35,H352,no,N,41,,120685,2368,ACC
42,,SING,C35,H351,no,N,42,,120685,2368,ACC
43,,SING,S37,H37,no,N,43,,120685,2368,ACC
44,,SING,S41,C42,no,N,44,,120685,2368,ACC
45,,SING,C42,H423,no,N,45,,120685,2368,ACC
46,,SING,C42,H422,no,N,46,,120685,2368,ACC
47,,SING,C42,H421,no,N,47,,120685,2368,ACC
1,,SING,FE,NA,no,N,1,,120686,2368,HEC
2,,SING,FE,NB,no,N,2,,120686,2368,HEC
3,,SING,FE,NC,no,N,3,,120686,2368,HEC
4,,SING,FE,ND,no,N,4,,120686,2368,HEC
5,,DOUB,CHA,C1A,no,N,5,,120686,2368,HEC
6,,SING,CHA,C4D,no,N,6,,120686,2368,HEC
7,,SING,CHA,HHA,no,N,7,,120686,2368,HEC
8,,DOUB,CHB,C4A,no,N,8,,120686,2368,HEC
9,,SING,CHB,C1B,no,N,9,,120686,2368,HEC
10,,SING,CHB,HHB,no,N,10,,120686,2368,HEC
11,,DOUB,CHC,C4B,no,N,11,,120686,2368,HEC
12,,SING,CHC,C1C,no,N,12,,120686,2368,HEC
13,,SING,CHC,HHC,no,N,13,,120686,2368,HEC
14,,DOUB,CHD,C4C,no,N,14,,120686,2368,HEC
15,,SING,CHD,C1D,no,N,15,,120686,2368,HEC
16,,SING,CHD,HHD,no,N,16,,120686,2368,HEC
17,,SING,NA,C1A,yes,N,17,,120686,2368,HEC
18,,SING,NA,C4A,yes,N,18,,120686,2368,HEC
19,,SING,C1A,C2A,yes,N,19,,120686,2368,HEC
20,,DOUB,C2A,C3A,yes,N,20,,120686,2368,HEC
21,,SING,C2A,CAA,no,N,21,,120686,2368,HEC
22,,SING,C3A,C4A,yes,N,22,,120686,2368,HEC
23,,SING,C3A,CMA,no,N,23,,120686,2368,HEC
24,,SING,CMA,HMA1,no,N,24,,120686,2368,HEC
25,,SING,CMA,HMA2,no,N,25,,120686,2368,HEC
26,,SING,CMA,HMA3,no,N,26,,120686,2368,HEC
27,,SING,CAA,CBA,no,N,27,,120686,2368,HEC
28,,SING,CAA,HAA1,no,N,28,,120686,2368,HEC
29,,SING,CAA,HAA2,no,N,29,,120686,2368,HEC
30,,SING,CBA,CGA,no,N,30,,120686,2368,HEC
31,,SING,CBA,HBA1,no,N,31,,120686,2368,HEC
32,,SING,CBA,HBA2,no,N,32,,120686,2368,HEC
33,,DOUB,CGA,O1A,no,N,33,,120686,2368,HEC
34,,SING,CGA,O2A,no,N,34,,120686,2368,HEC
35,,SING,O2A,H2A,no,N,35,,120686,2368,HEC
36,,SING,NB,C1B,yes,N,36,,120686,2368,HEC
37,,SING,NB,C4B,yes,N,37,,120686,2368,HEC
38,,DOUB,C1B,C2B,yes,N,38,,120686,2368,HEC
39,,SING,C2B,C3B,yes,N,39,,120686,2368,HEC
40,,SING,C2B,CMB,no,N,40,,120686,2368,HEC
41,,SING,C3B,C4B,yes,N,41,,120686,2368,HEC
42,,DOUB,C3B,CAB,no,E,42,,120686,2368,HEC
43,,SING,CMB,HMB1,no,N,43,,120686,2368,HEC
44,,SING,CMB,HMB2,no,N,44,,120686,2368,HEC
45,,SING,CMB,HMB3,no,N,45,,120686,2368,HEC
46,,SING,CAB,CBB,no,N,46,,120686,2368,HEC
47,,SING,CAB,HAB,no,N,47,,120686,2368,HEC
48,,SING,CBB,HBB1,no,N,48,,120686,2368,HEC
49,,SING,CBB,HBB2,no,N,49,,120686,2368,HEC
50,,SING,CBB,HBB3,no,N,50,,120686,2368,HEC
51,,SING,NC,C1C,yes,N,51,,120686,2368,HEC
52,,SING,NC,C4C,yes,N,52,,120686,2368,HEC
53,,DOUB,C1C,C2C,yes,N,53,,120686,2368,HEC
54,,SING,C2C,C3C,yes,N,54,,120686,2368,HEC
55,,SING,C2C,CMC,no,N,55,,120686,2368,HEC
56,,SING,C3C,C4C,yes,N,56,,120686,2368,HEC
57,,DOUB,C3C,CAC,no,E,57,,120686,2368,HEC
58,,SING,CMC,HMC1,no,N,58,,120686,2368,HEC
59,,SING,CMC,HMC2,no,N,59,,120686,2368,HEC
60,,SING,CMC,HMC3,no,N,60,,120686,2368,HEC
61,,SING,CAC,CBC,no,N,61,,120686,2368,HEC
62,,SING,CAC,HAC,no,N,62,,120686,2368,HEC
63,,SING,CBC,HBC1,no,N,63,,120686,2368,HEC
64,,SING,CBC,HBC2,no,N,64,,120686,2368,HEC
65,,SING,CBC,HBC3,no,N,65,,120686,2368,HEC
66,,SING,ND,C1D,yes,N,66,,120686,2368,HEC
67,,SING,ND,C4D,yes,N,67,,120686,2368,HEC
68,,DOUB,C1D,C2D,yes,N,68,,120686,2368,HEC
69,,SING,C2D,C3D,yes,N,69,,120686,2368,HEC
70,,SING,C2D,CMD,no,N,70,,120686,2368,HEC
71,,DOUB,C3D,C4D,yes,N,71,,120686,2368,HEC
72,,SING,C3D,CAD,no,N,72,,120686,2368,HEC
73,,SING,CMD,HMD1,no,N,73,,120686,2368,HEC
74,,SING,CMD,HMD2,no,N,74,,120686,2368,HEC
75,,SING,CMD,HMD3,no,N,75,,120686,2368,HEC
76,,SING,CAD,CBD,no,N,76,,120686,2368,HEC
77,,SING,CAD,HAD1,no,N,77,,120686,2368,HEC
78,,SING,CAD,HAD2,no,N,78,,120686,2368,HEC
79,,SING,CBD,CGD,no,N,79,,120686,2368,HEC
80,,SING,CBD,HBD1,no,N,80,,120686,2368,HEC
81,,SING,CBD,HBD2,no,N,81,,120686,2368,HEC
82,,DOUB,CGD,O1D,no,N,82,,120686,2368,HEC
83,,SING,CGD,O2D,no,N,83,,120686,2368,HEC
84,,SING,O2D,H2D,no,N,84,,120686,2368,HEC
1,,SING,N,CA,no,N,1,,120789,24,NLE
2,,SING,N,H,no,N,2,,120789,24,NLE
3,,SING,N,HN2,no,N,3,,120789,24,NLE
4,,SING,CA,C,no,N,4,,120789,24,NLE
5,,SING,CA,CB,no,N,5,,120789,24,NLE
6,,SING,CA,HA,no,N,6,,120789,24,NLE
7,,DOUB,C,O,no,N,7,,120789,24,NLE
8,,SING,C,OXT,no,N,8,,120789,24,NLE
9,,SING,OXT,HXT,no,N,9,,120789,24,NLE
10,,SING,CB,CG,no,N,10,,120789,24,NLE
11,,SING,CB,HB2,no,N,11,,120789,24,NLE
12,,SING,CB,HB3,no,N,12,,120789,24,NLE
13,,SING,CG,CD,no,N,13,,120789,24,NLE
14,,SING,CG,HG2,no,N,14,,120789,24,NLE
15,,SING,CG,HG3,no,N,15,,120789,24,NLE
16,,SING,CD,CE,no,N,16,,120789,24,NLE
17,,SING,CD,HD2,no,N,17,,120789,24,NLE
18,,SING,CD,HD3,no,N,18,,120789,24,NLE
19,,SING,CE,HE1,no,N,19,,120789,24,NLE
20,,SING,CE,HE2,no,N,20,,120789,24,NLE
21,,SING,CE,HE3,no,N,21,,120789,24,NLE
1,,SING,N,CA,no,N,1,,120790,24,AAR
2,,SING,N,H,no,N,2,,120790,24,AAR
3,,SING,N,H2,no,N,3,,120790,24,AAR
4,,SING,CA,CB,no,N,4,,120790,24,AAR
5,,SING,CA,C,no,N,5,,120790,24,AAR
6,,SING,CA,HA,no,N,6,,120790,24,AAR
7,,SING,CB,CG,no,N,7,,120790,24,AAR
8,,SING,CB,HB2,no,N,8,,120790,24,AAR
9,,SING,CB,HB3,no,N,9,,120790,24,AAR
10,,SING,CG,CD,no,N,10,,120790,24,AAR
11,,SING,CG,HG2,no,N,11,,120790,24,AAR
12,,SING,CG,HG3,no,N,12,,120790,24,AAR
13,,SING,CD,NE,no,N,13,,120790,24,AAR
14,,SING,CD,HD2,no,N,14,,120790,24,AAR
15,,SING,CD,HD3,no,N,15,,120790,24,AAR
16,,SING,NE,CZ,no,N,16,,120790,24,AAR
17,,SING,NE,HE,no,N,17,,120790,24,AAR
18,,SING,CZ,NH1,no,N,18,,120790,24,AAR
19,,DOUB,CZ,NH2,no,N,19,,120790,24,AAR
20,,SING,NH1,HH11,no,N,20,,120790,24,AAR
21,,SING,NH1,HH12,no,N,21,,120790,24,AAR
22,,SING,NH2,HH21,no,N,22,,120790,24,AAR
23,,SING,NH2,HH22,no,N,23,,120790,24,AAR
24,,DOUB,C,O,no,N,24,,120790,24,AAR
25,,SING,C,NT,no,N,25,,120790,24,AAR
26,,SING,NT,HNT1,no,N,26,,120790,24,AAR
27,,SING,NT,HNT2,no,N,27,,120790,24,AAR
1,,SING,N,CA,no,N,1,,120951,2435,M3L
2,,SING,N,H,no,N,2,,120951,2435,M3L
3,,SING,N,H2,no,N,3,,120951,2435,M3L
4,,SING,CA,CB,no,N,4,,120951,2435,M3L
5,,SING,CA,C,no,N,5,,120951,2435,M3L
6,,SING,CA,HA,no,N,6,,120951,2435,M3L
7,,SING,CB,CG,no,N,7,,120951,2435,M3L
8,,SING,CB,HB2,no,N,8,,120951,2435,M3L
9,,SING,CB,HB3,no,N,9,,120951,2435,M3L
10,,SING,CG,CD,no,N,10,,120951,2435,M3L
11,,SING,CG,HG2,no,N,11,,120951,2435,M3L
12,,SING,CG,HG3,no,N,12,,120951,2435,M3L
13,,SING,CD,CE,no,N,13,,120951,2435,M3L
14,,SING,CD,HD2,no,N,14,,120951,2435,M3L
15,,SING,CD,HD3,no,N,15,,120951,2435,M3L
16,,SING,CE,NZ,no,N,16,,120951,2435,M3L
17,,SING,CE,HE2,no,N,17,,120951,2435,M3L
18,,SING,CE,HE3,no,N,18,,120951,2435,M3L
19,,SING,NZ,CM1,no,N,19,,120951,2435,M3L
20,,SING,NZ,CM2,no,N,20,,120951,2435,M3L
21,,SING,NZ,CM3,no,N,21,,120951,2435,M3L
22,,DOUB,C,O,no,N,22,,120951,2435,M3L
23,,SING,C,OXT,no,N,23,,120951,2435,M3L
24,,SING,OXT,HXT,no,N,24,,120951,2435,M3L
25,,SING,CM1,HM11,no,N,25,,120951,2435,M3L
26,,SING,CM1,HM12,no,N,26,,120951,2435,M3L
27,,SING,CM1,HM13,no,N,27,,120951,2435,M3L
28,,SING,CM2,HM21,no,N,28,,120951,2435,M3L
29,,SING,CM2,HM22,no,N,29,,120951,2435,M3L
30,,SING,CM2,HM23,no,N,30,,120951,2435,M3L
31,,SING,CM3,HM31,no,N,31,,120951,2435,M3L
32,,SING,CM3,HM32,no,N,32,,120951,2435,M3L
33,,SING,CM3,HM33,no,N,33,,120951,2435,M3L
1,,SING,N,CA,no,N,1,,120963,2436,M3L
2,,SING,N,H,no,N,2,,120963,2436,M3L
3,,SING,N,H2,no,N,3,,120963,2436,M3L
4,,SING,CA,CB,no,N,4,,120963,2436,M3L
5,,SING,CA,C,no,N,5,,120963,2436,M3L
6,,SING,CA,HA,no,N,6,,120963,2436,M3L
7,,SING,CB,CG,no,N,7,,120963,2436,M3L
8,,SING,CB,HB2,no,N,8,,120963,2436,M3L
9,,SING,CB,HB3,no,N,9,,120963,2436,M3L
10,,SING,CG,CD,no,N,10,,120963,2436,M3L
11,,SING,CG,HG2,no,N,11,,120963,2436,M3L
12,,SING,CG,HG3,no,N,12,,120963,2436,M3L
13,,SING,CD,CE,no,N,13,,120963,2436,M3L
14,,SING,CD,HD2,no,N,14,,120963,2436,M3L
15,,SING,CD,HD3,no,N,15,,120963,2436,M3L
16,,SING,CE,NZ,no,N,16,,120963,2436,M3L
17,,SING,CE,HE2,no,N,17,,120963,2436,M3L
18,,SING,CE,HE3,no,N,18,,120963,2436,M3L
19,,SING,NZ,CM1,no,N,19,,120963,2436,M3L
20,,SING,NZ,CM2,no,N,20,,120963,2436,M3L
21,,SING,NZ,CM3,no,N,21,,120963,2436,M3L
22,,DOUB,C,O,no,N,22,,120963,2436,M3L
23,,SING,C,OXT,no,N,23,,120963,2436,M3L
24,,SING,OXT,HXT,no,N,24,,120963,2436,M3L
25,,SING,CM1,HM11,no,N,25,,120963,2436,M3L
26,,SING,CM1,HM12,no,N,26,,120963,2436,M3L
27,,SING,CM1,HM13,no,N,27,,120963,2436,M3L
28,,SING,CM2,HM21,no,N,28,,120963,2436,M3L
29,,SING,CM2,HM22,no,N,29,,120963,2436,M3L
30,,SING,CM2,HM23,no,N,30,,120963,2436,M3L
31,,SING,CM3,HM31,no,N,31,,120963,2436,M3L
32,,SING,CM3,HM32,no,N,32,,120963,2436,M3L
33,,SING,CM3,HM33,no,N,33,,120963,2436,M3L
1,,SING,N,CA,no,N,1,,120975,2437,M3L
2,,SING,N,H,no,N,2,,120975,2437,M3L
3,,SING,N,H2,no,N,3,,120975,2437,M3L
4,,SING,CA,CB,no,N,4,,120975,2437,M3L
5,,SING,CA,C,no,N,5,,120975,2437,M3L
6,,SING,CA,HA,no,N,6,,120975,2437,M3L
7,,SING,CB,CG,no,N,7,,120975,2437,M3L
8,,SING,CB,HB2,no,N,8,,120975,2437,M3L
9,,SING,CB,HB3,no,N,9,,120975,2437,M3L
10,,SING,CG,CD,no,N,10,,120975,2437,M3L
11,,SING,CG,HG2,no,N,11,,120975,2437,M3L
12,,SING,CG,HG3,no,N,12,,120975,2437,M3L
13,,SING,CD,CE,no,N,13,,120975,2437,M3L
14,,SING,CD,HD2,no,N,14,,120975,2437,M3L
15,,SING,CD,HD3,no,N,15,,120975,2437,M3L
16,,SING,CE,NZ,no,N,16,,120975,2437,M3L
17,,SING,CE,HE2,no,N,17,,120975,2437,M3L
18,,SING,CE,HE3,no,N,18,,120975,2437,M3L
19,,SING,NZ,CM1,no,N,19,,120975,2437,M3L
20,,SING,NZ,CM2,no,N,20,,120975,2437,M3L
21,,SING,NZ,CM3,no,N,21,,120975,2437,M3L
22,,DOUB,C,O,no,N,22,,120975,2437,M3L
23,,SING,C,OXT,no,N,23,,120975,2437,M3L
24,,SING,OXT,HXT,no,N,24,,120975,2437,M3L
25,,SING,CM1,HM11,no,N,25,,120975,2437,M3L
26,,SING,CM1,HM12,no,N,26,,120975,2437,M3L
27,,SING,CM1,HM13,no,N,27,,120975,2437,M3L
28,,SING,CM2,HM21,no,N,28,,120975,2437,M3L
29,,SING,CM2,HM22,no,N,29,,120975,2437,M3L
30,,SING,CM2,HM23,no,N,30,,120975,2437,M3L
3,,DOUB,CA,CB,,,,,240394,6146,DHB_2
31,,SING,CM3,HM31,no,N,31,,120975,2437,M3L
32,,SING,CM3,HM32,no,N,32,,120975,2437,M3L
33,,SING,CM3,HM33,no,N,33,,120975,2437,M3L
1,,SING,N,HN1,no,N,1,,121078,245,NH2
2,,SING,N,HN2,no,N,2,,121078,245,NH2
1,,SING,FE,NA,no,N,1,,121246,2488,HEC
2,,SING,FE,NB,no,N,2,,121246,2488,HEC
3,,SING,FE,NC,no,N,3,,121246,2488,HEC
4,,SING,FE,ND,no,N,4,,121246,2488,HEC
5,,DOUB,CHA,C1A,no,N,5,,121246,2488,HEC
6,,SING,CHA,C4D,no,N,6,,121246,2488,HEC
7,,SING,CHA,HHA,no,N,7,,121246,2488,HEC
8,,DOUB,CHB,C4A,no,N,8,,121246,2488,HEC
9,,SING,CHB,C1B,no,N,9,,121246,2488,HEC
10,,SING,CHB,HHB,no,N,10,,121246,2488,HEC
11,,DOUB,CHC,C4B,no,N,11,,121246,2488,HEC
12,,SING,CHC,C1C,no,N,12,,121246,2488,HEC
13,,SING,CHC,HHC,no,N,13,,121246,2488,HEC
14,,DOUB,CHD,C4C,no,N,14,,121246,2488,HEC
15,,SING,CHD,C1D,no,N,15,,121246,2488,HEC
16,,SING,CHD,HHD,no,N,16,,121246,2488,HEC
17,,SING,NA,C1A,yes,N,17,,121246,2488,HEC
18,,SING,NA,C4A,yes,N,18,,121246,2488,HEC
19,,SING,C1A,C2A,yes,N,19,,121246,2488,HEC
20,,DOUB,C2A,C3A,yes,N,20,,121246,2488,HEC
21,,SING,C2A,CAA,no,N,21,,121246,2488,HEC
22,,SING,C3A,C4A,yes,N,22,,121246,2488,HEC
23,,SING,C3A,CMA,no,N,23,,121246,2488,HEC
24,,SING,CMA,HMA1,no,N,24,,121246,2488,HEC
25,,SING,CMA,HMA2,no,N,25,,121246,2488,HEC
26,,SING,CMA,HMA3,no,N,26,,121246,2488,HEC
27,,SING,CAA,CBA,no,N,27,,121246,2488,HEC
28,,SING,CAA,HAA1,no,N,28,,121246,2488,HEC
29,,SING,CAA,HAA2,no,N,29,,121246,2488,HEC
30,,SING,CBA,CGA,no,N,30,,121246,2488,HEC
31,,SING,CBA,HBA1,no,N,31,,121246,2488,HEC
32,,SING,CBA,HBA2,no,N,32,,121246,2488,HEC
33,,DOUB,CGA,O1A,no,N,33,,121246,2488,HEC
34,,SING,CGA,O2A,no,N,34,,121246,2488,HEC
35,,SING,O2A,H2A,no,N,35,,121246,2488,HEC
36,,SING,NB,C1B,yes,N,36,,121246,2488,HEC
37,,SING,NB,C4B,yes,N,37,,121246,2488,HEC
38,,DOUB,C1B,C2B,yes,N,38,,121246,2488,HEC
39,,SING,C2B,C3B,yes,N,39,,121246,2488,HEC
40,,SING,C2B,CMB,no,N,40,,121246,2488,HEC
41,,SING,C3B,C4B,yes,N,41,,121246,2488,HEC
42,,DOUB,C3B,CAB,no,E,42,,121246,2488,HEC
43,,SING,CMB,HMB1,no,N,43,,121246,2488,HEC
44,,SING,CMB,HMB2,no,N,44,,121246,2488,HEC
45,,SING,CMB,HMB3,no,N,45,,121246,2488,HEC
46,,SING,CAB,CBB,no,N,46,,121246,2488,HEC
47,,SING,CAB,HAB,no,N,47,,121246,2488,HEC
48,,SING,CBB,HBB1,no,N,48,,121246,2488,HEC
49,,SING,CBB,HBB2,no,N,49,,121246,2488,HEC
50,,SING,CBB,HBB3,no,N,50,,121246,2488,HEC
51,,SING,NC,C1C,yes,N,51,,121246,2488,HEC
52,,SING,NC,C4C,yes,N,52,,121246,2488,HEC
53,,DOUB,C1C,C2C,yes,N,53,,121246,2488,HEC
54,,SING,C2C,C3C,yes,N,54,,121246,2488,HEC
55,,SING,C2C,CMC,no,N,55,,121246,2488,HEC
56,,SING,C3C,C4C,yes,N,56,,121246,2488,HEC
57,,DOUB,C3C,CAC,no,E,57,,121246,2488,HEC
58,,SING,CMC,HMC1,no,N,58,,121246,2488,HEC
59,,SING,CMC,HMC2,no,N,59,,121246,2488,HEC
60,,SING,CMC,HMC3,no,N,60,,121246,2488,HEC
61,,SING,CAC,CBC,no,N,61,,121246,2488,HEC
62,,SING,CAC,HAC,no,N,62,,121246,2488,HEC
63,,SING,CBC,HBC1,no,N,63,,121246,2488,HEC
64,,SING,CBC,HBC2,no,N,64,,121246,2488,HEC
65,,SING,CBC,HBC3,no,N,65,,121246,2488,HEC
66,,SING,ND,C1D,yes,N,66,,121246,2488,HEC
67,,SING,ND,C4D,yes,N,67,,121246,2488,HEC
68,,DOUB,C1D,C2D,yes,N,68,,121246,2488,HEC
69,,SING,C2D,C3D,yes,N,69,,121246,2488,HEC
70,,SING,C2D,CMD,no,N,70,,121246,2488,HEC
71,,DOUB,C3D,C4D,yes,N,71,,121246,2488,HEC
72,,SING,C3D,CAD,no,N,72,,121246,2488,HEC
73,,SING,CMD,HMD1,no,N,73,,121246,2488,HEC
74,,SING,CMD,HMD2,no,N,74,,121246,2488,HEC
75,,SING,CMD,HMD3,no,N,75,,121246,2488,HEC
76,,SING,CAD,CBD,no,N,76,,121246,2488,HEC
77,,SING,CAD,HAD1,no,N,77,,121246,2488,HEC
78,,SING,CAD,HAD2,no,N,78,,121246,2488,HEC
79,,SING,CBD,CGD,no,N,79,,121246,2488,HEC
80,,SING,CBD,HBD1,no,N,80,,121246,2488,HEC
81,,SING,CBD,HBD2,no,N,81,,121246,2488,HEC
82,,DOUB,CGD,O1D,no,N,82,,121246,2488,HEC
83,,SING,CGD,O2D,no,N,83,,121246,2488,HEC
84,,SING,O2D,H2D,no,N,84,,121246,2488,HEC
1,,DOUB,O,C,no,N,1,,121271,249,LPD
2,,SING,C,N2,no,N,2,,121271,249,LPD
3,,SING,C,CA,no,N,3,,121271,249,LPD
4,,SING,N2,HN21,no,N,4,,121271,249,LPD
5,,SING,N2,HN22,no,N,5,,121271,249,LPD
6,,SING,CA,N,no,N,6,,121271,249,LPD
7,,SING,CA,CB,no,N,7,,121271,249,LPD
8,,SING,CA,HA,no,N,8,,121271,249,LPD
9,,SING,N,CD,no,N,9,,121271,249,LPD
10,,SING,N,H,no,N,10,,121271,249,LPD
11,,SING,CD,CG,no,N,11,,121271,249,LPD
12,,SING,CD,HD3,no,N,12,,121271,249,LPD
13,,SING,CD,HD2,no,N,13,,121271,249,LPD
14,,SING,CG,CB,no,N,14,,121271,249,LPD
15,,SING,CG,HG3,no,N,15,,121271,249,LPD
16,,SING,CG,HG2,no,N,16,,121271,249,LPD
17,,SING,CB,HB2,no,N,17,,121271,249,LPD
18,,SING,CB,HB3,no,N,18,,121271,249,LPD
1,,SING,N,CA,no,N,1,,121311,250,CY3
2,,SING,N,H,no,N,2,,121311,250,CY3
3,,SING,N,H2,no,N,3,,121311,250,CY3
4,,SING,CA,C,no,N,4,,121311,250,CY3
5,,SING,CA,CB,no,N,5,,121311,250,CY3
6,,SING,CA,HA,no,N,6,,121311,250,CY3
7,,DOUB,C,O,no,N,7,,121311,250,CY3
8,,SING,C,N1,no,N,8,,121311,250,CY3
9,,SING,CB,SG,no,N,9,,121311,250,CY3
10,,SING,CB,HB2,no,N,10,,121311,250,CY3
11,,SING,CB,HB3,no,N,11,,121311,250,CY3
12,,SING,SG,HG,no,N,12,,121311,250,CY3
13,,SING,N1,HN11,no,N,13,,121311,250,CY3
14,,SING,N1,HN12,no,N,14,,121311,250,CY3
1,,SING,O01,C01,no,N,1,,121417,25005,TA1
2,,SING,O01,H011,no,N,2,,121417,25005,TA1
3,,SING,C01,C02,no,N,3,,121417,25005,TA1
4,,SING,C01,C43,no,N,4,,121417,25005,TA1
5,,SING,C01,C45,no,N,5,,121417,25005,TA1
6,,SING,C02,O02,no,N,6,,121417,25005,TA1
7,,SING,C02,C10,no,N,7,,121417,25005,TA1
8,,SING,C02,H021,no,N,8,,121417,25005,TA1
9,,SING,O02,C03,no,N,9,,121417,25005,TA1
10,,DOUB,C03,O03,no,N,10,,121417,25005,TA1
11,,SING,C03,C04,no,N,11,,121417,25005,TA1
12,,DOUB,C04,C05,yes,N,12,,121417,25005,TA1
13,,SING,C04,C09,yes,N,13,,121417,25005,TA1
14,,SING,C05,C06,yes,N,14,,121417,25005,TA1
15,,SING,C05,H051,no,N,15,,121417,25005,TA1
16,,DOUB,C06,C07,yes,N,16,,121417,25005,TA1
17,,SING,C06,H061,no,N,17,,121417,25005,TA1
18,,SING,C07,C08,yes,N,18,,121417,25005,TA1
19,,SING,C07,HC71,no,N,19,,121417,25005,TA1
20,,DOUB,C08,C09,yes,N,20,,121417,25005,TA1
21,,SING,C08,H081,no,N,21,,121417,25005,TA1
22,,SING,C09,H091,no,N,22,,121417,25005,TA1
23,,SING,C10,C11,no,N,23,,121417,25005,TA1
24,,SING,C10,C18,no,N,24,,121417,25005,TA1
25,,SING,C10,H101,no,N,25,,121417,25005,TA1
26,,SING,C11,O04,no,N,26,,121417,25005,TA1
27,,SING,C11,C14,no,N,27,,121417,25005,TA1
28,,SING,C11,C15,no,N,28,,121417,25005,TA1
29,,SING,O04,C12,no,N,29,,121417,25005,TA1
30,,DOUB,C12,O05,no,N,30,,121417,25005,TA1
31,,SING,C12,C13,no,N,31,,121417,25005,TA1
32,,SING,C13,H131,no,N,32,,121417,25005,TA1
33,,SING,C13,H132,no,N,33,,121417,25005,TA1
34,,SING,C13,H133,no,N,34,,121417,25005,TA1
35,,SING,C14,O06,no,N,35,,121417,25005,TA1
36,,SING,C14,H141,no,N,36,,121417,25005,TA1
37,,SING,C14,H142,no,N,37,,121417,25005,TA1
38,,SING,O06,C15,no,N,38,,121417,25005,TA1
39,,SING,C15,C16,no,N,39,,121417,25005,TA1
40,,SING,C15,H151,no,N,40,,121417,25005,TA1
41,,SING,C16,C17,no,N,41,,121417,25005,TA1
42,,SING,C16,H161,no,N,42,,121417,25005,TA1
43,,SING,C16,H162,no,N,43,,121417,25005,TA1
44,,SING,C17,O07,no,N,44,,121417,25005,TA1
45,,SING,C17,C18,no,N,45,,121417,25005,TA1
46,,SING,C17,H171,no,N,46,,121417,25005,TA1
47,,SING,O07,H071,no,N,47,,121417,25005,TA1
48,,SING,C18,C19,no,N,48,,121417,25005,TA1
49,,SING,C18,C20,no,N,49,,121417,25005,TA1
50,,SING,C19,H191,no,N,50,,121417,25005,TA1
51,,SING,C19,H192,no,N,51,,121417,25005,TA1
52,,SING,C19,H193,no,N,52,,121417,25005,TA1
53,,DOUB,C20,O08,no,N,53,,121417,25005,TA1
54,,SING,C20,C21,no,N,54,,121417,25005,TA1
55,,SING,C21,O09,no,N,55,,121417,25005,TA1
56,,SING,C21,C24,no,N,56,,121417,25005,TA1
57,,SING,C21,H211,no,N,57,,121417,25005,TA1
58,,SING,O09,C22,no,N,58,,121417,25005,TA1
59,,DOUB,C22,O10,no,N,59,,121417,25005,TA1
60,,SING,C22,C23,no,N,60,,121417,25005,TA1
61,,SING,C23,H231,no,N,61,,121417,25005,TA1
62,,SING,C23,H232,no,N,62,,121417,25005,TA1
63,,SING,C23,H233,no,N,63,,121417,25005,TA1
64,,DOUB,C24,C25,no,N,64,,121417,25005,TA1
65,,SING,C24,C45,no,N,65,,121417,25005,TA1
66,,SING,C25,C26,no,N,66,,121417,25005,TA1
67,,SING,C25,C44,no,N,67,,121417,25005,TA1
68,,SING,C26,O11,no,N,68,,121417,25005,TA1
69,,SING,C26,C43,no,N,69,,121417,25005,TA1
70,,SING,C26,H261,no,N,70,,121417,25005,TA1
71,,SING,O11,C27,no,N,71,,121417,25005,TA1
72,,DOUB,C27,O12,no,N,72,,121417,25005,TA1
73,,SING,C27,C28,no,N,73,,121417,25005,TA1
74,,SING,C28,O13,no,N,74,,121417,25005,TA1
75,,SING,C28,C29,no,N,75,,121417,25005,TA1
76,,SING,C28,H281,no,N,76,,121417,25005,TA1
77,,SING,O13,HO11,no,N,77,,121417,25005,TA1
78,,SING,C29,N01,no,N,78,,121417,25005,TA1
79,,SING,C29,C37,no,N,79,,121417,25005,TA1
80,,SING,C29,H291,no,N,80,,121417,25005,TA1
81,,SING,N01,C30,no,N,81,,121417,25005,TA1
4,,SING,CA,C,,,,,240394,6146,DHB_2
82,,SING,N01,HN01,no,N,82,,121417,25005,TA1
83,,DOUB,C30,O14,no,N,83,,121417,25005,TA1
84,,SING,C30,C31,no,N,84,,121417,25005,TA1
85,,DOUB,C31,C32,yes,N,85,,121417,25005,TA1
86,,SING,C31,C36,yes,N,86,,121417,25005,TA1
87,,SING,C32,C33,yes,N,87,,121417,25005,TA1
88,,SING,C32,H321,no,N,88,,121417,25005,TA1
89,,DOUB,C33,C34,yes,N,89,,121417,25005,TA1
90,,SING,C33,H331,no,N,90,,121417,25005,TA1
91,,SING,C34,C35,yes,N,91,,121417,25005,TA1
92,,SING,C34,H341,no,N,92,,121417,25005,TA1
93,,DOUB,C35,C36,yes,N,93,,121417,25005,TA1
94,,SING,C35,H351,no,N,94,,121417,25005,TA1
95,,SING,C36,H361,no,N,95,,121417,25005,TA1
96,,DOUB,C37,C38,yes,N,96,,121417,25005,TA1
97,,SING,C37,C42,yes,N,97,,121417,25005,TA1
98,,SING,C38,C39,yes,N,98,,121417,25005,TA1
99,,SING,C38,H381,no,N,99,,121417,25005,TA1
100,,DOUB,C39,C40,yes,N,100,,121417,25005,TA1
101,,SING,C39,H391,no,N,101,,121417,25005,TA1
102,,SING,C40,C41,yes,N,102,,121417,25005,TA1
103,,SING,C40,H401,no,N,103,,121417,25005,TA1
104,,DOUB,C41,C42,yes,N,104,,121417,25005,TA1
105,,SING,C41,H411,no,N,105,,121417,25005,TA1
106,,SING,C42,H421,no,N,106,,121417,25005,TA1
107,,SING,C43,H431,no,N,107,,121417,25005,TA1
108,,SING,C43,H432,no,N,108,,121417,25005,TA1
109,,SING,C44,H441,no,N,109,,121417,25005,TA1
110,,SING,C44,H442,no,N,110,,121417,25005,TA1
111,,SING,C44,H443,no,N,111,,121417,25005,TA1
112,,SING,C45,C46,no,N,112,,121417,25005,TA1
113,,SING,C45,C47,no,N,113,,121417,25005,TA1
114,,SING,C46,H461,no,N,114,,121417,25005,TA1
115,,SING,C46,H462,no,N,115,,121417,25005,TA1
116,,SING,C46,H463,no,N,116,,121417,25005,TA1
117,,SING,C47,H471,no,N,117,,121417,25005,TA1
118,,SING,C47,H472,no,N,118,,121417,25005,TA1
119,,SING,C47,H473,no,N,119,,121417,25005,TA1
1,,DOUB,PG,O1G,no,N,1,,121418,25005,GTP
2,,SING,PG,O2G,no,N,2,,121418,25005,GTP
3,,SING,PG,O3G,no,N,3,,121418,25005,GTP
4,,SING,PG,O3B,no,N,4,,121418,25005,GTP
5,,SING,O2G,HOG2,no,N,5,,121418,25005,GTP
6,,SING,O3G,HOG3,no,N,6,,121418,25005,GTP
7,,SING,O3B,PB,no,N,7,,121418,25005,GTP
8,,DOUB,PB,O1B,no,N,8,,121418,25005,GTP
9,,SING,PB,O2B,no,N,9,,121418,25005,GTP
10,,SING,PB,O3A,no,N,10,,121418,25005,GTP
11,,SING,O2B,HOB2,no,N,11,,121418,25005,GTP
12,,SING,O3A,PA,no,N,12,,121418,25005,GTP
13,,DOUB,PA,O1A,no,N,13,,121418,25005,GTP
14,,SING,PA,O2A,no,N,14,,121418,25005,GTP
15,,SING,PA,O5',no,N,15,,121418,25005,GTP
16,,SING,O2A,HOA2,no,N,16,,121418,25005,GTP
17,,SING,O5',C5',no,N,17,,121418,25005,GTP
18,,SING,C5',C4',no,N,18,,121418,25005,GTP
19,,SING,C5',H5',no,N,19,,121418,25005,GTP
20,,SING,C5',H5'',no,N,20,,121418,25005,GTP
21,,SING,C4',O4',no,N,21,,121418,25005,GTP
22,,SING,C4',C3',no,N,22,,121418,25005,GTP
23,,SING,C4',H4',no,N,23,,121418,25005,GTP
24,,SING,O4',C1',no,N,24,,121418,25005,GTP
25,,SING,C3',O3',no,N,25,,121418,25005,GTP
26,,SING,C3',C2',no,N,26,,121418,25005,GTP
27,,SING,C3',H3',no,N,27,,121418,25005,GTP
28,,SING,O3',HO3',no,N,28,,121418,25005,GTP
29,,SING,C2',O2',no,N,29,,121418,25005,GTP
30,,SING,C2',C1',no,N,30,,121418,25005,GTP
31,,SING,C2',H2',no,N,31,,121418,25005,GTP
32,,SING,O2',HO2',no,N,32,,121418,25005,GTP
33,,SING,C1',N9,no,N,33,,121418,25005,GTP
34,,SING,C1',H1',no,N,34,,121418,25005,GTP
35,,SING,N9,C8,yes,N,35,,121418,25005,GTP
36,,SING,N9,C4,yes,N,36,,121418,25005,GTP
37,,DOUB,C8,N7,yes,N,37,,121418,25005,GTP
38,,SING,C8,H8,no,N,38,,121418,25005,GTP
39,,SING,N7,C5,yes,N,39,,121418,25005,GTP
40,,SING,C5,C6,no,N,40,,121418,25005,GTP
41,,DOUB,C5,C4,yes,N,41,,121418,25005,GTP
42,,DOUB,C6,O6,no,N,42,,121418,25005,GTP
43,,SING,C6,N1,no,N,43,,121418,25005,GTP
44,,SING,N1,C2,no,N,44,,121418,25005,GTP
45,,SING,N1,HN1,no,N,45,,121418,25005,GTP
46,,SING,C2,N2,no,N,46,,121418,25005,GTP
47,,DOUB,C2,N3,no,N,47,,121418,25005,GTP
48,,SING,N2,HN21,no,N,48,,121418,25005,GTP
49,,SING,N2,HN22,no,N,49,,121418,25005,GTP
50,,SING,N3,C4,no,N,50,,121418,25005,GTP
1,,SING,N1,C2,yes,N,1,,121622,25019,FOL
2,,SING,N1,C8A,yes,N,2,,121622,25019,FOL
3,,SING,N1,HN1,no,N,3,,121622,25019,FOL
4,,SING,C2,NA2,no,N,4,,121622,25019,FOL
5,,DOUB,C2,N3,yes,N,5,,121622,25019,FOL
6,,SING,NA2,HN21,no,N,6,,121622,25019,FOL
7,,SING,NA2,HN22,no,N,7,,121622,25019,FOL
8,,SING,N3,C4,yes,N,8,,121622,25019,FOL
9,,DOUB,C4,O4,no,N,9,,121622,25019,FOL
10,,SING,C4,C4A,yes,N,10,,121622,25019,FOL
11,,SING,C4A,N5,yes,N,11,,121622,25019,FOL
12,,DOUB,C4A,C8A,yes,N,12,,121622,25019,FOL
5,,SING,CB,HB2,,,,,240394,6146,DHB_2
13,,DOUB,N5,C6,yes,N,13,,121622,25019,FOL
14,,SING,C6,C7,yes,N,14,,121622,25019,FOL
15,,SING,C6,C9,no,N,15,,121622,25019,FOL
16,,DOUB,C7,N8,yes,N,16,,121622,25019,FOL
17,,SING,C7,H7,no,N,17,,121622,25019,FOL
18,,SING,N8,C8A,yes,N,18,,121622,25019,FOL
19,,SING,C9,N10,no,N,19,,121622,25019,FOL
20,,SING,C9,H91,no,N,20,,121622,25019,FOL
21,,SING,C9,H92,no,N,21,,121622,25019,FOL
22,,SING,N10,C14,no,N,22,,121622,25019,FOL
23,,SING,N10,HN0,no,N,23,,121622,25019,FOL
24,,DOUB,C11,C12,yes,N,24,,121622,25019,FOL
25,,SING,C11,C16,yes,N,25,,121622,25019,FOL
26,,SING,C11,C,no,N,26,,121622,25019,FOL
27,,SING,C12,C13,yes,N,27,,121622,25019,FOL
28,,SING,C12,H12,no,N,28,,121622,25019,FOL
29,,DOUB,C13,C14,yes,N,29,,121622,25019,FOL
30,,SING,C13,H13,no,N,30,,121622,25019,FOL
31,,SING,C14,C15,yes,N,31,,121622,25019,FOL
32,,DOUB,C15,C16,yes,N,32,,121622,25019,FOL
33,,SING,C15,H15,no,N,33,,121622,25019,FOL
34,,SING,C16,H16,no,N,34,,121622,25019,FOL
35,,DOUB,C,O,no,N,35,,121622,25019,FOL
36,,SING,C,N,no,N,36,,121622,25019,FOL
37,,SING,N,CA,no,N,37,,121622,25019,FOL
38,,SING,N,HN,no,N,38,,121622,25019,FOL
39,,SING,CA,CB,no,N,39,,121622,25019,FOL
40,,SING,CA,CT,no,N,40,,121622,25019,FOL
41,,SING,CA,HA,no,N,41,,121622,25019,FOL
42,,SING,CB,CG,no,N,42,,121622,25019,FOL
43,,SING,CB,HB1,no,N,43,,121622,25019,FOL
44,,SING,CB,HB2,no,N,44,,121622,25019,FOL
45,,SING,CG,CD,no,N,45,,121622,25019,FOL
46,,SING,CG,HG1,no,N,46,,121622,25019,FOL
47,,SING,CG,HG2,no,N,47,,121622,25019,FOL
48,,DOUB,CD,OE1,no,N,48,,121622,25019,FOL
49,,SING,CD,OE2,no,N,49,,121622,25019,FOL
50,,SING,OE2,HOE2,no,N,50,,121622,25019,FOL
51,,DOUB,CT,O1,no,N,51,,121622,25019,FOL
52,,SING,CT,O2,no,N,52,,121622,25019,FOL
53,,SING,O2,HO2,no,N,53,,121622,25019,FOL
1,,DOUB,C,O,no,N,1,,121667,25022,ACE
2,,SING,C,CH3,no,N,2,,121667,25022,ACE
3,,SING,C,H,no,N,3,,121667,25022,ACE
4,,SING,CH3,H1,no,N,4,,121667,25022,ACE
5,,SING,CH3,H2,no,N,5,,121667,25022,ACE
6,,SING,CH3,H3,no,N,6,,121667,25022,ACE
1,,DOUB,P,O1P,no,N,1,,121668,25022,AMD
2,,SING,P,O2P,no,N,2,,121668,25022,AMD
3,,SING,P,O3P,no,N,3,,121668,25022,AMD
4,,SING,P,O5',no,N,4,,121668,25022,AMD
5,,SING,O2P,HOP2,no,N,5,,121668,25022,AMD
6,,SING,O3P,C,no,N,6,,121668,25022,AMD
7,,SING,O5',C5',no,N,7,,121668,25022,AMD
8,,SING,C5',C4',no,N,8,,121668,25022,AMD
9,,SING,C5',H5'1,no,N,9,,121668,25022,AMD
10,,SING,C5',H5'2,no,N,10,,121668,25022,AMD
11,,SING,C4',O4',no,N,11,,121668,25022,AMD
12,,SING,C4',C3',no,N,12,,121668,25022,AMD
13,,SING,C4',H4',no,N,13,,121668,25022,AMD
14,,SING,O4',C1',no,N,14,,121668,25022,AMD
15,,SING,C1',N9,no,N,15,,121668,25022,AMD
16,,SING,C1',C2',no,N,16,,121668,25022,AMD
17,,SING,C1',H1',no,N,17,,121668,25022,AMD
18,,SING,N9,C4,yes,N,18,,121668,25022,AMD
19,,SING,N9,C8,yes,N,19,,121668,25022,AMD
20,,SING,C4,N3,yes,N,20,,121668,25022,AMD
21,,DOUB,C4,C5,yes,N,21,,121668,25022,AMD
22,,DOUB,N3,C2,yes,N,22,,121668,25022,AMD
23,,SING,C2,N1,yes,N,23,,121668,25022,AMD
24,,SING,C2,H2,no,N,24,,121668,25022,AMD
25,,DOUB,N1,C6,yes,N,25,,121668,25022,AMD
26,,SING,C6,N6,no,N,26,,121668,25022,AMD
27,,SING,C6,C5,yes,N,27,,121668,25022,AMD
28,,SING,N6,H61,no,N,28,,121668,25022,AMD
29,,SING,N6,H62,no,N,29,,121668,25022,AMD
30,,SING,C5,N7,yes,N,30,,121668,25022,AMD
31,,DOUB,N7,C8,yes,N,31,,121668,25022,AMD
32,,SING,C8,H8,no,N,32,,121668,25022,AMD
33,,SING,C2',C3',no,N,33,,121668,25022,AMD
34,,SING,C2',H2'1,no,N,34,,121668,25022,AMD
35,,SING,C2',H2'2,no,N,35,,121668,25022,AMD
36,,SING,C3',O3',no,N,36,,121668,25022,AMD
37,,SING,C3',H3',no,N,37,,121668,25022,AMD
38,,SING,O3',HO'3,no,N,38,,121668,25022,AMD
39,,SING,N,CA,no,N,39,,121668,25022,AMD
40,,SING,N,H,no,N,40,,121668,25022,AMD
41,,SING,N,HN2,no,N,41,,121668,25022,AMD
42,,SING,CA,CB,no,N,42,,121668,25022,AMD
43,,SING,CA,C,no,N,43,,121668,25022,AMD
44,,SING,CA,HA,no,N,44,,121668,25022,AMD
45,,SING,CB,CG,no,N,45,,121668,25022,AMD
46,,SING,CB,HB1,no,N,46,,121668,25022,AMD
47,,SING,CB,HB2,no,N,47,,121668,25022,AMD
48,,DOUB,CG,OD1,no,N,48,,121668,25022,AMD
49,,SING,CG,OD2,no,N,49,,121668,25022,AMD
50,,SING,OD2,HD2,no,N,50,,121668,25022,AMD
51,,DOUB,C,O,no,N,51,,121668,25022,AMD
1,,SING,N,CA,no,N,1,,122149,25048,HYP
2,,SING,N,CD,no,N,2,,122149,25048,HYP
3,,SING,N,H,no,N,3,,122149,25048,HYP
4,,SING,CA,C,no,N,4,,122149,25048,HYP
5,,SING,CA,CB,no,N,5,,122149,25048,HYP
6,,SING,CA,HA,no,N,6,,122149,25048,HYP
7,,DOUB,C,O,no,N,7,,122149,25048,HYP
8,,SING,C,OXT,no,N,8,,122149,25048,HYP
9,,SING,CB,CG,no,N,9,,122149,25048,HYP
10,,SING,CB,HB2,no,N,10,,122149,25048,HYP
11,,SING,CB,HB3,no,N,11,,122149,25048,HYP
12,,SING,CG,CD,no,N,12,,122149,25048,HYP
13,,SING,CG,OD1,no,N,13,,122149,25048,HYP
14,,SING,CG,HG,no,N,14,,122149,25048,HYP
15,,SING,CD,HD22,no,N,15,,122149,25048,HYP
16,,SING,CD,HD23,no,N,16,,122149,25048,HYP
17,,SING,OD1,HD1,no,N,17,,122149,25048,HYP
18,,SING,OXT,HXT,no,N,18,,122149,25048,HYP
1,,SING,O23,P24,no,N,1,,122369,25065,PNS
2,,SING,O23,HOP1,no,N,2,,122369,25065,PNS
3,,SING,P24,O25,no,N,3,,122369,25065,PNS
4,,DOUB,P24,O26,no,N,4,,122369,25065,PNS
5,,SING,P24,O27,no,N,5,,122369,25065,PNS
6,,SING,O25,HOP2,no,N,6,,122369,25065,PNS
7,,SING,O27,C28,no,N,7,,122369,25065,PNS
8,,SING,C28,C29,no,N,8,,122369,25065,PNS
9,,SING,C28,H282,no,N,9,,122369,25065,PNS
10,,SING,C28,H281,no,N,10,,122369,25065,PNS
11,,SING,C29,C30,no,N,11,,122369,25065,PNS
12,,SING,C29,C31,no,N,12,,122369,25065,PNS
13,,SING,C29,C32,no,N,13,,122369,25065,PNS
14,,SING,C30,H303,no,N,14,,122369,25065,PNS
15,,SING,C30,H302,no,N,15,,122369,25065,PNS
16,,SING,C30,H301,no,N,16,,122369,25065,PNS
17,,SING,C31,H313,no,N,17,,122369,25065,PNS
18,,SING,C31,H312,no,N,18,,122369,25065,PNS
19,,SING,C31,H311,no,N,19,,122369,25065,PNS
20,,SING,C32,O33,no,N,20,,122369,25065,PNS
21,,SING,C32,C34,no,N,21,,122369,25065,PNS
22,,SING,C32,H32,no,N,22,,122369,25065,PNS
23,,SING,O33,H33,no,N,23,,122369,25065,PNS
24,,DOUB,C34,O35,no,N,24,,122369,25065,PNS
25,,SING,C34,N36,no,N,25,,122369,25065,PNS
26,,SING,N36,C37,no,N,26,,122369,25065,PNS
27,,SING,N36,H36,no,N,27,,122369,25065,PNS
28,,SING,C37,C38,no,N,28,,122369,25065,PNS
29,,SING,C37,H372,no,N,29,,122369,25065,PNS
30,,SING,C37,H371,no,N,30,,122369,25065,PNS
31,,SING,C38,C39,no,N,31,,122369,25065,PNS
32,,SING,C38,H382,no,N,32,,122369,25065,PNS
33,,SING,C38,H381,no,N,33,,122369,25065,PNS
34,,DOUB,C39,O40,no,N,34,,122369,25065,PNS
35,,SING,C39,N41,no,N,35,,122369,25065,PNS
36,,SING,N41,C42,no,N,36,,122369,25065,PNS
37,,SING,N41,H41,no,N,37,,122369,25065,PNS
38,,SING,C42,C43,no,N,38,,122369,25065,PNS
39,,SING,C42,H422,no,N,39,,122369,25065,PNS
40,,SING,C42,H421,no,N,40,,122369,25065,PNS
41,,SING,C43,S44,no,N,41,,122369,25065,PNS
42,,SING,C43,H431,no,N,42,,122369,25065,PNS
43,,SING,C43,H432,no,N,43,,122369,25065,PNS
44,,SING,S44,H44,no,N,44,,122369,25065,PNS
1,,SING,N,CA,no,N,1,,122644,25082,PTR
2,,SING,N,H,no,N,2,,122644,25082,PTR
3,,SING,N,HN2,no,N,3,,122644,25082,PTR
4,,SING,CA,C,no,N,4,,122644,25082,PTR
5,,SING,CA,CB,no,N,5,,122644,25082,PTR
6,,SING,CA,HA,no,N,6,,122644,25082,PTR
7,,DOUB,C,O,no,N,7,,122644,25082,PTR
8,,SING,C,OXT,no,N,8,,122644,25082,PTR
9,,SING,OXT,HXT,no,N,9,,122644,25082,PTR
10,,SING,CB,CG,no,N,10,,122644,25082,PTR
11,,SING,CB,HB2,no,N,11,,122644,25082,PTR
12,,SING,CB,HB3,no,N,12,,122644,25082,PTR
13,,DOUB,CG,CD1,yes,N,13,,122644,25082,PTR
14,,SING,CG,CD2,yes,N,14,,122644,25082,PTR
15,,SING,CD1,CE1,yes,N,15,,122644,25082,PTR
16,,SING,CD1,HD1,no,N,16,,122644,25082,PTR
17,,DOUB,CD2,CE2,yes,N,17,,122644,25082,PTR
18,,SING,CD2,HD2,no,N,18,,122644,25082,PTR
19,,DOUB,CE1,CZ,yes,N,19,,122644,25082,PTR
20,,SING,CE1,HE1,no,N,20,,122644,25082,PTR
21,,SING,CE2,CZ,yes,N,21,,122644,25082,PTR
22,,SING,CE2,HE2,no,N,22,,122644,25082,PTR
23,,SING,CZ,OH,no,N,23,,122644,25082,PTR
24,,SING,OH,P,no,N,24,,122644,25082,PTR
25,,DOUB,P,O1P,no,N,25,,122644,25082,PTR
26,,SING,P,O2P,no,N,26,,122644,25082,PTR
27,,SING,P,O3P,no,N,27,,122644,25082,PTR
28,,SING,O2P,HO2P,no,N,28,,122644,25082,PTR
29,,SING,O3P,HO3P,no,N,29,,122644,25082,PTR
1,,DOUB,C1,O1,no,N,1,,122730,25087,MYR
2,,SING,C1,O2,no,N,2,,122730,25087,MYR
3,,SING,C1,C2,no,N,3,,122730,25087,MYR
4,,SING,O2,HO2,no,N,4,,122730,25087,MYR
5,,SING,C2,C3,no,N,5,,122730,25087,MYR
6,,SING,C2,H21,no,N,6,,122730,25087,MYR
7,,SING,C2,H22,no,N,7,,122730,25087,MYR
8,,SING,C3,C4,no,N,8,,122730,25087,MYR
9,,SING,C3,H31,no,N,9,,122730,25087,MYR
10,,SING,C3,H32,no,N,10,,122730,25087,MYR
11,,SING,C4,C5,no,N,11,,122730,25087,MYR
12,,SING,C4,H41,no,N,12,,122730,25087,MYR
13,,SING,C4,H42,no,N,13,,122730,25087,MYR
14,,SING,C5,C6,no,N,14,,122730,25087,MYR
15,,SING,C5,H51,no,N,15,,122730,25087,MYR
16,,SING,C5,H52,no,N,16,,122730,25087,MYR
17,,SING,C6,C7,no,N,17,,122730,25087,MYR
18,,SING,C6,H61,no,N,18,,122730,25087,MYR
19,,SING,C6,H62,no,N,19,,122730,25087,MYR
20,,SING,C7,C8,no,N,20,,122730,25087,MYR
21,,SING,C7,H71,no,N,21,,122730,25087,MYR
22,,SING,C7,H72,no,N,22,,122730,25087,MYR
23,,SING,C8,C9,no,N,23,,122730,25087,MYR
24,,SING,C8,H81,no,N,24,,122730,25087,MYR
25,,SING,C8,H82,no,N,25,,122730,25087,MYR
26,,SING,C9,C10,no,N,26,,122730,25087,MYR
27,,SING,C9,H91,no,N,27,,122730,25087,MYR
28,,SING,C9,H92,no,N,28,,122730,25087,MYR
29,,SING,C10,C11,no,N,29,,122730,25087,MYR
30,,SING,C10,H101,no,N,30,,122730,25087,MYR
31,,SING,C10,H102,no,N,31,,122730,25087,MYR
32,,SING,C11,C12,no,N,32,,122730,25087,MYR
33,,SING,C11,H111,no,N,33,,122730,25087,MYR
34,,SING,C11,H112,no,N,34,,122730,25087,MYR
35,,SING,C12,C13,no,N,35,,122730,25087,MYR
36,,SING,C12,H121,no,N,36,,122730,25087,MYR
37,,SING,C12,H122,no,N,37,,122730,25087,MYR
38,,SING,C13,C14,no,N,38,,122730,25087,MYR
39,,SING,C13,H131,no,N,39,,122730,25087,MYR
40,,SING,C13,H132,no,N,40,,122730,25087,MYR
41,,SING,C14,H141,no,N,41,,122730,25087,MYR
42,,SING,C14,H142,no,N,42,,122730,25087,MYR
43,,SING,C14,H143,no,N,43,,122730,25087,MYR
1,,DOUB,C1,C2,yes,N,1,,122970,25107,QUE
2,,SING,C1,C6,yes,N,2,,122970,25107,QUE
3,,SING,C1,H1,no,N,3,,122970,25107,QUE
4,,SING,C2,C3,yes,N,4,,122970,25107,QUE
5,,SING,C2,O30,no,N,5,,122970,25107,QUE
6,,DOUB,C3,C4,yes,N,6,,122970,25107,QUE
7,,SING,C3,C9,yes,N,7,,122970,25107,QUE
8,,SING,C4,C5,yes,N,8,,122970,25107,QUE
9,,SING,C4,O12,yes,N,9,,122970,25107,QUE
10,,DOUB,C5,C6,yes,N,10,,122970,25107,QUE
11,,SING,C5,H5,no,N,11,,122970,25107,QUE
12,,SING,C6,O29,no,N,12,,122970,25107,QUE
13,,SING,C9,C10,yes,N,13,,122970,25107,QUE
14,,DOUB,C9,O13,no,N,14,,122970,25107,QUE
15,,DOUB,C10,C11,yes,N,15,,122970,25107,QUE
16,,SING,C10,O27,no,N,16,,122970,25107,QUE
17,,SING,C11,C14,yes,N,17,,122970,25107,QUE
18,,SING,C11,O12,yes,N,18,,122970,25107,QUE
19,,DOUB,C14,C15,yes,N,19,,122970,25107,QUE
20,,SING,C14,C19,yes,N,20,,122970,25107,QUE
21,,SING,C15,C16,yes,N,21,,122970,25107,QUE
22,,SING,C15,H15,no,N,22,,122970,25107,QUE
23,,DOUB,C16,C17,yes,N,23,,122970,25107,QUE
24,,SING,C16,H16,no,N,24,,122970,25107,QUE
25,,SING,C17,C18,yes,N,25,,122970,25107,QUE
26,,SING,C17,O24,no,N,26,,122970,25107,QUE
27,,DOUB,C18,C19,yes,N,27,,122970,25107,QUE
28,,SING,C18,O23,no,N,28,,122970,25107,QUE
29,,SING,C19,H19,no,N,29,,122970,25107,QUE
30,,SING,O23,HO3,no,N,30,,122970,25107,QUE
31,,SING,O24,HO4,no,N,31,,122970,25107,QUE
32,,SING,O27,HO7,no,N,32,,122970,25107,QUE
33,,SING,O29,HO9,no,N,33,,122970,25107,QUE
34,,SING,O30,HO0,no,N,34,,122970,25107,QUE
1,,SING,N,HN1,no,N,1,,123045,25112,NH2
2,,SING,N,HN2,no,N,2,,123045,25112,NH2
1,,SING,BE,F1,no,N,1,,123244,25124,BEF
2,,SING,BE,F2,no,N,2,,123244,25124,BEF
3,,SING,BE,F3,no,N,3,,123244,25124,BEF
1,,SING,N,CA,no,N,1,,123316,25129,HYP
2,,SING,N,CD,no,N,2,,123316,25129,HYP
3,,SING,N,H,no,N,3,,123316,25129,HYP
4,,SING,CA,C,no,N,4,,123316,25129,HYP
5,,SING,CA,CB,no,N,5,,123316,25129,HYP
6,,SING,CA,HA,no,N,6,,123316,25129,HYP
7,,DOUB,C,O,no,N,7,,123316,25129,HYP
8,,SING,C,OXT,no,N,8,,123316,25129,HYP
9,,SING,CB,CG,no,N,9,,123316,25129,HYP
10,,SING,CB,HB2,no,N,10,,123316,25129,HYP
11,,SING,CB,HB3,no,N,11,,123316,25129,HYP
12,,SING,CG,CD,no,N,12,,123316,25129,HYP
13,,SING,CG,OD1,no,N,13,,123316,25129,HYP
14,,SING,CG,HG,no,N,14,,123316,25129,HYP
15,,SING,CD,HD22,no,N,15,,123316,25129,HYP
16,,SING,CD,HD23,no,N,16,,123316,25129,HYP
17,,SING,OD1,HD1,no,N,17,,123316,25129,HYP
18,,SING,OXT,HXT,no,N,18,,123316,25129,HYP
1,,SING,BE,F1,no,N,1,,123449,25137,BEF
2,,SING,BE,F2,no,N,2,,123449,25137,BEF
3,,SING,BE,F3,no,N,3,,123449,25137,BEF
1,,SING,N1,C2,yes,N,1,,123726,25153,FMN
2,,DOUB,N1,C10,yes,N,2,,123726,25153,FMN
3,,DOUB,C2,O2,no,N,3,,123726,25153,FMN
4,,SING,C2,N3,yes,N,4,,123726,25153,FMN
5,,SING,N3,C4,yes,N,5,,123726,25153,FMN
6,,SING,N3,HN3,no,N,6,,123726,25153,FMN
7,,DOUB,C4,O4,no,N,7,,123726,25153,FMN
8,,SING,C4,C4A,yes,N,8,,123726,25153,FMN
9,,DOUB,C4A,N5,yes,N,9,,123726,25153,FMN
10,,SING,C4A,C10,yes,N,10,,123726,25153,FMN
11,,SING,N5,C5A,yes,N,11,,123726,25153,FMN
12,,DOUB,C5A,C6,yes,N,12,,123726,25153,FMN
13,,SING,C5A,C9A,yes,N,13,,123726,25153,FMN
14,,SING,C6,C7,yes,N,14,,123726,25153,FMN
15,,SING,C6,H6,no,N,15,,123726,25153,FMN
16,,SING,C7,C7M,no,N,16,,123726,25153,FMN
17,,DOUB,C7,C8,yes,N,17,,123726,25153,FMN
18,,SING,C7M,HM71,no,N,18,,123726,25153,FMN
19,,SING,C7M,HM72,no,N,19,,123726,25153,FMN
20,,SING,C7M,HM73,no,N,20,,123726,25153,FMN
21,,SING,C8,C8M,no,N,21,,123726,25153,FMN
22,,SING,C8,C9,yes,N,22,,123726,25153,FMN
23,,SING,C8M,HM81,no,N,23,,123726,25153,FMN
24,,SING,C8M,HM82,no,N,24,,123726,25153,FMN
25,,SING,C8M,HM83,no,N,25,,123726,25153,FMN
26,,DOUB,C9,C9A,yes,N,26,,123726,25153,FMN
27,,SING,C9,H9,no,N,27,,123726,25153,FMN
28,,SING,C9A,N10,yes,N,28,,123726,25153,FMN
29,,SING,N10,C10,yes,N,29,,123726,25153,FMN
30,,SING,N10,C1',no,N,30,,123726,25153,FMN
31,,SING,C1',C2',no,N,31,,123726,25153,FMN
32,,SING,C1',H1'1,no,N,32,,123726,25153,FMN
33,,SING,C1',H1'2,no,N,33,,123726,25153,FMN
34,,SING,C2',O2',no,N,34,,123726,25153,FMN
35,,SING,C2',C3',no,N,35,,123726,25153,FMN
36,,SING,C2',H2',no,N,36,,123726,25153,FMN
37,,SING,O2',HO2',no,N,37,,123726,25153,FMN
38,,SING,C3',O3',no,N,38,,123726,25153,FMN
39,,SING,C3',C4',no,N,39,,123726,25153,FMN
40,,SING,C3',H3',no,N,40,,123726,25153,FMN
41,,SING,O3',HO3',no,N,41,,123726,25153,FMN
42,,SING,C4',O4',no,N,42,,123726,25153,FMN
43,,SING,C4',C5',no,N,43,,123726,25153,FMN
44,,SING,C4',H4',no,N,44,,123726,25153,FMN
45,,SING,O4',HO4',no,N,45,,123726,25153,FMN
46,,SING,C5',O5',no,N,46,,123726,25153,FMN
47,,SING,C5',H5'1,no,N,47,,123726,25153,FMN
48,,SING,C5',H5'2,no,N,48,,123726,25153,FMN
49,,SING,O5',P,no,N,49,,123726,25153,FMN
50,,DOUB,P,O1P,no,N,50,,123726,25153,FMN
51,,SING,P,O2P,no,N,51,,123726,25153,FMN
52,,SING,P,O3P,no,N,52,,123726,25153,FMN
53,,SING,O2P,HOP2,no,N,53,,123726,25153,FMN
54,,SING,O3P,HOP3,no,N,54,,123726,25153,FMN
1,,DOUB,CAG,CAF,yes,N,1,,123745,25154,1YE
2,,SING,CAG,CAP,yes,N,2,,123745,25154,1YE
3,,SING,CAK,CAM,no,N,3,,123745,25154,1YE
4,,SING,CAK,CAP,no,N,4,,123745,25154,1YE
5,,SING,CAF,CAI,yes,N,5,,123745,25154,1YE
6,,DOUB,CAM,OAC,no,N,6,,123745,25154,1YE
7,,SING,CAM,OAE,no,N,7,,123745,25154,1YE
8,,DOUB,CAP,CAU,yes,N,8,,123745,25154,1YE
9,,DOUB,CAI,CAR,yes,N,9,,123745,25154,1YE
10,,SING,CAU,CAR,yes,N,10,,123745,25154,1YE
11,,SING,CAU,OAL,no,N,11,,123745,25154,1YE
12,,SING,CAR,CAQ,no,N,12,,123745,25154,1YE
13,,SING,OAL,CAT,no,N,13,,123745,25154,1YE
14,,DOUB,CAQ,OAD,no,N,14,,123745,25154,1YE
15,,SING,CAQ,CAS,no,N,15,,123745,25154,1YE
16,,DOUB,CAT,CAS,yes,N,16,,123745,25154,1YE
17,,SING,CAT,CAO,yes,N,17,,123745,25154,1YE
18,,SING,CAB,CAO,no,N,18,,123745,25154,1YE
19,,SING,CAS,CAJ,yes,N,19,,123745,25154,1YE
20,,DOUB,CAO,CAN,yes,N,20,,123745,25154,1YE
21,,DOUB,CAJ,CAH,yes,N,21,,123745,25154,1YE
22,,SING,CAN,CAH,yes,N,22,,123745,25154,1YE
23,,SING,CAN,CAA,no,N,23,,123745,25154,1YE
24,,SING,CAJ,H1,no,N,24,,123745,25154,1YE
25,,SING,CAH,H2,no,N,25,,123745,25154,1YE
26,,SING,CAA,H3,no,N,26,,123745,25154,1YE
27,,SING,CAA,H4,no,N,27,,123745,25154,1YE
28,,SING,CAA,H5,no,N,28,,123745,25154,1YE
29,,SING,CAB,H6,no,N,29,,123745,25154,1YE
30,,SING,CAB,H7,no,N,30,,123745,25154,1YE
31,,SING,CAB,H8,no,N,31,,123745,25154,1YE
32,,SING,CAI,H9,no,N,32,,123745,25154,1YE
33,,SING,CAF,H10,no,N,33,,123745,25154,1YE
34,,SING,CAG,H11,no,N,34,,123745,25154,1YE
35,,SING,CAK,H12,no,N,35,,123745,25154,1YE
36,,SING,CAK,H13,no,N,36,,123745,25154,1YE
37,,SING,OAE,H14,no,N,37,,123745,25154,1YE
1,,SING,N,CA,no,N,1,,123872,25161,DHA
2,,SING,N,H,no,N,2,,123872,25161,DHA
3,,SING,N,H2,no,N,3,,123872,25161,DHA
4,,DOUB,CA,CB,no,N,4,,123872,25161,DHA
5,,SING,CA,C,no,N,5,,123872,25161,DHA
6,,SING,CB,HB1,no,N,6,,123872,25161,DHA
7,,SING,CB,HB2,no,N,7,,123872,25161,DHA
8,,DOUB,C,O,no,N,8,,123872,25161,DHA
9,,SING,C,OXT,no,N,9,,123872,25161,DHA
10,,SING,OXT,HXT,no,N,10,,123872,25161,DHA
1,,SING,N,CA,no,N,1,,123873,25161,DBU
2,,SING,N,H,no,N,2,,123873,25161,DBU
3,,SING,N,H2,no,N,3,,123873,25161,DBU
4,,DOUB,CA,CB,no,Z,4,,123873,25161,DBU
5,,SING,CA,C,no,N,5,,123873,25161,DBU
6,,SING,CB,CG,no,N,6,,123873,25161,DBU
7,,SING,CB,HB,no,N,7,,123873,25161,DBU
8,,SING,CG,HG1,no,N,8,,123873,25161,DBU
9,,SING,CG,HG2,no,N,9,,123873,25161,DBU
10,,SING,CG,HG3,no,N,10,,123873,25161,DBU
11,,DOUB,C,O,no,N,11,,123873,25161,DBU
12,,SING,C,OXT,no,N,12,,123873,25161,DBU
13,,SING,OXT,HXT,no,N,13,,123873,25161,DBU
1,,SING,N,CA,no,N,1,,123874,25161,DAL
2,,SING,N,H,no,N,2,,123874,25161,DAL
3,,SING,N,H2,no,N,3,,123874,25161,DAL
4,,SING,CA,CB,no,N,4,,123874,25161,DAL
5,,SING,CA,C,no,N,5,,123874,25161,DAL
6,,SING,CA,HA,no,N,6,,123874,25161,DAL
7,,SING,CB,HB1,no,N,7,,123874,25161,DAL
8,,SING,CB,HB2,no,N,8,,123874,25161,DAL
9,,SING,CB,HB3,no,N,9,,123874,25161,DAL
10,,DOUB,C,O,no,N,10,,123874,25161,DAL
11,,SING,C,OXT,no,N,11,,123874,25161,DAL
12,,SING,OXT,HXT,no,N,12,,123874,25161,DAL
1,,SING,N,CA,no,N,1,,123875,25161,ABA
2,,SING,N,H,no,N,2,,123875,25161,ABA
3,,SING,N,HN2,no,N,3,,123875,25161,ABA
4,,SING,CA,C,no,N,4,,123875,25161,ABA
5,,SING,CA,CB,no,N,5,,123875,25161,ABA
6,,SING,CA,HA,no,N,6,,123875,25161,ABA
7,,DOUB,C,O,no,N,7,,123875,25161,ABA
8,,SING,C,OXT,no,N,8,,123875,25161,ABA
9,,SING,CB,CG,no,N,9,,123875,25161,ABA
10,,SING,CB,HB3,no,N,10,,123875,25161,ABA
11,,SING,CB,HB2,no,N,11,,123875,25161,ABA
12,,SING,CG,HG1,no,N,12,,123875,25161,ABA
13,,SING,CG,HG3,no,N,13,,123875,25161,ABA
14,,SING,CG,HG2,no,N,14,,123875,25161,ABA
15,,SING,OXT,HXT,no,N,15,,123875,25161,ABA
1,,SING,N,CA,no,N,1,,123890,25162,DBU
2,,SING,N,H,no,N,2,,123890,25162,DBU
3,,SING,N,H2,no,N,3,,123890,25162,DBU
4,,DOUB,CA,CB,no,Z,4,,123890,25162,DBU
5,,SING,CA,C,no,N,5,,123890,25162,DBU
6,,SING,CB,CG,no,N,6,,123890,25162,DBU
7,,SING,CB,HB,no,N,7,,123890,25162,DBU
8,,SING,CG,HG1,no,N,8,,123890,25162,DBU
9,,SING,CG,HG2,no,N,9,,123890,25162,DBU
10,,SING,CG,HG3,no,N,10,,123890,25162,DBU
11,,DOUB,C,O,no,N,11,,123890,25162,DBU
12,,SING,C,OXT,no,N,12,,123890,25162,DBU
13,,SING,OXT,HXT,no,N,13,,123890,25162,DBU
1,,SING,N,CA,no,N,1,,123891,25162,DBB
2,,SING,CA,C,no,N,2,,123891,25162,DBB
3,,SING,CA,CB,no,N,3,,123891,25162,DBB
4,,DOUB,C,O,no,N,4,,123891,25162,DBB
5,,SING,CB,CG,no,N,5,,123891,25162,DBB
6,,SING,C,OXT,no,N,6,,123891,25162,DBB
7,,SING,N,H,no,N,7,,123891,25162,DBB
8,,SING,N,H1,no,N,8,,123891,25162,DBB
9,,SING,CA,HA,no,N,9,,123891,25162,DBB
10,,SING,CB,HB2,no,N,10,,123891,25162,DBB
11,,SING,CB,HB3,no,N,11,,123891,25162,DBB
12,,SING,CG,HG1,no,N,12,,123891,25162,DBB
13,,SING,CG,HG2,no,N,13,,123891,25162,DBB
14,,SING,CG,HG3,no,N,14,,123891,25162,DBB
15,,SING,OXT,HXT,no,N,15,,123891,25162,DBB
1,,SING,N,CA,no,N,1,,123892,25162,DHA
2,,SING,N,H,no,N,2,,123892,25162,DHA
3,,SING,N,H2,no,N,3,,123892,25162,DHA
4,,DOUB,CA,CB,no,N,4,,123892,25162,DHA
5,,SING,CA,C,no,N,5,,123892,25162,DHA
6,,SING,CB,HB1,no,N,6,,123892,25162,DHA
7,,SING,CB,HB2,no,N,7,,123892,25162,DHA
8,,DOUB,C,O,no,N,8,,123892,25162,DHA
9,,SING,C,OXT,no,N,9,,123892,25162,DHA
10,,SING,OXT,HXT,no,N,10,,123892,25162,DHA
1,,SING,N,CA,no,N,1,,123893,25162,DAL
2,,SING,N,H,no,N,2,,123893,25162,DAL
3,,SING,N,H2,no,N,3,,123893,25162,DAL
4,,SING,CA,CB,no,N,4,,123893,25162,DAL
5,,SING,CA,C,no,N,5,,123893,25162,DAL
6,,SING,CA,HA,no,N,6,,123893,25162,DAL
7,,SING,CB,HB1,no,N,7,,123893,25162,DAL
8,,SING,CB,HB2,no,N,8,,123893,25162,DAL
9,,SING,CB,HB3,no,N,9,,123893,25162,DAL
10,,DOUB,C,O,no,N,10,,123893,25162,DAL
11,,SING,C,OXT,no,N,11,,123893,25162,DAL
12,,SING,OXT,HXT,no,N,12,,123893,25162,DAL
1,,SING,O,H1,no,N,1,,123932,25164,HOH
2,,SING,O,H2,no,N,2,,123932,25164,HOH
1,,SING,N,CA,no,N,1,,124128,25174,ABA
2,,SING,N,H,no,N,2,,124128,25174,ABA
3,,SING,N,HN2,no,N,3,,124128,25174,ABA
4,,SING,CA,C,no,N,4,,124128,25174,ABA
5,,SING,CA,CB,no,N,5,,124128,25174,ABA
6,,SING,CA,HA,no,N,6,,124128,25174,ABA
7,,DOUB,C,O,no,N,7,,124128,25174,ABA
8,,SING,C,OXT,no,N,8,,124128,25174,ABA
9,,SING,CB,CG,no,N,9,,124128,25174,ABA
10,,SING,CB,HB3,no,N,10,,124128,25174,ABA
11,,SING,CB,HB2,no,N,11,,124128,25174,ABA
12,,SING,CG,HG1,no,N,12,,124128,25174,ABA
13,,SING,CG,HG3,no,N,13,,124128,25174,ABA
14,,SING,CG,HG2,no,N,14,,124128,25174,ABA
15,,SING,OXT,HXT,no,N,15,,124128,25174,ABA
1,,SING,N,CA,no,N,1,,124347,25186,ABA
2,,SING,N,H,no,N,2,,124347,25186,ABA
3,,SING,N,HN2,no,N,3,,124347,25186,ABA
4,,SING,CA,C,no,N,4,,124347,25186,ABA
5,,SING,CA,CB,no,N,5,,124347,25186,ABA
6,,SING,CA,HA,no,N,6,,124347,25186,ABA
7,,DOUB,C,O,no,N,7,,124347,25186,ABA
8,,SING,C,OXT,no,N,8,,124347,25186,ABA
9,,SING,CB,CG,no,N,9,,124347,25186,ABA
10,,SING,CB,HB3,no,N,10,,124347,25186,ABA
11,,SING,CB,HB2,no,N,11,,124347,25186,ABA
12,,SING,CG,HG1,no,N,12,,124347,25186,ABA
13,,SING,CG,HG3,no,N,13,,124347,25186,ABA
14,,SING,CG,HG2,no,N,14,,124347,25186,ABA
15,,SING,OXT,HXT,no,N,15,,124347,25186,ABA
1,,SING,N,CA,no,N,1,,124363,25187,ABA
2,,SING,N,H,no,N,2,,124363,25187,ABA
3,,SING,N,HN2,no,N,3,,124363,25187,ABA
4,,SING,CA,C,no,N,4,,124363,25187,ABA
5,,SING,CA,CB,no,N,5,,124363,25187,ABA
6,,SING,CA,HA,no,N,6,,124363,25187,ABA
7,,DOUB,C,O,no,N,7,,124363,25187,ABA
8,,SING,C,OXT,no,N,8,,124363,25187,ABA
9,,SING,CB,CG,no,N,9,,124363,25187,ABA
10,,SING,CB,HB3,no,N,10,,124363,25187,ABA
11,,SING,CB,HB2,no,N,11,,124363,25187,ABA
12,,SING,CG,HG1,no,N,12,,124363,25187,ABA
13,,SING,CG,HG3,no,N,13,,124363,25187,ABA
14,,SING,CG,HG2,no,N,14,,124363,25187,ABA
15,,SING,OXT,HXT,no,N,15,,124363,25187,ABA
1,,SING,C4,C5,yes,N,1,,124381,25188,6MZ
2,,SING,C4,N9,yes,N,2,,124381,25188,6MZ
3,,SING,C2,N3,yes,N,3,,124381,25188,6MZ
4,,DOUB,C4,N3,yes,N,4,,124381,25188,6MZ
5,,DOUB,C2,N1,yes,N,5,,124381,25188,6MZ
6,,DOUB,C5,C6,yes,N,6,,124381,25188,6MZ
7,,SING,N1,C6,yes,N,7,,124381,25188,6MZ
8,,SING,C6,N6,no,N,8,,124381,25188,6MZ
9,,SING,N6,C9,no,N,9,,124381,25188,6MZ
10,,SING,C5,N7,yes,N,10,,124381,25188,6MZ
11,,SING,N9,C8,yes,N,11,,124381,25188,6MZ
12,,DOUB,N7,C8,yes,N,12,,124381,25188,6MZ
13,,SING,O5',C5',no,N,13,,124381,25188,6MZ
14,,SING,C1',H1',no,N,14,,124381,25188,6MZ
15,,SING,C9,H9C1,no,N,15,,124381,25188,6MZ
16,,SING,C9,H9C2,no,N,16,,124381,25188,6MZ
17,,SING,C5',H5'1,no,N,17,,124381,25188,6MZ
18,,SING,C5',H5'2,no,N,18,,124381,25188,6MZ
19,,SING,C4',H4',no,N,19,,124381,25188,6MZ
20,,SING,C3',H3',no,N,20,,124381,25188,6MZ
21,,SING,C2',H2',no,N,21,,124381,25188,6MZ
22,,SING,O2',HA,no,N,22,,124381,25188,6MZ
23,,SING,O3',HB,no,N,23,,124381,25188,6MZ
24,,SING,O3P,H3P,no,N,24,,124381,25188,6MZ
25,,SING,C5',C4',no,N,25,,124381,25188,6MZ
26,,SING,C4',O4',no,N,26,,124381,25188,6MZ
27,,SING,N9,C1',no,N,27,,124381,25188,6MZ
28,,SING,O4',C1',no,N,28,,124381,25188,6MZ
29,,SING,C1',C2',no,N,29,,124381,25188,6MZ
30,,SING,C2',O2',no,N,30,,124381,25188,6MZ
31,,SING,C4',C3',no,N,31,,124381,25188,6MZ
32,,SING,C2',C3',no,N,32,,124381,25188,6MZ
33,,SING,C3',O3',no,N,33,,124381,25188,6MZ
34,,SING,O1P,P,no,N,34,,124381,25188,6MZ
35,,DOUB,O2P,P,no,N,35,,124381,25188,6MZ
36,,SING,O5',P,no,N,36,,124381,25188,6MZ
37,,SING,P,O3P,no,N,37,,124381,25188,6MZ
38,,SING,C2,H2,no,N,38,,124381,25188,6MZ
39,,SING,O1P,H1P,no,N,39,,124381,25188,6MZ
40,,SING,C8,H8,no,N,40,,124381,25188,6MZ
41,,SING,N6,H6,no,N,41,,124381,25188,6MZ
42,,SING,C9,H9,no,N,42,,124381,25188,6MZ
1,,SING,N,HN1,no,N,1,,124420,25190,NH2
2,,SING,N,HN2,no,N,2,,124420,25190,NH2
1,,SING,C1,C2,no,N,1,,124451,25192,NAG
2,,SING,C1,O1,no,N,2,,124451,25192,NAG
3,,SING,C1,O5,no,N,3,,124451,25192,NAG
4,,SING,C1,H1,no,N,4,,124451,25192,NAG
5,,SING,C2,C3,no,N,5,,124451,25192,NAG
6,,SING,C2,N2,no,N,6,,124451,25192,NAG
7,,SING,C2,H2,no,N,7,,124451,25192,NAG
8,,SING,C3,C4,no,N,8,,124451,25192,NAG
9,,SING,C3,O3,no,N,9,,124451,25192,NAG
10,,SING,C3,H3,no,N,10,,124451,25192,NAG
11,,SING,C4,C5,no,N,11,,124451,25192,NAG
12,,SING,C4,O4,no,N,12,,124451,25192,NAG
13,,SING,C4,H4,no,N,13,,124451,25192,NAG
14,,SING,C5,C6,no,N,14,,124451,25192,NAG
15,,SING,C5,O5,no,N,15,,124451,25192,NAG
16,,SING,C5,H5,no,N,16,,124451,25192,NAG
17,,SING,C6,O6,no,N,17,,124451,25192,NAG
18,,SING,C6,H61,no,N,18,,124451,25192,NAG
19,,SING,C6,H62,no,N,19,,124451,25192,NAG
20,,SING,C7,C8,no,N,20,,124451,25192,NAG
21,,SING,C7,N2,no,N,21,,124451,25192,NAG
22,,DOUB,C7,O7,no,N,22,,124451,25192,NAG
23,,SING,C8,H81,no,N,23,,124451,25192,NAG
24,,SING,C8,H82,no,N,24,,124451,25192,NAG
25,,SING,C8,H83,no,N,25,,124451,25192,NAG
26,,SING,N2,HN2,no,N,26,,124451,25192,NAG
27,,SING,O1,HO1,no,N,27,,124451,25192,NAG
28,,SING,O3,HO3,no,N,28,,124451,25192,NAG
29,,SING,O4,HO4,no,N,29,,124451,25192,NAG
30,,SING,O6,HO6,no,N,30,,124451,25192,NAG
1,,SING,C1,C2,no,N,1,,124452,25192,AMU
2,,SING,C1,O1,no,N,2,,124452,25192,AMU
3,,SING,C1,O5,no,N,3,,124452,25192,AMU
4,,SING,C1,H1,no,N,4,,124452,25192,AMU
5,,SING,C2,C3,no,N,5,,124452,25192,AMU
6,,SING,C2,N2,no,N,6,,124452,25192,AMU
7,,SING,C2,H2,no,N,7,,124452,25192,AMU
8,,SING,C3,C4,no,N,8,,124452,25192,AMU
9,,SING,C3,O3,no,N,9,,124452,25192,AMU
10,,SING,C3,H3,no,N,10,,124452,25192,AMU
11,,SING,C4,C5,no,N,11,,124452,25192,AMU
12,,SING,C4,O4,no,N,12,,124452,25192,AMU
13,,SING,C4,H4,no,N,13,,124452,25192,AMU
14,,SING,C5,C6,no,N,14,,124452,25192,AMU
15,,SING,C5,O5,no,N,15,,124452,25192,AMU
16,,SING,C5,H5,no,N,16,,124452,25192,AMU
17,,SING,C6,O6,no,N,17,,124452,25192,AMU
18,,SING,C6,H61,no,N,18,,124452,25192,AMU
19,,SING,C6,H62,no,N,19,,124452,25192,AMU
20,,SING,C7,C8,no,N,20,,124452,25192,AMU
21,,DOUB,C7,O7,no,N,21,,124452,25192,AMU
22,,SING,C7,N2,no,N,22,,124452,25192,AMU
23,,SING,C8,H81,no,N,23,,124452,25192,AMU
24,,SING,C8,H82,no,N,24,,124452,25192,AMU
25,,SING,C8,H83,no,N,25,,124452,25192,AMU
26,,SING,C9,C10,no,N,26,,124452,25192,AMU
27,,SING,C9,C11,no,N,27,,124452,25192,AMU
28,,SING,C9,O3,no,N,28,,124452,25192,AMU
29,,SING,C9,H9,no,N,29,,124452,25192,AMU
30,,DOUB,C10,O10,no,N,30,,124452,25192,AMU
31,,SING,C10,O11,no,N,31,,124452,25192,AMU
32,,SING,C11,H111,no,N,32,,124452,25192,AMU
33,,SING,C11,H112,no,N,33,,124452,25192,AMU
34,,SING,C11,H113,no,N,34,,124452,25192,AMU
35,,SING,O1,HO1,no,N,35,,124452,25192,AMU
36,,SING,O4,HO4,no,N,36,,124452,25192,AMU
37,,SING,O6,HO6,no,N,37,,124452,25192,AMU
38,,SING,O11,HO11,no,N,38,,124452,25192,AMU
39,,SING,N2,HN2,no,N,39,,124452,25192,AMU
1,,SING,N,CA,no,N,1,,124453,25192,FGA
2,,SING,N,H,no,N,2,,124453,25192,FGA
3,,SING,N,H2,no,N,3,,124453,25192,FGA
4,,SING,CA,C,no,N,4,,124453,25192,FGA
5,,SING,CA,CB,no,N,5,,124453,25192,FGA
6,,SING,CA,HA,no,N,6,,124453,25192,FGA
7,,DOUB,C,O,no,N,7,,124453,25192,FGA
8,,SING,C,OXT,no,N,8,,124453,25192,FGA
9,,SING,CB,CG,no,N,9,,124453,25192,FGA
10,,SING,CB,HB2,no,N,10,,124453,25192,FGA
11,,SING,CB,HB3,no,N,11,,124453,25192,FGA
12,,SING,CG,CD,no,N,12,,124453,25192,FGA
13,,SING,CG,HG2,no,N,13,,124453,25192,FGA
14,,SING,CG,HG3,no,N,14,,124453,25192,FGA
15,,DOUB,CD,OE1,no,N,15,,124453,25192,FGA
16,,SING,CD,OE2,no,N,16,,124453,25192,FGA
17,,SING,OE2,HE2,no,N,17,,124453,25192,FGA
18,,SING,OXT,HXT,no,N,18,,124453,25192,FGA
1,,SING,C1,C2,no,N,1,,124454,25192,API
2,,DOUB,C1,O1,no,N,2,,124454,25192,API
3,,SING,C1,O2,no,N,3,,124454,25192,API
4,,SING,C2,C3,no,N,4,,124454,25192,API
5,,SING,C2,N2,no,N,5,,124454,25192,API
6,,SING,C2,H2,no,N,6,,124454,25192,API
7,,SING,C3,C4,no,N,7,,124454,25192,API
8,,SING,C3,H31,no,N,8,,124454,25192,API
9,,SING,C3,H32,no,N,9,,124454,25192,API
10,,SING,C4,C5,no,N,10,,124454,25192,API
11,,SING,C4,H41,no,N,11,,124454,25192,API
12,,SING,C4,H42,no,N,12,,124454,25192,API
13,,SING,C5,C6,no,N,13,,124454,25192,API
14,,SING,C5,H51,no,N,14,,124454,25192,API
15,,SING,C5,H52,no,N,15,,124454,25192,API
16,,SING,C6,C7,no,N,16,,124454,25192,API
17,,SING,C6,N6,no,N,17,,124454,25192,API
18,,SING,C6,H6,no,N,18,,124454,25192,API
19,,DOUB,C7,O3,no,N,19,,124454,25192,API
20,,SING,C7,O4,no,N,20,,124454,25192,API
21,,SING,O2,HO2,no,N,21,,124454,25192,API
22,,SING,O4,HO4,no,N,22,,124454,25192,API
23,,SING,N2,HN21,no,N,23,,124454,25192,API
24,,SING,N2,HN22,no,N,24,,124454,25192,API
25,,SING,N6,HN61,no,N,25,,124454,25192,API
26,,SING,N6,HN62,no,N,26,,124454,25192,API
1,,SING,N,CA,no,N,1,,124455,25192,DAL
2,,SING,N,H,no,N,2,,124455,25192,DAL
3,,SING,N,H2,no,N,3,,124455,25192,DAL
4,,SING,CA,CB,no,N,4,,124455,25192,DAL
5,,SING,CA,C,no,N,5,,124455,25192,DAL
6,,SING,CA,HA,no,N,6,,124455,25192,DAL
7,,SING,CB,HB1,no,N,7,,124455,25192,DAL
8,,SING,CB,HB2,no,N,8,,124455,25192,DAL
9,,SING,CB,HB3,no,N,9,,124455,25192,DAL
10,,DOUB,C,O,no,N,10,,124455,25192,DAL
11,,SING,C,OXT,no,N,11,,124455,25192,DAL
12,,SING,OXT,HXT,no,N,12,,124455,25192,DAL
1,,DOUB,C2,N1,yes,N,1,,124904,25220,6MD
2,,SING,C2,N3,yes,N,2,,124904,25220,6MD
3,,SING,N1,C6,yes,N,3,,124904,25220,6MD
4,,DOUB,N3,C4,yes,N,4,,124904,25220,6MD
5,,SING,CZ,N6,no,N,5,,124904,25220,6MD
6,,SING,C6,N6,no,N,6,,124904,25220,6MD
7,,DOUB,C6,C5,yes,N,7,,124904,25220,6MD
8,,SING,C4,C5,yes,N,8,,124904,25220,6MD
9,,SING,C4,N9,yes,N,9,,124904,25220,6MD
10,,SING,C4',O4',no,N,10,,124904,25220,6MD
11,,SING,C4',C5',no,N,11,,124904,25220,6MD
12,,SING,C4',C3',no,N,12,,124904,25220,6MD
13,,SING,O4',C1',no,N,13,,124904,25220,6MD
14,,SING,C5,N7,yes,N,14,,124904,25220,6MD
15,,SING,C5',O5',no,N,15,,124904,25220,6MD
16,,SING,O3',C3',no,N,16,,124904,25220,6MD
17,,SING,C1',N9,no,N,17,,124904,25220,6MD
18,,SING,C1',C2',no,N,18,,124904,25220,6MD
19,,SING,N9,C8,yes,N,19,,124904,25220,6MD
20,,SING,C3',C2',no,N,20,,124904,25220,6MD
21,,SING,C2',O2',no,N,21,,124904,25220,6MD
22,,DOUB,N7,C8,yes,N,22,,124904,25220,6MD
23,,SING,O5',H1,no,N,23,,124904,25220,6MD
24,,SING,C5',H2,no,N,24,,124904,25220,6MD
25,,SING,C5',H3,no,N,25,,124904,25220,6MD
26,,SING,C4',H4,no,N,26,,124904,25220,6MD
27,,SING,C3',H5,no,N,27,,124904,25220,6MD
28,,SING,O3',H6,no,N,28,,124904,25220,6MD
29,,SING,C2',H7,no,N,29,,124904,25220,6MD
30,,SING,O2',H8,no,N,30,,124904,25220,6MD
31,,SING,C1',H9,no,N,31,,124904,25220,6MD
32,,SING,C8,H10,no,N,32,,124904,25220,6MD
33,,SING,N6,H11,no,N,33,,124904,25220,6MD
34,,SING,C2,H12,no,N,34,,124904,25220,6MD
35,,SING,CZ,H13,no,N,35,,124904,25220,6MD
36,,SING,CZ,H14,no,N,36,,124904,25220,6MD
37,,SING,CZ,H15,no,N,37,,124904,25220,6MD
1,,SING,C71,C83,no,N,1,,125168,25233,3LW
2,,SING,C71,C61,no,N,2,,125168,25233,3LW
3,,SING,C71,C81,no,N,3,,125168,25233,3LW
4,,SING,C83,C73,no,N,4,,125168,25233,3LW
5,,SING,C73,C82,no,N,5,,125168,25233,3LW
6,,SING,C73,C63,no,N,6,,125168,25233,3LW
7,,SING,C82,C72,no,N,7,,125168,25233,3LW
8,,SING,C72,C62,no,N,8,,125168,25233,3LW
9,,SING,C72,C81,no,N,9,,125168,25233,3LW
10,,SING,C62,C10,no,N,10,,125168,25233,3LW
11,,SING,C10,C61,no,N,11,,125168,25233,3LW
12,,SING,C10,C63,no,N,12,,125168,25233,3LW
13,,SING,C10,N2,no,N,13,,125168,25233,3LW
14,,SING,N2,C5,no,N,14,,125168,25233,3LW
15,,SING,C5,C12,no,N,15,,125168,25233,3LW
16,,SING,C12,S,no,N,16,,125168,25233,3LW
17,,SING,C12,C3,no,N,17,,125168,25233,3LW
18,,SING,S,C1,no,N,18,,125168,25233,3LW
19,,SING,C1,BR,no,N,19,,125168,25233,3LW
20,,SING,C1,C2,no,N,20,,125168,25233,3LW
21,,SING,C2,C3,no,N,21,,125168,25233,3LW
22,,SING,C71,1H7,no,N,22,,125168,25233,3LW
23,,SING,C83,5H8,no,N,23,,125168,25233,3LW
24,,SING,C83,6H8,no,N,24,,125168,25233,3LW
25,,SING,C73,3H7,no,N,25,,125168,25233,3LW
26,,SING,C82,3H8,no,N,26,,125168,25233,3LW
27,,SING,C82,4H8,no,N,27,,125168,25233,3LW
28,,SING,C72,2H7,no,N,28,,125168,25233,3LW
29,,SING,C62,3H6,no,N,29,,125168,25233,3LW
30,,SING,C62,4H6,no,N,30,,125168,25233,3LW
31,,SING,C61,1H6,no,N,31,,125168,25233,3LW
32,,SING,C61,2H6,no,N,32,,125168,25233,3LW
33,,SING,C63,5H6,no,N,33,,125168,25233,3LW
34,,SING,C63,6H6,no,N,34,,125168,25233,3LW
35,,SING,N2,1HN2,no,N,35,,125168,25233,3LW
36,,SING,C5,1H5,no,N,36,,125168,25233,3LW
37,,SING,C5,2H5,no,N,37,,125168,25233,3LW
38,,SING,C12,H1,no,N,38,,125168,25233,3LW
39,,SING,C1,H4,no,N,39,,125168,25233,3LW
40,,SING,C2,H2,no,N,40,,125168,25233,3LW
41,,SING,C3,H3,no,N,41,,125168,25233,3LW
42,,SING,C81,1H8,no,N,42,,125168,25233,3LW
43,,SING,C81,2H8,no,N,43,,125168,25233,3LW
44,,SING,C2,H5,no,N,44,,125168,25233,3LW
45,,SING,C3,H6,no,N,45,,125168,25233,3LW
1,,SING,C71,C83,no,N,1,,125185,25234,3LW
2,,SING,C71,C61,no,N,2,,125185,25234,3LW
3,,SING,C71,C81,no,N,3,,125185,25234,3LW
4,,SING,C83,C73,no,N,4,,125185,25234,3LW
5,,SING,C73,C82,no,N,5,,125185,25234,3LW
6,,SING,C73,C63,no,N,6,,125185,25234,3LW
7,,SING,C82,C72,no,N,7,,125185,25234,3LW
8,,SING,C72,C62,no,N,8,,125185,25234,3LW
9,,SING,C72,C81,no,N,9,,125185,25234,3LW
10,,SING,C62,C10,no,N,10,,125185,25234,3LW
11,,SING,C10,C61,no,N,11,,125185,25234,3LW
12,,SING,C10,C63,no,N,12,,125185,25234,3LW
13,,SING,C10,N2,no,N,13,,125185,25234,3LW
14,,SING,N2,C5,no,N,14,,125185,25234,3LW
15,,SING,C5,C12,no,N,15,,125185,25234,3LW
16,,SING,C12,S,no,N,16,,125185,25234,3LW
17,,SING,C12,C3,no,N,17,,125185,25234,3LW
18,,SING,S,C1,no,N,18,,125185,25234,3LW
19,,SING,C1,BR,no,N,19,,125185,25234,3LW
20,,SING,C1,C2,no,N,20,,125185,25234,3LW
21,,SING,C2,C3,no,N,21,,125185,25234,3LW
22,,SING,C71,1H7,no,N,22,,125185,25234,3LW
23,,SING,C83,5H8,no,N,23,,125185,25234,3LW
24,,SING,C83,6H8,no,N,24,,125185,25234,3LW
25,,SING,C73,3H7,no,N,25,,125185,25234,3LW
26,,SING,C82,3H8,no,N,26,,125185,25234,3LW
27,,SING,C82,4H8,no,N,27,,125185,25234,3LW
28,,SING,C72,2H7,no,N,28,,125185,25234,3LW
29,,SING,C62,3H6,no,N,29,,125185,25234,3LW
30,,SING,C62,4H6,no,N,30,,125185,25234,3LW
31,,SING,C61,1H6,no,N,31,,125185,25234,3LW
32,,SING,C61,2H6,no,N,32,,125185,25234,3LW
33,,SING,C63,5H6,no,N,33,,125185,25234,3LW
34,,SING,C63,6H6,no,N,34,,125185,25234,3LW
35,,SING,N2,1HN2,no,N,35,,125185,25234,3LW
36,,SING,C5,1H5,no,N,36,,125185,25234,3LW
37,,SING,C5,2H5,no,N,37,,125185,25234,3LW
38,,SING,C12,H1,no,N,38,,125185,25234,3LW
39,,SING,C1,H4,no,N,39,,125185,25234,3LW
40,,SING,C2,H2,no,N,40,,125185,25234,3LW
41,,SING,C3,H3,no,N,41,,125185,25234,3LW
42,,SING,C81,1H8,no,N,42,,125185,25234,3LW
43,,SING,C81,2H8,no,N,43,,125185,25234,3LW
44,,SING,C2,H5,no,N,44,,125185,25234,3LW
45,,SING,C3,H6,no,N,45,,125185,25234,3LW
1,,SING,N,CA,no,N,1,,125222,25236,PFF
2,,SING,N,H,no,N,2,,125222,25236,PFF
3,,SING,N,H2,no,N,3,,125222,25236,PFF
4,,SING,CA,C,no,N,4,,125222,25236,PFF
5,,SING,CA,CB,no,N,5,,125222,25236,PFF
6,,SING,CA,HA,no,N,6,,125222,25236,PFF
7,,DOUB,C,O,no,N,7,,125222,25236,PFF
8,,SING,C,OXT,no,N,8,,125222,25236,PFF
9,,SING,OXT,HXT,no,N,9,,125222,25236,PFF
10,,SING,CB,CG,no,N,10,,125222,25236,PFF
11,,SING,CB,HB2,no,N,11,,125222,25236,PFF
12,,SING,CB,HB3,no,N,12,,125222,25236,PFF
13,,DOUB,CG,CD1,yes,N,13,,125222,25236,PFF
14,,SING,CG,CD2,yes,N,14,,125222,25236,PFF
15,,SING,CD1,CE1,yes,N,15,,125222,25236,PFF
16,,SING,CD1,HD1,no,N,16,,125222,25236,PFF
17,,DOUB,CD2,CE2,yes,N,17,,125222,25236,PFF
18,,SING,CD2,HD2,no,N,18,,125222,25236,PFF
19,,DOUB,CE1,CZ,yes,N,19,,125222,25236,PFF
20,,SING,CE1,HE1,no,N,20,,125222,25236,PFF
21,,SING,CE2,CZ,yes,N,21,,125222,25236,PFF
22,,SING,CE2,HE2,no,N,22,,125222,25236,PFF
23,,SING,CZ,F,no,N,23,,125222,25236,PFF
1,,SING,N,HN1,no,N,1,,125223,25236,NH2
2,,SING,N,HN2,no,N,2,,125223,25236,NH2
1,,SING,N,CA,no,N,1,,125266,25238,PCA
2,,SING,N,CD,no,N,2,,125266,25238,PCA
3,,SING,N,H,no,N,3,,125266,25238,PCA
4,,SING,CA,CB,no,N,4,,125266,25238,PCA
5,,SING,CA,C,no,N,5,,125266,25238,PCA
6,,SING,CA,HA,no,N,6,,125266,25238,PCA
7,,SING,CB,CG,no,N,7,,125266,25238,PCA
8,,SING,CB,HB2,no,N,8,,125266,25238,PCA
9,,SING,CB,HB3,no,N,9,,125266,25238,PCA
10,,SING,CG,CD,no,N,10,,125266,25238,PCA
11,,SING,CG,HG2,no,N,11,,125266,25238,PCA
12,,SING,CG,HG3,no,N,12,,125266,25238,PCA
13,,DOUB,CD,OE,no,N,13,,125266,25238,PCA
14,,DOUB,C,O,no,N,14,,125266,25238,PCA
15,,SING,C,OXT,no,N,15,,125266,25238,PCA
16,,SING,OXT,HXT,no,N,16,,125266,25238,PCA
1,,SING,C1,C2,no,N,1,,125695,25269,NAG
2,,SING,C1,O1,no,N,2,,125695,25269,NAG
3,,SING,C1,O5,no,N,3,,125695,25269,NAG
4,,SING,C1,H1,no,N,4,,125695,25269,NAG
5,,SING,C2,C3,no,N,5,,125695,25269,NAG
6,,SING,C2,N2,no,N,6,,125695,25269,NAG
7,,SING,C2,H2,no,N,7,,125695,25269,NAG
8,,SING,C3,C4,no,N,8,,125695,25269,NAG
9,,SING,C3,O3,no,N,9,,125695,25269,NAG
10,,SING,C3,H3,no,N,10,,125695,25269,NAG
11,,SING,C4,C5,no,N,11,,125695,25269,NAG
12,,SING,C4,O4,no,N,12,,125695,25269,NAG
13,,SING,C4,H4,no,N,13,,125695,25269,NAG
14,,SING,C5,C6,no,N,14,,125695,25269,NAG
15,,SING,C5,O5,no,N,15,,125695,25269,NAG
16,,SING,C5,H5,no,N,16,,125695,25269,NAG
17,,SING,C6,O6,no,N,17,,125695,25269,NAG
18,,SING,C6,H61,no,N,18,,125695,25269,NAG
19,,SING,C6,H62,no,N,19,,125695,25269,NAG
20,,SING,C7,C8,no,N,20,,125695,25269,NAG
21,,SING,C7,N2,no,N,21,,125695,25269,NAG
22,,DOUB,C7,O7,no,N,22,,125695,25269,NAG
23,,SING,C8,H81,no,N,23,,125695,25269,NAG
24,,SING,C8,H82,no,N,24,,125695,25269,NAG
25,,SING,C8,H83,no,N,25,,125695,25269,NAG
26,,SING,N2,HN2,no,N,26,,125695,25269,NAG
27,,SING,O1,HO1,no,N,27,,125695,25269,NAG
28,,SING,O3,HO3,no,N,28,,125695,25269,NAG
29,,SING,O4,HO4,no,N,29,,125695,25269,NAG
30,,SING,O6,HO6,no,N,30,,125695,25269,NAG
1,,SING,N,CA,no,N,1,,125776,25273,SEP
2,,SING,N,H,no,N,2,,125776,25273,SEP
3,,SING,N,H2,no,N,3,,125776,25273,SEP
4,,SING,CA,CB,no,N,4,,125776,25273,SEP
5,,SING,CA,C,no,N,5,,125776,25273,SEP
6,,SING,CA,HA,no,N,6,,125776,25273,SEP
7,,SING,CB,OG,no,N,7,,125776,25273,SEP
8,,SING,CB,HB2,no,N,8,,125776,25273,SEP
9,,SING,CB,HB3,no,N,9,,125776,25273,SEP
10,,SING,OG,P,no,N,10,,125776,25273,SEP
11,,DOUB,C,O,no,N,11,,125776,25273,SEP
12,,SING,C,OXT,no,N,12,,125776,25273,SEP
13,,SING,OXT,HXT,no,N,13,,125776,25273,SEP
14,,DOUB,P,O1P,no,N,14,,125776,25273,SEP
15,,SING,P,O2P,no,N,15,,125776,25273,SEP
16,,SING,P,O3P,no,N,16,,125776,25273,SEP
17,,SING,O2P,HOP2,no,N,17,,125776,25273,SEP
18,,SING,O3P,HOP3,no,N,18,,125776,25273,SEP
1,,SING,P24,O26,no,N,1,,125968,25284,SDO
2,,SING,P24,O23,no,N,2,,125968,25284,SDO
3,,SING,P24,O27,no,N,3,,125968,25284,SDO
4,,SING,O27,C28,no,N,4,,125968,25284,SDO
5,,SING,C28,C29,no,N,5,,125968,25284,SDO
6,,SING,C29,C30,no,N,6,,125968,25284,SDO
7,,SING,C29,C31,no,N,7,,125968,25284,SDO
8,,SING,C29,C32,no,N,8,,125968,25284,SDO
9,,SING,C32,O33,no,N,9,,125968,25284,SDO
10,,SING,C32,C34,no,N,10,,125968,25284,SDO
11,,DOUB,C34,O35,no,N,11,,125968,25284,SDO
12,,SING,C34,N36,no,N,12,,125968,25284,SDO
13,,SING,N36,C37,no,N,13,,125968,25284,SDO
14,,SING,C37,C38,no,N,14,,125968,25284,SDO
15,,SING,C38,C39,no,N,15,,125968,25284,SDO
16,,DOUB,C39,O40,no,N,16,,125968,25284,SDO
17,,SING,C39,N41,no,N,17,,125968,25284,SDO
18,,SING,N41,C42,no,N,18,,125968,25284,SDO
6,,SING,CB,CG,,,,,240394,6146,DHB_2
19,,SING,C42,C43,no,N,19,,125968,25284,SDO
20,,SING,C43,S1,no,N,20,,125968,25284,SDO
21,,SING,S1,C1,no,N,21,,125968,25284,SDO
22,,SING,C1,C2,no,N,22,,125968,25284,SDO
23,,SING,C2,C3,no,N,23,,125968,25284,SDO
24,,DOUB,C3,O3,no,N,24,,125968,25284,SDO
25,,SING,C3,C4,no,N,25,,125968,25284,SDO
26,,SING,C4,C5,no,N,26,,125968,25284,SDO
27,,SING,C5,C6,no,N,27,,125968,25284,SDO
28,,SING,C6,C7,no,N,28,,125968,25284,SDO
29,,DOUB,C7,O7,no,N,29,,125968,25284,SDO
30,,SING,C7,C8,no,N,30,,125968,25284,SDO
31,,SING,O26,H1,no,N,31,,125968,25284,SDO
32,,SING,O23,H2,no,N,32,,125968,25284,SDO
33,,SING,C28,H28A,no,N,33,,125968,25284,SDO
34,,SING,C28,H28B,no,N,34,,125968,25284,SDO
35,,SING,C30,H30A,no,N,35,,125968,25284,SDO
36,,SING,C30,H30B,no,N,36,,125968,25284,SDO
37,,SING,C30,H30C,no,N,37,,125968,25284,SDO
38,,SING,C31,H31A,no,N,38,,125968,25284,SDO
39,,SING,C31,H31B,no,N,39,,125968,25284,SDO
40,,SING,C31,H31C,no,N,40,,125968,25284,SDO
41,,SING,C32,H32A,no,N,41,,125968,25284,SDO
42,,SING,O33,H33A,no,N,42,,125968,25284,SDO
43,,SING,N36,H36A,no,N,43,,125968,25284,SDO
44,,SING,C37,H37A,no,N,44,,125968,25284,SDO
45,,SING,C37,H37B,no,N,45,,125968,25284,SDO
46,,SING,C38,H38A,no,N,46,,125968,25284,SDO
47,,SING,C38,H38B,no,N,47,,125968,25284,SDO
48,,SING,N41,H41A,no,N,48,,125968,25284,SDO
49,,SING,C42,H42A,no,N,49,,125968,25284,SDO
50,,SING,C42,H42B,no,N,50,,125968,25284,SDO
51,,SING,C43,H43A,no,N,51,,125968,25284,SDO
52,,SING,C43,H43B,no,N,52,,125968,25284,SDO
53,,SING,C1,H1A,no,N,53,,125968,25284,SDO
54,,SING,C1,H1B,no,N,54,,125968,25284,SDO
55,,SING,C2,H2A,no,N,55,,125968,25284,SDO
56,,SING,C2,H2B,no,N,56,,125968,25284,SDO
57,,SING,C4,H4A,no,N,57,,125968,25284,SDO
58,,SING,C4,H4B,no,N,58,,125968,25284,SDO
59,,SING,C5,H5A,no,N,59,,125968,25284,SDO
60,,SING,C5,H5B,no,N,60,,125968,25284,SDO
61,,SING,C6,H6A,no,N,61,,125968,25284,SDO
62,,SING,C6,H6B,no,N,62,,125968,25284,SDO
63,,SING,C8,H8A,no,N,63,,125968,25284,SDO
64,,SING,C8,H8B,no,N,64,,125968,25284,SDO
65,,SING,C8,H8C,no,N,65,,125968,25284,SDO
1,,TRIP,C,O,no,N,1,,125990,25285,CMO
1,,SING,CHA,C1A,yes,N,1,,125991,25285,HEM
2,,DOUB,CHA,C4D,yes,N,2,,125991,25285,HEM
3,,SING,CHA,HHA,no,N,3,,125991,25285,HEM
4,,SING,CHB,C4A,yes,N,4,,125991,25285,HEM
5,,DOUB,CHB,C1B,yes,N,5,,125991,25285,HEM
6,,SING,CHB,HHB,no,N,6,,125991,25285,HEM
7,,SING,CHC,C4B,yes,N,7,,125991,25285,HEM
8,,DOUB,CHC,C1C,yes,N,8,,125991,25285,HEM
9,,SING,CHC,HHC,no,N,9,,125991,25285,HEM
10,,DOUB,CHD,C4C,yes,N,10,,125991,25285,HEM
11,,SING,CHD,C1D,yes,N,11,,125991,25285,HEM
12,,SING,CHD,HHD,no,N,12,,125991,25285,HEM
13,,DOUB,C1A,C2A,yes,N,13,,125991,25285,HEM
14,,SING,C1A,NA,yes,N,14,,125991,25285,HEM
15,,SING,C2A,C3A,yes,N,15,,125991,25285,HEM
16,,SING,C2A,CAA,no,N,16,,125991,25285,HEM
17,,DOUB,C3A,C4A,yes,N,17,,125991,25285,HEM
18,,SING,C3A,CMA,no,N,18,,125991,25285,HEM
19,,SING,C4A,NA,yes,N,19,,125991,25285,HEM
20,,SING,CMA,HMA,no,N,20,,125991,25285,HEM
21,,SING,CMA,HMAA,no,N,21,,125991,25285,HEM
22,,SING,CMA,HMAB,no,N,22,,125991,25285,HEM
23,,SING,CAA,CBA,no,N,23,,125991,25285,HEM
24,,SING,CAA,HAA,no,N,24,,125991,25285,HEM
25,,SING,CAA,HAAA,no,N,25,,125991,25285,HEM
26,,SING,CBA,CGA,no,N,26,,125991,25285,HEM
27,,SING,CBA,HBA,no,N,27,,125991,25285,HEM
28,,SING,CBA,HBAA,no,N,28,,125991,25285,HEM
29,,DOUB,CGA,O1A,no,N,29,,125991,25285,HEM
30,,SING,CGA,O2A,no,N,30,,125991,25285,HEM
31,,SING,C1B,C2B,no,N,31,,125991,25285,HEM
32,,SING,C1B,NB,yes,N,32,,125991,25285,HEM
33,,DOUB,C2B,C3B,yes,N,33,,125991,25285,HEM
34,,SING,C2B,CMB,yes,N,34,,125991,25285,HEM
35,,SING,C3B,C4B,no,N,35,,125991,25285,HEM
36,,SING,C3B,CAB,yes,N,36,,125991,25285,HEM
37,,DOUB,C4B,NB,no,N,37,,125991,25285,HEM
38,,SING,CMB,HMB,yes,N,38,,125991,25285,HEM
39,,SING,CMB,HMBA,no,N,39,,125991,25285,HEM
40,,SING,CMB,HMBB,no,N,40,,125991,25285,HEM
41,,DOUB,CAB,CBB,no,N,41,,125991,25285,HEM
42,,SING,CAB,HAB,no,N,42,,125991,25285,HEM
43,,SING,CBB,HBB,no,N,43,,125991,25285,HEM
44,,SING,CBB,HBBA,no,N,44,,125991,25285,HEM
45,,SING,C1C,C2C,no,N,45,,125991,25285,HEM
46,,SING,C1C,NC,yes,N,46,,125991,25285,HEM
47,,DOUB,C2C,C3C,yes,N,47,,125991,25285,HEM
48,,SING,C2C,CMC,yes,N,48,,125991,25285,HEM
49,,SING,C3C,C4C,no,N,49,,125991,25285,HEM
50,,SING,C3C,CAC,yes,N,50,,125991,25285,HEM
51,,SING,C4C,NC,no,N,51,,125991,25285,HEM
52,,SING,CMC,HMC,yes,N,52,,125991,25285,HEM
7,,SING,CG,HG1,,,,,240394,6146,DHB_2
53,,SING,CMC,HMCA,no,N,53,,125991,25285,HEM
54,,SING,CMC,HMCB,no,N,54,,125991,25285,HEM
55,,DOUB,CAC,CBC,no,N,55,,125991,25285,HEM
56,,SING,CAC,HAC,no,N,56,,125991,25285,HEM
57,,SING,CBC,HBC,no,N,57,,125991,25285,HEM
58,,SING,CBC,HBCA,no,N,58,,125991,25285,HEM
59,,SING,C1D,C2D,no,N,59,,125991,25285,HEM
60,,DOUB,C1D,ND,yes,N,60,,125991,25285,HEM
61,,DOUB,C2D,C3D,yes,N,61,,125991,25285,HEM
62,,SING,C2D,CMD,yes,N,62,,125991,25285,HEM
63,,SING,C3D,C4D,no,N,63,,125991,25285,HEM
64,,SING,C3D,CAD,yes,N,64,,125991,25285,HEM
65,,SING,C4D,ND,no,N,65,,125991,25285,HEM
66,,SING,CMD,HMD,yes,N,66,,125991,25285,HEM
67,,SING,CMD,HMDA,no,N,67,,125991,25285,HEM
68,,SING,CMD,HMDB,no,N,68,,125991,25285,HEM
69,,SING,CAD,CBD,no,N,69,,125991,25285,HEM
70,,SING,CAD,HAD,no,N,70,,125991,25285,HEM
71,,SING,CAD,HADA,no,N,71,,125991,25285,HEM
72,,SING,CBD,CGD,no,N,72,,125991,25285,HEM
73,,SING,CBD,HBD,no,N,73,,125991,25285,HEM
74,,SING,CBD,HBDA,no,N,74,,125991,25285,HEM
75,,DOUB,CGD,O1D,no,N,75,,125991,25285,HEM
76,,SING,CGD,O2D,no,N,76,,125991,25285,HEM
77,,SING,O2A,H2A,no,N,77,,125991,25285,HEM
78,,SING,O2D,H2D,no,N,78,,125991,25285,HEM
79,,SING,FE,NA,no,N,79,,125991,25285,HEM
80,,SING,FE,NB,no,N,80,,125991,25285,HEM
81,,SING,FE,NC,no,N,81,,125991,25285,HEM
82,,SING,FE,ND,no,N,82,,125991,25285,HEM
1,,SING,CHA,C1A,yes,N,1,,126008,25286,HEM
2,,DOUB,CHA,C4D,yes,N,2,,126008,25286,HEM
3,,SING,CHA,HHA,no,N,3,,126008,25286,HEM
4,,SING,CHB,C4A,yes,N,4,,126008,25286,HEM
5,,DOUB,CHB,C1B,yes,N,5,,126008,25286,HEM
6,,SING,CHB,HHB,no,N,6,,126008,25286,HEM
7,,SING,CHC,C4B,yes,N,7,,126008,25286,HEM
8,,DOUB,CHC,C1C,yes,N,8,,126008,25286,HEM
9,,SING,CHC,HHC,no,N,9,,126008,25286,HEM
10,,DOUB,CHD,C4C,yes,N,10,,126008,25286,HEM
11,,SING,CHD,C1D,yes,N,11,,126008,25286,HEM
12,,SING,CHD,HHD,no,N,12,,126008,25286,HEM
13,,DOUB,C1A,C2A,yes,N,13,,126008,25286,HEM
14,,SING,C1A,NA,yes,N,14,,126008,25286,HEM
15,,SING,C2A,C3A,yes,N,15,,126008,25286,HEM
16,,SING,C2A,CAA,no,N,16,,126008,25286,HEM
17,,DOUB,C3A,C4A,yes,N,17,,126008,25286,HEM
18,,SING,C3A,CMA,no,N,18,,126008,25286,HEM
19,,SING,C4A,NA,yes,N,19,,126008,25286,HEM
20,,SING,CMA,HMA,no,N,20,,126008,25286,HEM
21,,SING,CMA,HMAA,no,N,21,,126008,25286,HEM
22,,SING,CMA,HMAB,no,N,22,,126008,25286,HEM
23,,SING,CAA,CBA,no,N,23,,126008,25286,HEM
24,,SING,CAA,HAA,no,N,24,,126008,25286,HEM
25,,SING,CAA,HAAA,no,N,25,,126008,25286,HEM
26,,SING,CBA,CGA,no,N,26,,126008,25286,HEM
27,,SING,CBA,HBA,no,N,27,,126008,25286,HEM
28,,SING,CBA,HBAA,no,N,28,,126008,25286,HEM
29,,DOUB,CGA,O1A,no,N,29,,126008,25286,HEM
30,,SING,CGA,O2A,no,N,30,,126008,25286,HEM
31,,SING,C1B,C2B,no,N,31,,126008,25286,HEM
32,,SING,C1B,NB,yes,N,32,,126008,25286,HEM
33,,DOUB,C2B,C3B,yes,N,33,,126008,25286,HEM
34,,SING,C2B,CMB,yes,N,34,,126008,25286,HEM
35,,SING,C3B,C4B,no,N,35,,126008,25286,HEM
36,,SING,C3B,CAB,yes,N,36,,126008,25286,HEM
37,,DOUB,C4B,NB,no,N,37,,126008,25286,HEM
38,,SING,CMB,HMB,yes,N,38,,126008,25286,HEM
39,,SING,CMB,HMBA,no,N,39,,126008,25286,HEM
40,,SING,CMB,HMBB,no,N,40,,126008,25286,HEM
41,,DOUB,CAB,CBB,no,N,41,,126008,25286,HEM
42,,SING,CAB,HAB,no,N,42,,126008,25286,HEM
43,,SING,CBB,HBB,no,N,43,,126008,25286,HEM
44,,SING,CBB,HBBA,no,N,44,,126008,25286,HEM
45,,SING,C1C,C2C,no,N,45,,126008,25286,HEM
46,,SING,C1C,NC,yes,N,46,,126008,25286,HEM
47,,DOUB,C2C,C3C,yes,N,47,,126008,25286,HEM
48,,SING,C2C,CMC,yes,N,48,,126008,25286,HEM
49,,SING,C3C,C4C,no,N,49,,126008,25286,HEM
50,,SING,C3C,CAC,yes,N,50,,126008,25286,HEM
51,,SING,C4C,NC,no,N,51,,126008,25286,HEM
52,,SING,CMC,HMC,yes,N,52,,126008,25286,HEM
53,,SING,CMC,HMCA,no,N,53,,126008,25286,HEM
54,,SING,CMC,HMCB,no,N,54,,126008,25286,HEM
55,,DOUB,CAC,CBC,no,N,55,,126008,25286,HEM
56,,SING,CAC,HAC,no,N,56,,126008,25286,HEM
57,,SING,CBC,HBC,no,N,57,,126008,25286,HEM
58,,SING,CBC,HBCA,no,N,58,,126008,25286,HEM
59,,SING,C1D,C2D,no,N,59,,126008,25286,HEM
60,,DOUB,C1D,ND,yes,N,60,,126008,25286,HEM
61,,DOUB,C2D,C3D,yes,N,61,,126008,25286,HEM
62,,SING,C2D,CMD,yes,N,62,,126008,25286,HEM
63,,SING,C3D,C4D,no,N,63,,126008,25286,HEM
64,,SING,C3D,CAD,yes,N,64,,126008,25286,HEM
65,,SING,C4D,ND,no,N,65,,126008,25286,HEM
66,,SING,CMD,HMD,yes,N,66,,126008,25286,HEM
67,,SING,CMD,HMDA,no,N,67,,126008,25286,HEM
68,,SING,CMD,HMDB,no,N,68,,126008,25286,HEM
8,,SING,CG,HG2,,,,,240394,6146,DHB_2
69,,SING,CAD,CBD,no,N,69,,126008,25286,HEM
70,,SING,CAD,HAD,no,N,70,,126008,25286,HEM
71,,SING,CAD,HADA,no,N,71,,126008,25286,HEM
72,,SING,CBD,CGD,no,N,72,,126008,25286,HEM
73,,SING,CBD,HBD,no,N,73,,126008,25286,HEM
74,,SING,CBD,HBDA,no,N,74,,126008,25286,HEM
75,,DOUB,CGD,O1D,no,N,75,,126008,25286,HEM
76,,SING,CGD,O2D,no,N,76,,126008,25286,HEM
77,,SING,O2A,H2A,no,N,77,,126008,25286,HEM
78,,SING,O2D,H2D,no,N,78,,126008,25286,HEM
79,,SING,FE,NA,no,N,79,,126008,25286,HEM
80,,SING,FE,NB,no,N,80,,126008,25286,HEM
81,,SING,FE,NC,no,N,81,,126008,25286,HEM
82,,SING,FE,ND,no,N,82,,126008,25286,HEM
1,,SING,P24,O26,no,N,1,,126025,25287,SXR
2,,SING,P24,O23,no,N,2,,126025,25287,SXR
3,,SING,P24,O27,no,N,3,,126025,25287,SXR
4,,SING,O27,C28,no,N,4,,126025,25287,SXR
5,,SING,C28,C29,no,N,5,,126025,25287,SXR
6,,SING,C29,C30,no,N,6,,126025,25287,SXR
7,,SING,C29,C31,no,N,7,,126025,25287,SXR
8,,SING,C29,C32,no,N,8,,126025,25287,SXR
9,,SING,C32,O33,no,N,9,,126025,25287,SXR
10,,SING,C32,C34,no,N,10,,126025,25287,SXR
11,,DOUB,C34,O35,no,N,11,,126025,25287,SXR
12,,SING,C34,N36,no,N,12,,126025,25287,SXR
13,,SING,N36,C37,no,N,13,,126025,25287,SXR
14,,SING,C37,C38,no,N,14,,126025,25287,SXR
15,,SING,C38,C39,no,N,15,,126025,25287,SXR
16,,DOUB,C39,O40,no,N,16,,126025,25287,SXR
17,,SING,C39,N41,no,N,17,,126025,25287,SXR
18,,SING,N41,C42,no,N,18,,126025,25287,SXR
19,,SING,C42,C43,no,N,19,,126025,25287,SXR
20,,SING,C43,S1,no,N,20,,126025,25287,SXR
21,,SING,S1,C1,no,N,21,,126025,25287,SXR
22,,DOUB,C11,C10,yes,N,22,,126025,25287,SXR
23,,SING,C11,C6,yes,N,23,,126025,25287,SXR
24,,SING,C10,C9,yes,N,24,,126025,25287,SXR
25,,DOUB,C9,C8,yes,N,25,,126025,25287,SXR
26,,SING,C8,C7,yes,N,26,,126025,25287,SXR
27,,DOUB,C7,C6,yes,N,27,,126025,25287,SXR
28,,SING,C6,C5,no,N,28,,126025,25287,SXR
29,,SING,C5,C4,no,N,29,,126025,25287,SXR
30,,SING,C4,C3,no,N,30,,126025,25287,SXR
31,,DOUB,C3,O3,no,N,31,,126025,25287,SXR
32,,SING,C3,C2,no,N,32,,126025,25287,SXR
33,,SING,C2,C1,no,N,33,,126025,25287,SXR
34,,SING,O26,H1,no,N,34,,126025,25287,SXR
35,,SING,O23,H2,no,N,35,,126025,25287,SXR
36,,SING,C28,H28A,no,N,36,,126025,25287,SXR
37,,SING,C28,H28B,no,N,37,,126025,25287,SXR
38,,SING,C30,H30A,no,N,38,,126025,25287,SXR
39,,SING,C30,H30B,no,N,39,,126025,25287,SXR
40,,SING,C30,H30C,no,N,40,,126025,25287,SXR
41,,SING,C31,H31A,no,N,41,,126025,25287,SXR
42,,SING,C31,H31B,no,N,42,,126025,25287,SXR
43,,SING,C31,H31C,no,N,43,,126025,25287,SXR
44,,SING,C32,H32A,no,N,44,,126025,25287,SXR
45,,SING,O33,H33A,no,N,45,,126025,25287,SXR
46,,SING,N36,H36A,no,N,46,,126025,25287,SXR
47,,SING,C37,H37A,no,N,47,,126025,25287,SXR
48,,SING,C37,H37B,no,N,48,,126025,25287,SXR
49,,SING,C38,H38A,no,N,49,,126025,25287,SXR
50,,SING,C38,H38B,no,N,50,,126025,25287,SXR
51,,SING,N41,H41A,no,N,51,,126025,25287,SXR
52,,SING,C42,H42A,no,N,52,,126025,25287,SXR
53,,SING,C42,H42B,no,N,53,,126025,25287,SXR
54,,SING,C43,H43A,no,N,54,,126025,25287,SXR
55,,SING,C43,H43B,no,N,55,,126025,25287,SXR
56,,SING,C11,H11A,no,N,56,,126025,25287,SXR
57,,SING,C10,H10A,no,N,57,,126025,25287,SXR
58,,SING,C9,H9A,no,N,58,,126025,25287,SXR
59,,SING,C8,H8A,no,N,59,,126025,25287,SXR
60,,SING,C7,H7A,no,N,60,,126025,25287,SXR
61,,SING,C5,H5A,no,N,61,,126025,25287,SXR
62,,SING,C5,H5B,no,N,62,,126025,25287,SXR
63,,SING,C4,H4A,no,N,63,,126025,25287,SXR
64,,SING,C4,H4B,no,N,64,,126025,25287,SXR
65,,SING,C2,H2A,no,N,65,,126025,25287,SXR
66,,SING,C2,H2B,no,N,66,,126025,25287,SXR
67,,SING,C1,H1A,no,N,67,,126025,25287,SXR
68,,SING,C1,H1B,no,N,68,,126025,25287,SXR
1,,SING,N,CA,no,N,1,,126192,25295,ALA
2,,SING,N,H,no,N,2,,126192,25295,ALA
3,,SING,N,H2,no,N,3,,126192,25295,ALA
4,,SING,CA,C,no,N,4,,126192,25295,ALA
5,,SING,CA,CB,no,N,5,,126192,25295,ALA
6,,SING,CA,HA,no,N,6,,126192,25295,ALA
7,,DOUB,C,O,no,N,7,,126192,25295,ALA
8,,SING,C,OXT,no,N,8,,126192,25295,ALA
9,,SING,CB,HB1,no,N,9,,126192,25295,ALA
10,,SING,CB,HB2,no,N,10,,126192,25295,ALA
11,,SING,CB,HB3,no,N,11,,126192,25295,ALA
12,,SING,OXT,HXT,no,N,12,,126192,25295,ALA
1,,SING,N,HN1,no,N,1,,126193,25295,NH2
2,,SING,N,HN2,no,N,2,,126193,25295,NH2
1,,DOUB,CC1,CC2,yes,N,1,,126306,25300,3UQ
2,,SING,CC2,CC3,yes,N,2,,126306,25300,3UQ
3,,DOUB,CC3,CC5,yes,N,3,,126306,25300,3UQ
4,,SING,CC5,CC4,yes,N,4,,126306,25300,3UQ
5,,SING,CC4,CC1,yes,N,5,,126306,25300,3UQ
6,,SING,HC3,CC3,no,N,6,,126306,25300,3UQ
7,,SING,CC1,HC1,no,N,7,,126306,25300,3UQ
8,,SING,CC2,HC2,no,N,8,,126306,25300,3UQ
9,,SING,HC4,CC4,no,N,9,,126306,25300,3UQ
10,,SING,HC5,CC5,no,N,10,,126306,25300,3UQ
11,,DOUB,CA1,CA2,yes,N,11,,126306,25300,3UQ
12,,SING,CA2,CA3,yes,N,12,,126306,25300,3UQ
13,,DOUB,CA3,CA4,yes,N,13,,126306,25300,3UQ
14,,SING,CA4,CA5,yes,N,14,,126306,25300,3UQ
15,,DOUB,CA5,CA6,yes,N,15,,126306,25300,3UQ
16,,SING,CA6,CA1,yes,N,16,,126306,25300,3UQ
17,,SING,CA6,CA7,yes,N,17,,126306,25300,3UQ
18,,DOUB,CA7,CA8,yes,N,18,,126306,25300,3UQ
19,,SING,CA8,CA9,yes,N,19,,126306,25300,3UQ
20,,DOUB,CA9,CA0,yes,N,20,,126306,25300,3UQ
21,,SING,CA0,CA5,yes,N,21,,126306,25300,3UQ
22,,SING,CA1,HA1,no,N,22,,126306,25300,3UQ
23,,SING,CA2,HA2,no,N,23,,126306,25300,3UQ
24,,SING,CA3,HA3,no,N,24,,126306,25300,3UQ
25,,SING,CA4,HA4,no,N,25,,126306,25300,3UQ
26,,SING,CA7,HA7,no,N,26,,126306,25300,3UQ
27,,SING,CA8,HA8,no,N,27,,126306,25300,3UQ
28,,SING,CA9,HA9,no,N,28,,126306,25300,3UQ
29,,SING,CA0,HA0,no,N,29,,126306,25300,3UQ
30,,SING,CC1,RU,no,N,30,,126306,25300,3UQ
31,,SING,CC2,RU,no,N,31,,126306,25300,3UQ
32,,SING,CC3,RU,no,N,32,,126306,25300,3UQ
33,,SING,CC4,RU,no,N,33,,126306,25300,3UQ
34,,SING,CC5,RU,no,N,34,,126306,25300,3UQ
35,,SING,CA1,RU,no,N,35,,126306,25300,3UQ
36,,SING,CA2,RU,no,N,36,,126306,25300,3UQ
37,,SING,CA3,RU,no,N,37,,126306,25300,3UQ
38,,SING,CA4,RU,no,N,38,,126306,25300,3UQ
39,,SING,CA5,RU,no,N,39,,126306,25300,3UQ
40,,SING,CA6,RU,no,N,40,,126306,25300,3UQ
1,,DOUB,C,O,no,N,1,,126597,25316,ACE
2,,SING,C,CH3,no,N,2,,126597,25316,ACE
3,,SING,C,H,no,N,3,,126597,25316,ACE
4,,SING,CH3,H1,no,N,4,,126597,25316,ACE
5,,SING,CH3,H2,no,N,5,,126597,25316,ACE
6,,SING,CH3,H3,no,N,6,,126597,25316,ACE
1,,SING,N,CA,no,N,1,,126598,25316,ALA
2,,SING,N,H,no,N,2,,126598,25316,ALA
3,,SING,N,H2,no,N,3,,126598,25316,ALA
4,,SING,CA,C,no,N,4,,126598,25316,ALA
5,,SING,CA,CB,no,N,5,,126598,25316,ALA
6,,SING,CA,HA,no,N,6,,126598,25316,ALA
7,,DOUB,C,O,no,N,7,,126598,25316,ALA
8,,SING,C,OXT,no,N,8,,126598,25316,ALA
9,,SING,CB,HB1,no,N,9,,126598,25316,ALA
10,,SING,CB,HB2,no,N,10,,126598,25316,ALA
11,,SING,CB,HB3,no,N,11,,126598,25316,ALA
12,,SING,OXT,HXT,no,N,12,,126598,25316,ALA
1,,DOUB,C,O,no,N,1,,126616,25317,ACE
2,,SING,C,CH3,no,N,2,,126616,25317,ACE
3,,SING,C,H,no,N,3,,126616,25317,ACE
4,,SING,CH3,H1,no,N,4,,126616,25317,ACE
5,,SING,CH3,H2,no,N,5,,126616,25317,ACE
6,,SING,CH3,H3,no,N,6,,126616,25317,ACE
1,,SING,N,HN1,no,N,1,,126617,25317,NH2
2,,SING,N,HN2,no,N,2,,126617,25317,NH2
1,,DOUB,C,O,no,N,1,,126635,25318,ACE
2,,SING,C,CH3,no,N,2,,126635,25318,ACE
3,,SING,C,H,no,N,3,,126635,25318,ACE
4,,SING,CH3,H1,no,N,4,,126635,25318,ACE
5,,SING,CH3,H2,no,N,5,,126635,25318,ACE
6,,SING,CH3,H3,no,N,6,,126635,25318,ACE
1,,SING,N,HN1,no,N,1,,126636,25318,NH2
2,,SING,N,HN2,no,N,2,,126636,25318,NH2
1,,DOUB,C,O,no,N,1,,126654,25319,ACE
2,,SING,C,CH3,no,N,2,,126654,25319,ACE
3,,SING,C,H,no,N,3,,126654,25319,ACE
4,,SING,CH3,H1,no,N,4,,126654,25319,ACE
5,,SING,CH3,H2,no,N,5,,126654,25319,ACE
6,,SING,CH3,H3,no,N,6,,126654,25319,ACE
1,,SING,N,HN1,no,N,1,,126655,25319,NH2
2,,SING,N,HN2,no,N,2,,126655,25319,NH2
1,,DOUB,C,O,no,N,1,,126673,25320,ACE
2,,SING,C,CH3,no,N,2,,126673,25320,ACE
3,,SING,C,H,no,N,3,,126673,25320,ACE
4,,SING,CH3,H1,no,N,4,,126673,25320,ACE
5,,SING,CH3,H2,no,N,5,,126673,25320,ACE
6,,SING,CH3,H3,no,N,6,,126673,25320,ACE
1,,SING,N,HN1,no,N,1,,126674,25320,NH2
2,,SING,N,HN2,no,N,2,,126674,25320,NH2
1,,DOUB,C,O,no,N,1,,126692,25321,ACE
2,,SING,C,CH3,no,N,2,,126692,25321,ACE
3,,SING,C,H,no,N,3,,126692,25321,ACE
4,,SING,CH3,H1,no,N,4,,126692,25321,ACE
5,,SING,CH3,H2,no,N,5,,126692,25321,ACE
6,,SING,CH3,H3,no,N,6,,126692,25321,ACE
1,,SING,N,HN1,no,N,1,,126693,25321,NH2
2,,SING,N,HN2,no,N,2,,126693,25321,NH2
1,,DOUB,C,O,no,N,1,,126711,25322,ACE
2,,SING,C,CH3,no,N,2,,126711,25322,ACE
3,,SING,C,H,no,N,3,,126711,25322,ACE
4,,SING,CH3,H1,no,N,4,,126711,25322,ACE
5,,SING,CH3,H2,no,N,5,,126711,25322,ACE
6,,SING,CH3,H3,no,N,6,,126711,25322,ACE
1,,SING,N,HN1,no,N,1,,126712,25322,NH2
2,,SING,N,HN2,no,N,2,,126712,25322,NH2
1,,SING,N,CA,no,N,1,,126730,25323,ARG
2,,SING,N,H,no,N,2,,126730,25323,ARG
3,,SING,N,H2,no,N,3,,126730,25323,ARG
4,,SING,CA,C,no,N,4,,126730,25323,ARG
5,,SING,CA,CB,no,N,5,,126730,25323,ARG
6,,SING,CA,HA,no,N,6,,126730,25323,ARG
7,,DOUB,C,O,no,N,7,,126730,25323,ARG
8,,SING,C,OXT,no,N,8,,126730,25323,ARG
9,,SING,CB,CG,no,N,9,,126730,25323,ARG
10,,SING,CB,HB2,no,N,10,,126730,25323,ARG
11,,SING,CB,HB3,no,N,11,,126730,25323,ARG
12,,SING,CG,CD,no,N,12,,126730,25323,ARG
13,,SING,CG,HG2,no,N,13,,126730,25323,ARG
14,,SING,CG,HG3,no,N,14,,126730,25323,ARG
15,,SING,CD,NE,no,N,15,,126730,25323,ARG
16,,SING,CD,HD2,no,N,16,,126730,25323,ARG
17,,SING,CD,HD3,no,N,17,,126730,25323,ARG
18,,SING,NE,CZ,no,N,18,,126730,25323,ARG
19,,SING,NE,HE,no,N,19,,126730,25323,ARG
20,,SING,CZ,NH1,no,N,20,,126730,25323,ARG
21,,DOUB,CZ,NH2,no,N,21,,126730,25323,ARG
22,,SING,NH1,HH11,no,N,22,,126730,25323,ARG
23,,SING,NH1,HH12,no,N,23,,126730,25323,ARG
24,,SING,NH2,HH21,no,N,24,,126730,25323,ARG
25,,SING,NH2,HH22,no,N,25,,126730,25323,ARG
26,,SING,OXT,HXT,no,N,26,,126730,25323,ARG
1,,SING,C1,C2,no,N,1,,126872,25331,MAN
2,,SING,C1,O1,no,N,2,,126872,25331,MAN
3,,SING,C1,O5,no,N,3,,126872,25331,MAN
4,,SING,C1,H1,no,N,4,,126872,25331,MAN
5,,SING,C2,C3,no,N,5,,126872,25331,MAN
6,,SING,C2,O2,no,N,6,,126872,25331,MAN
7,,SING,C2,H2,no,N,7,,126872,25331,MAN
8,,SING,C3,C4,no,N,8,,126872,25331,MAN
9,,SING,C3,O3,no,N,9,,126872,25331,MAN
10,,SING,C3,H3,no,N,10,,126872,25331,MAN
11,,SING,C4,C5,no,N,11,,126872,25331,MAN
12,,SING,C4,O4,no,N,12,,126872,25331,MAN
13,,SING,C4,H4,no,N,13,,126872,25331,MAN
14,,SING,C5,C6,no,N,14,,126872,25331,MAN
15,,SING,C5,O5,no,N,15,,126872,25331,MAN
16,,SING,C5,H5,no,N,16,,126872,25331,MAN
17,,SING,C6,O6,no,N,17,,126872,25331,MAN
18,,SING,C6,H61,no,N,18,,126872,25331,MAN
19,,SING,C6,H62,no,N,19,,126872,25331,MAN
20,,SING,O1,HO1,no,N,20,,126872,25331,MAN
21,,SING,O2,HO2,no,N,21,,126872,25331,MAN
22,,SING,O3,HO3,no,N,22,,126872,25331,MAN
23,,SING,O4,HO4,no,N,23,,126872,25331,MAN
24,,SING,O6,HO6,no,N,24,,126872,25331,MAN
1,,SING,C1,C2,no,N,1,,126892,25332,MAN
2,,SING,C1,O1,no,N,2,,126892,25332,MAN
3,,SING,C1,O5,no,N,3,,126892,25332,MAN
4,,SING,C1,H1,no,N,4,,126892,25332,MAN
5,,SING,C2,C3,no,N,5,,126892,25332,MAN
6,,SING,C2,O2,no,N,6,,126892,25332,MAN
7,,SING,C2,H2,no,N,7,,126892,25332,MAN
8,,SING,C3,C4,no,N,8,,126892,25332,MAN
9,,SING,C3,O3,no,N,9,,126892,25332,MAN
10,,SING,C3,H3,no,N,10,,126892,25332,MAN
11,,SING,C4,C5,no,N,11,,126892,25332,MAN
12,,SING,C4,O4,no,N,12,,126892,25332,MAN
13,,SING,C4,H4,no,N,13,,126892,25332,MAN
14,,SING,C5,C6,no,N,14,,126892,25332,MAN
15,,SING,C5,O5,no,N,15,,126892,25332,MAN
16,,SING,C5,H5,no,N,16,,126892,25332,MAN
17,,SING,C6,O6,no,N,17,,126892,25332,MAN
18,,SING,C6,H61,no,N,18,,126892,25332,MAN
19,,SING,C6,H62,no,N,19,,126892,25332,MAN
20,,SING,O1,HO1,no,N,20,,126892,25332,MAN
21,,SING,O2,HO2,no,N,21,,126892,25332,MAN
22,,SING,O3,HO3,no,N,22,,126892,25332,MAN
23,,SING,O4,HO4,no,N,23,,126892,25332,MAN
24,,SING,O6,HO6,no,N,24,,126892,25332,MAN
1,,SING,N1,C2,yes,N,1,,127074,25342,FMN
2,,DOUB,N1,C10,yes,N,2,,127074,25342,FMN
3,,DOUB,C2,O2,no,N,3,,127074,25342,FMN
4,,SING,C2,N3,yes,N,4,,127074,25342,FMN
5,,SING,N3,C4,yes,N,5,,127074,25342,FMN
6,,SING,N3,HN3,no,N,6,,127074,25342,FMN
7,,DOUB,C4,O4,no,N,7,,127074,25342,FMN
8,,SING,C4,C4A,yes,N,8,,127074,25342,FMN
9,,DOUB,C4A,N5,yes,N,9,,127074,25342,FMN
10,,SING,C4A,C10,yes,N,10,,127074,25342,FMN
11,,SING,N5,C5A,yes,N,11,,127074,25342,FMN
12,,DOUB,C5A,C6,yes,N,12,,127074,25342,FMN
13,,SING,C5A,C9A,yes,N,13,,127074,25342,FMN
14,,SING,C6,C7,yes,N,14,,127074,25342,FMN
15,,SING,C6,H6,no,N,15,,127074,25342,FMN
16,,SING,C7,C7M,no,N,16,,127074,25342,FMN
17,,DOUB,C7,C8,yes,N,17,,127074,25342,FMN
18,,SING,C7M,HM71,no,N,18,,127074,25342,FMN
19,,SING,C7M,HM72,no,N,19,,127074,25342,FMN
20,,SING,C7M,HM73,no,N,20,,127074,25342,FMN
21,,SING,C8,C8M,no,N,21,,127074,25342,FMN
22,,SING,C8,C9,yes,N,22,,127074,25342,FMN
23,,SING,C8M,HM81,no,N,23,,127074,25342,FMN
24,,SING,C8M,HM82,no,N,24,,127074,25342,FMN
25,,SING,C8M,HM83,no,N,25,,127074,25342,FMN
26,,DOUB,C9,C9A,yes,N,26,,127074,25342,FMN
27,,SING,C9,H9,no,N,27,,127074,25342,FMN
28,,SING,C9A,N10,yes,N,28,,127074,25342,FMN
29,,SING,N10,C10,yes,N,29,,127074,25342,FMN
30,,SING,N10,C1',no,N,30,,127074,25342,FMN
31,,SING,C1',C2',no,N,31,,127074,25342,FMN
32,,SING,C1',H1'1,no,N,32,,127074,25342,FMN
33,,SING,C1',H1'2,no,N,33,,127074,25342,FMN
34,,SING,C2',O2',no,N,34,,127074,25342,FMN
35,,SING,C2',C3',no,N,35,,127074,25342,FMN
9,,SING,CG,HG3,,,,,240394,6146,DHB_2
36,,SING,C2',H2',no,N,36,,127074,25342,FMN
37,,SING,O2',HO2',no,N,37,,127074,25342,FMN
38,,SING,C3',O3',no,N,38,,127074,25342,FMN
39,,SING,C3',C4',no,N,39,,127074,25342,FMN
40,,SING,C3',H3',no,N,40,,127074,25342,FMN
41,,SING,O3',HO3',no,N,41,,127074,25342,FMN
42,,SING,C4',O4',no,N,42,,127074,25342,FMN
43,,SING,C4',C5',no,N,43,,127074,25342,FMN
44,,SING,C4',H4',no,N,44,,127074,25342,FMN
45,,SING,O4',HO4',no,N,45,,127074,25342,FMN
46,,SING,C5',O5',no,N,46,,127074,25342,FMN
47,,SING,C5',H5'1,no,N,47,,127074,25342,FMN
48,,SING,C5',H5'2,no,N,48,,127074,25342,FMN
49,,SING,O5',P,no,N,49,,127074,25342,FMN
50,,DOUB,P,O1P,no,N,50,,127074,25342,FMN
51,,SING,P,O2P,no,N,51,,127074,25342,FMN
52,,SING,P,O3P,no,N,52,,127074,25342,FMN
53,,SING,O2P,HOP2,no,N,53,,127074,25342,FMN
54,,SING,O3P,HOP3,no,N,54,,127074,25342,FMN
1,,SING,N,CA,no,N,1,,127165,25347,MLY
2,,SING,N,H,no,N,2,,127165,25347,MLY
3,,SING,N,H2,no,N,3,,127165,25347,MLY
4,,SING,CA,CB,no,N,4,,127165,25347,MLY
5,,SING,CA,C,no,N,5,,127165,25347,MLY
6,,SING,CA,HA,no,N,6,,127165,25347,MLY
7,,SING,CB,CG,no,N,7,,127165,25347,MLY
8,,SING,CB,HB2,no,N,8,,127165,25347,MLY
9,,SING,CB,HB3,no,N,9,,127165,25347,MLY
10,,SING,CG,CD,no,N,10,,127165,25347,MLY
11,,SING,CG,HG2,no,N,11,,127165,25347,MLY
12,,SING,CG,HG3,no,N,12,,127165,25347,MLY
13,,SING,CD,CE,no,N,13,,127165,25347,MLY
14,,SING,CD,HD2,no,N,14,,127165,25347,MLY
15,,SING,CD,HD3,no,N,15,,127165,25347,MLY
16,,SING,CE,NZ,no,N,16,,127165,25347,MLY
17,,SING,CE,HE2,no,N,17,,127165,25347,MLY
18,,SING,CE,HE3,no,N,18,,127165,25347,MLY
19,,SING,NZ,CH1,no,N,19,,127165,25347,MLY
20,,SING,NZ,CH2,no,N,20,,127165,25347,MLY
21,,SING,CH1,HH11,no,N,21,,127165,25347,MLY
22,,SING,CH1,HH12,no,N,22,,127165,25347,MLY
23,,SING,CH1,HH13,no,N,23,,127165,25347,MLY
24,,SING,CH2,HH21,no,N,24,,127165,25347,MLY
25,,SING,CH2,HH22,no,N,25,,127165,25347,MLY
26,,SING,CH2,HH23,no,N,26,,127165,25347,MLY
27,,DOUB,C,O,no,N,27,,127165,25347,MLY
28,,SING,C,OXT,no,N,28,,127165,25347,MLY
29,,SING,OXT,HXT,no,N,29,,127165,25347,MLY
1,,SING,N,CA,no,N,1,,127193,25348,MLY
2,,SING,N,H,no,N,2,,127193,25348,MLY
3,,SING,N,H2,no,N,3,,127193,25348,MLY
4,,SING,CA,CB,no,N,4,,127193,25348,MLY
5,,SING,CA,C,no,N,5,,127193,25348,MLY
6,,SING,CA,HA,no,N,6,,127193,25348,MLY
7,,SING,CB,CG,no,N,7,,127193,25348,MLY
8,,SING,CB,HB2,no,N,8,,127193,25348,MLY
9,,SING,CB,HB3,no,N,9,,127193,25348,MLY
10,,SING,CG,CD,no,N,10,,127193,25348,MLY
11,,SING,CG,HG2,no,N,11,,127193,25348,MLY
12,,SING,CG,HG3,no,N,12,,127193,25348,MLY
13,,SING,CD,CE,no,N,13,,127193,25348,MLY
14,,SING,CD,HD2,no,N,14,,127193,25348,MLY
15,,SING,CD,HD3,no,N,15,,127193,25348,MLY
16,,SING,CE,NZ,no,N,16,,127193,25348,MLY
17,,SING,CE,HE2,no,N,17,,127193,25348,MLY
18,,SING,CE,HE3,no,N,18,,127193,25348,MLY
19,,SING,NZ,CH1,no,N,19,,127193,25348,MLY
20,,SING,NZ,CH2,no,N,20,,127193,25348,MLY
21,,SING,CH1,HH11,no,N,21,,127193,25348,MLY
22,,SING,CH1,HH12,no,N,22,,127193,25348,MLY
23,,SING,CH1,HH13,no,N,23,,127193,25348,MLY
24,,SING,CH2,HH21,no,N,24,,127193,25348,MLY
25,,SING,CH2,HH22,no,N,25,,127193,25348,MLY
26,,SING,CH2,HH23,no,N,26,,127193,25348,MLY
27,,DOUB,C,O,no,N,27,,127193,25348,MLY
28,,SING,C,OXT,no,N,28,,127193,25348,MLY
29,,SING,OXT,HXT,no,N,29,,127193,25348,MLY
1,,DOUB,PA,O1A,no,N,1,,127392,25360,AP5
2,,SING,PA,O2A,no,N,2,,127392,25360,AP5
3,,SING,PA,O3A,no,N,3,,127392,25360,AP5
4,,SING,PA,O5F,no,N,4,,127392,25360,AP5
5,,SING,O2A,HOA2,no,N,5,,127392,25360,AP5
6,,SING,O3A,PB,no,N,6,,127392,25360,AP5
7,,DOUB,PB,O1B,no,N,7,,127392,25360,AP5
8,,SING,PB,O2B,no,N,8,,127392,25360,AP5
9,,SING,PB,O3B,no,N,9,,127392,25360,AP5
10,,SING,O2B,HOB2,no,N,10,,127392,25360,AP5
11,,SING,O3B,PG,no,N,11,,127392,25360,AP5
12,,DOUB,PG,O1G,no,N,12,,127392,25360,AP5
13,,SING,PG,O2G,no,N,13,,127392,25360,AP5
14,,SING,PG,O3G,no,N,14,,127392,25360,AP5
15,,SING,O2G,HOG2,no,N,15,,127392,25360,AP5
16,,SING,O3G,PD,no,N,16,,127392,25360,AP5
17,,DOUB,PD,O1D,no,N,17,,127392,25360,AP5
18,,SING,PD,O2D,no,N,18,,127392,25360,AP5
19,,SING,PD,O3D,no,N,19,,127392,25360,AP5
20,,SING,O2D,HOD2,no,N,20,,127392,25360,AP5
21,,SING,O3D,PE,no,N,21,,127392,25360,AP5
22,,DOUB,PE,O1E,no,N,22,,127392,25360,AP5
23,,SING,PE,O2E,no,N,23,,127392,25360,AP5
24,,SING,PE,O5J,no,N,24,,127392,25360,AP5
25,,SING,O2E,HOE2,no,N,25,,127392,25360,AP5
26,,SING,O5F,C5F,no,N,26,,127392,25360,AP5
10,,DOUB,C,O,,,,,240394,6146,DHB_2
27,,SING,C5F,C4F,no,N,27,,127392,25360,AP5
28,,SING,C5F,H51A,no,N,28,,127392,25360,AP5
29,,SING,C5F,H52A,no,N,29,,127392,25360,AP5
30,,SING,C4F,O4F,no,N,30,,127392,25360,AP5
31,,SING,C4F,C3F,no,N,31,,127392,25360,AP5
32,,SING,C4F,H4F,no,N,32,,127392,25360,AP5
33,,SING,O4F,C1F,no,N,33,,127392,25360,AP5
34,,SING,C3F,O3F,no,N,34,,127392,25360,AP5
35,,SING,C3F,C2F,no,N,35,,127392,25360,AP5
36,,SING,C3F,H3F,no,N,36,,127392,25360,AP5
37,,SING,O3F,HO3A,no,N,37,,127392,25360,AP5
38,,SING,C2F,O2F,no,N,38,,127392,25360,AP5
39,,SING,C2F,C1F,no,N,39,,127392,25360,AP5
40,,SING,C2F,H2F,no,N,40,,127392,25360,AP5
41,,SING,O2F,HO2A,no,N,41,,127392,25360,AP5
42,,SING,C1F,N9A,no,N,42,,127392,25360,AP5
43,,SING,C1F,H1F,no,N,43,,127392,25360,AP5
44,,SING,N9A,C8A,yes,N,44,,127392,25360,AP5
45,,SING,N9A,C4A,yes,N,45,,127392,25360,AP5
46,,DOUB,C8A,N7A,yes,N,46,,127392,25360,AP5
47,,SING,C8A,H8A,no,N,47,,127392,25360,AP5
48,,SING,N7A,C5A,yes,N,48,,127392,25360,AP5
49,,SING,C5A,C6A,yes,N,49,,127392,25360,AP5
50,,DOUB,C5A,C4A,yes,N,50,,127392,25360,AP5
51,,SING,C6A,N6A,no,N,51,,127392,25360,AP5
52,,DOUB,C6A,N1A,yes,N,52,,127392,25360,AP5
53,,SING,N6A,H61A,no,N,53,,127392,25360,AP5
54,,SING,N6A,H62A,no,N,54,,127392,25360,AP5
55,,SING,N1A,C2A,yes,N,55,,127392,25360,AP5
56,,DOUB,C2A,N3A,yes,N,56,,127392,25360,AP5
57,,SING,C2A,H2A,no,N,57,,127392,25360,AP5
58,,SING,N3A,C4A,yes,N,58,,127392,25360,AP5
59,,SING,O5J,C5J,no,N,59,,127392,25360,AP5
60,,SING,C5J,C4J,no,N,60,,127392,25360,AP5
61,,SING,C5J,H51B,no,N,61,,127392,25360,AP5
62,,SING,C5J,H52B,no,N,62,,127392,25360,AP5
63,,SING,C4J,O4J,no,N,63,,127392,25360,AP5
64,,SING,C4J,C3J,no,N,64,,127392,25360,AP5
65,,SING,C4J,H4J,no,N,65,,127392,25360,AP5
66,,SING,O4J,C1J,no,N,66,,127392,25360,AP5
67,,SING,C3J,O3J,no,N,67,,127392,25360,AP5
68,,SING,C3J,C2J,no,N,68,,127392,25360,AP5
69,,SING,C3J,H3J,no,N,69,,127392,25360,AP5
70,,SING,O3J,HO3B,no,N,70,,127392,25360,AP5
71,,SING,C2J,O2J,no,N,71,,127392,25360,AP5
72,,SING,C2J,C1J,no,N,72,,127392,25360,AP5
73,,SING,C2J,H2J,no,N,73,,127392,25360,AP5
74,,SING,O2J,HO2B,no,N,74,,127392,25360,AP5
75,,SING,C1J,N9B,no,N,75,,127392,25360,AP5
76,,SING,C1J,H1J,no,N,76,,127392,25360,AP5
77,,SING,N9B,C8B,yes,N,77,,127392,25360,AP5
78,,SING,N9B,C4B,yes,N,78,,127392,25360,AP5
79,,DOUB,C8B,N7B,yes,N,79,,127392,25360,AP5
80,,SING,C8B,H8B,no,N,80,,127392,25360,AP5
81,,SING,N7B,C5B,yes,N,81,,127392,25360,AP5
82,,SING,C5B,C6B,yes,N,82,,127392,25360,AP5
83,,DOUB,C5B,C4B,yes,N,83,,127392,25360,AP5
84,,SING,C6B,N6B,no,N,84,,127392,25360,AP5
85,,DOUB,C6B,N1B,yes,N,85,,127392,25360,AP5
86,,SING,N6B,H61B,no,N,86,,127392,25360,AP5
87,,SING,N6B,H62B,no,N,87,,127392,25360,AP5
88,,SING,N1B,C2B,yes,N,88,,127392,25360,AP5
89,,DOUB,C2B,N3B,yes,N,89,,127392,25360,AP5
90,,SING,C2B,H2B,no,N,90,,127392,25360,AP5
91,,SING,N3B,C4B,yes,N,91,,127392,25360,AP5
1,,DOUB,PA,O1A,no,N,1,,127408,25361,AP5
2,,SING,PA,O2A,no,N,2,,127408,25361,AP5
3,,SING,PA,O3A,no,N,3,,127408,25361,AP5
4,,SING,PA,O5F,no,N,4,,127408,25361,AP5
5,,SING,O2A,HOA2,no,N,5,,127408,25361,AP5
6,,SING,O3A,PB,no,N,6,,127408,25361,AP5
7,,DOUB,PB,O1B,no,N,7,,127408,25361,AP5
8,,SING,PB,O2B,no,N,8,,127408,25361,AP5
9,,SING,PB,O3B,no,N,9,,127408,25361,AP5
10,,SING,O2B,HOB2,no,N,10,,127408,25361,AP5
11,,SING,O3B,PG,no,N,11,,127408,25361,AP5
12,,DOUB,PG,O1G,no,N,12,,127408,25361,AP5
13,,SING,PG,O2G,no,N,13,,127408,25361,AP5
14,,SING,PG,O3G,no,N,14,,127408,25361,AP5
15,,SING,O2G,HOG2,no,N,15,,127408,25361,AP5
16,,SING,O3G,PD,no,N,16,,127408,25361,AP5
17,,DOUB,PD,O1D,no,N,17,,127408,25361,AP5
18,,SING,PD,O2D,no,N,18,,127408,25361,AP5
19,,SING,PD,O3D,no,N,19,,127408,25361,AP5
20,,SING,O2D,HOD2,no,N,20,,127408,25361,AP5
21,,SING,O3D,PE,no,N,21,,127408,25361,AP5
22,,DOUB,PE,O1E,no,N,22,,127408,25361,AP5
23,,SING,PE,O2E,no,N,23,,127408,25361,AP5
24,,SING,PE,O5J,no,N,24,,127408,25361,AP5
25,,SING,O2E,HOE2,no,N,25,,127408,25361,AP5
26,,SING,O5F,C5F,no,N,26,,127408,25361,AP5
27,,SING,C5F,C4F,no,N,27,,127408,25361,AP5
28,,SING,C5F,H51A,no,N,28,,127408,25361,AP5
29,,SING,C5F,H52A,no,N,29,,127408,25361,AP5
30,,SING,C4F,O4F,no,N,30,,127408,25361,AP5
31,,SING,C4F,C3F,no,N,31,,127408,25361,AP5
32,,SING,C4F,H4F,no,N,32,,127408,25361,AP5
33,,SING,O4F,C1F,no,N,33,,127408,25361,AP5
34,,SING,C3F,O3F,no,N,34,,127408,25361,AP5
35,,SING,C3F,C2F,no,N,35,,127408,25361,AP5
36,,SING,C3F,H3F,no,N,36,,127408,25361,AP5
37,,SING,O3F,HO3A,no,N,37,,127408,25361,AP5
38,,SING,C2F,O2F,no,N,38,,127408,25361,AP5
39,,SING,C2F,C1F,no,N,39,,127408,25361,AP5
40,,SING,C2F,H2F,no,N,40,,127408,25361,AP5
41,,SING,O2F,HO2A,no,N,41,,127408,25361,AP5
42,,SING,C1F,N9A,no,N,42,,127408,25361,AP5
43,,SING,C1F,H1F,no,N,43,,127408,25361,AP5
44,,SING,N9A,C8A,yes,N,44,,127408,25361,AP5
45,,SING,N9A,C4A,yes,N,45,,127408,25361,AP5
46,,DOUB,C8A,N7A,yes,N,46,,127408,25361,AP5
47,,SING,C8A,H8A,no,N,47,,127408,25361,AP5
48,,SING,N7A,C5A,yes,N,48,,127408,25361,AP5
49,,SING,C5A,C6A,yes,N,49,,127408,25361,AP5
50,,DOUB,C5A,C4A,yes,N,50,,127408,25361,AP5
51,,SING,C6A,N6A,no,N,51,,127408,25361,AP5
52,,DOUB,C6A,N1A,yes,N,52,,127408,25361,AP5
53,,SING,N6A,H61A,no,N,53,,127408,25361,AP5
54,,SING,N6A,H62A,no,N,54,,127408,25361,AP5
55,,SING,N1A,C2A,yes,N,55,,127408,25361,AP5
56,,DOUB,C2A,N3A,yes,N,56,,127408,25361,AP5
57,,SING,C2A,H2A,no,N,57,,127408,25361,AP5
58,,SING,N3A,C4A,yes,N,58,,127408,25361,AP5
59,,SING,O5J,C5J,no,N,59,,127408,25361,AP5
60,,SING,C5J,C4J,no,N,60,,127408,25361,AP5
61,,SING,C5J,H51B,no,N,61,,127408,25361,AP5
62,,SING,C5J,H52B,no,N,62,,127408,25361,AP5
63,,SING,C4J,O4J,no,N,63,,127408,25361,AP5
64,,SING,C4J,C3J,no,N,64,,127408,25361,AP5
65,,SING,C4J,H4J,no,N,65,,127408,25361,AP5
66,,SING,O4J,C1J,no,N,66,,127408,25361,AP5
67,,SING,C3J,O3J,no,N,67,,127408,25361,AP5
68,,SING,C3J,C2J,no,N,68,,127408,25361,AP5
69,,SING,C3J,H3J,no,N,69,,127408,25361,AP5
70,,SING,O3J,HO3B,no,N,70,,127408,25361,AP5
71,,SING,C2J,O2J,no,N,71,,127408,25361,AP5
72,,SING,C2J,C1J,no,N,72,,127408,25361,AP5
73,,SING,C2J,H2J,no,N,73,,127408,25361,AP5
74,,SING,O2J,HO2B,no,N,74,,127408,25361,AP5
75,,SING,C1J,N9B,no,N,75,,127408,25361,AP5
76,,SING,C1J,H1J,no,N,76,,127408,25361,AP5
77,,SING,N9B,C8B,yes,N,77,,127408,25361,AP5
78,,SING,N9B,C4B,yes,N,78,,127408,25361,AP5
79,,DOUB,C8B,N7B,yes,N,79,,127408,25361,AP5
80,,SING,C8B,H8B,no,N,80,,127408,25361,AP5
81,,SING,N7B,C5B,yes,N,81,,127408,25361,AP5
82,,SING,C5B,C6B,yes,N,82,,127408,25361,AP5
83,,DOUB,C5B,C4B,yes,N,83,,127408,25361,AP5
84,,SING,C6B,N6B,no,N,84,,127408,25361,AP5
85,,DOUB,C6B,N1B,yes,N,85,,127408,25361,AP5
86,,SING,N6B,H61B,no,N,86,,127408,25361,AP5
87,,SING,N6B,H62B,no,N,87,,127408,25361,AP5
88,,SING,N1B,C2B,yes,N,88,,127408,25361,AP5
89,,DOUB,C2B,N3B,yes,N,89,,127408,25361,AP5
90,,SING,C2B,H2B,no,N,90,,127408,25361,AP5
91,,SING,N3B,C4B,yes,N,91,,127408,25361,AP5
1,,DOUB,PA,O1A,no,N,1,,127424,25362,AP5
2,,SING,PA,O2A,no,N,2,,127424,25362,AP5
3,,SING,PA,O3A,no,N,3,,127424,25362,AP5
4,,SING,PA,O5F,no,N,4,,127424,25362,AP5
5,,SING,O2A,HOA2,no,N,5,,127424,25362,AP5
6,,SING,O3A,PB,no,N,6,,127424,25362,AP5
7,,DOUB,PB,O1B,no,N,7,,127424,25362,AP5
8,,SING,PB,O2B,no,N,8,,127424,25362,AP5
9,,SING,PB,O3B,no,N,9,,127424,25362,AP5
10,,SING,O2B,HOB2,no,N,10,,127424,25362,AP5
11,,SING,O3B,PG,no,N,11,,127424,25362,AP5
12,,DOUB,PG,O1G,no,N,12,,127424,25362,AP5
13,,SING,PG,O2G,no,N,13,,127424,25362,AP5
14,,SING,PG,O3G,no,N,14,,127424,25362,AP5
15,,SING,O2G,HOG2,no,N,15,,127424,25362,AP5
16,,SING,O3G,PD,no,N,16,,127424,25362,AP5
17,,DOUB,PD,O1D,no,N,17,,127424,25362,AP5
18,,SING,PD,O2D,no,N,18,,127424,25362,AP5
19,,SING,PD,O3D,no,N,19,,127424,25362,AP5
20,,SING,O2D,HOD2,no,N,20,,127424,25362,AP5
21,,SING,O3D,PE,no,N,21,,127424,25362,AP5
22,,DOUB,PE,O1E,no,N,22,,127424,25362,AP5
23,,SING,PE,O2E,no,N,23,,127424,25362,AP5
24,,SING,PE,O5J,no,N,24,,127424,25362,AP5
25,,SING,O2E,HOE2,no,N,25,,127424,25362,AP5
26,,SING,O5F,C5F,no,N,26,,127424,25362,AP5
27,,SING,C5F,C4F,no,N,27,,127424,25362,AP5
28,,SING,C5F,H51A,no,N,28,,127424,25362,AP5
29,,SING,C5F,H52A,no,N,29,,127424,25362,AP5
30,,SING,C4F,O4F,no,N,30,,127424,25362,AP5
31,,SING,C4F,C3F,no,N,31,,127424,25362,AP5
32,,SING,C4F,H4F,no,N,32,,127424,25362,AP5
33,,SING,O4F,C1F,no,N,33,,127424,25362,AP5
34,,SING,C3F,O3F,no,N,34,,127424,25362,AP5
35,,SING,C3F,C2F,no,N,35,,127424,25362,AP5
36,,SING,C3F,H3F,no,N,36,,127424,25362,AP5
37,,SING,O3F,HO3A,no,N,37,,127424,25362,AP5
38,,SING,C2F,O2F,no,N,38,,127424,25362,AP5
39,,SING,C2F,C1F,no,N,39,,127424,25362,AP5
40,,SING,C2F,H2F,no,N,40,,127424,25362,AP5
41,,SING,O2F,HO2A,no,N,41,,127424,25362,AP5
42,,SING,C1F,N9A,no,N,42,,127424,25362,AP5
43,,SING,C1F,H1F,no,N,43,,127424,25362,AP5
44,,SING,N9A,C8A,yes,N,44,,127424,25362,AP5
45,,SING,N9A,C4A,yes,N,45,,127424,25362,AP5
46,,DOUB,C8A,N7A,yes,N,46,,127424,25362,AP5
47,,SING,C8A,H8A,no,N,47,,127424,25362,AP5
48,,SING,N7A,C5A,yes,N,48,,127424,25362,AP5
49,,SING,C5A,C6A,yes,N,49,,127424,25362,AP5
50,,DOUB,C5A,C4A,yes,N,50,,127424,25362,AP5
51,,SING,C6A,N6A,no,N,51,,127424,25362,AP5
52,,DOUB,C6A,N1A,yes,N,52,,127424,25362,AP5
53,,SING,N6A,H61A,no,N,53,,127424,25362,AP5
54,,SING,N6A,H62A,no,N,54,,127424,25362,AP5
55,,SING,N1A,C2A,yes,N,55,,127424,25362,AP5
56,,DOUB,C2A,N3A,yes,N,56,,127424,25362,AP5
57,,SING,C2A,H2A,no,N,57,,127424,25362,AP5
58,,SING,N3A,C4A,yes,N,58,,127424,25362,AP5
59,,SING,O5J,C5J,no,N,59,,127424,25362,AP5
60,,SING,C5J,C4J,no,N,60,,127424,25362,AP5
61,,SING,C5J,H51B,no,N,61,,127424,25362,AP5
62,,SING,C5J,H52B,no,N,62,,127424,25362,AP5
63,,SING,C4J,O4J,no,N,63,,127424,25362,AP5
64,,SING,C4J,C3J,no,N,64,,127424,25362,AP5
65,,SING,C4J,H4J,no,N,65,,127424,25362,AP5
66,,SING,O4J,C1J,no,N,66,,127424,25362,AP5
67,,SING,C3J,O3J,no,N,67,,127424,25362,AP5
68,,SING,C3J,C2J,no,N,68,,127424,25362,AP5
69,,SING,C3J,H3J,no,N,69,,127424,25362,AP5
70,,SING,O3J,HO3B,no,N,70,,127424,25362,AP5
71,,SING,C2J,O2J,no,N,71,,127424,25362,AP5
72,,SING,C2J,C1J,no,N,72,,127424,25362,AP5
73,,SING,C2J,H2J,no,N,73,,127424,25362,AP5
74,,SING,O2J,HO2B,no,N,74,,127424,25362,AP5
75,,SING,C1J,N9B,no,N,75,,127424,25362,AP5
76,,SING,C1J,H1J,no,N,76,,127424,25362,AP5
77,,SING,N9B,C8B,yes,N,77,,127424,25362,AP5
78,,SING,N9B,C4B,yes,N,78,,127424,25362,AP5
79,,DOUB,C8B,N7B,yes,N,79,,127424,25362,AP5
80,,SING,C8B,H8B,no,N,80,,127424,25362,AP5
81,,SING,N7B,C5B,yes,N,81,,127424,25362,AP5
82,,SING,C5B,C6B,yes,N,82,,127424,25362,AP5
83,,DOUB,C5B,C4B,yes,N,83,,127424,25362,AP5
84,,SING,C6B,N6B,no,N,84,,127424,25362,AP5
85,,DOUB,C6B,N1B,yes,N,85,,127424,25362,AP5
86,,SING,N6B,H61B,no,N,86,,127424,25362,AP5
87,,SING,N6B,H62B,no,N,87,,127424,25362,AP5
88,,SING,N1B,C2B,yes,N,88,,127424,25362,AP5
89,,DOUB,C2B,N3B,yes,N,89,,127424,25362,AP5
90,,SING,C2B,H2B,no,N,90,,127424,25362,AP5
91,,SING,N3B,C4B,yes,N,91,,127424,25362,AP5
1,,SING,OP3,P,no,N,1,,127538,25369,8OG
2,,SING,OP3,HOP3,no,N,2,,127538,25369,8OG
3,,DOUB,P,OP1,no,N,3,,127538,25369,8OG
4,,SING,P,OP2,no,N,4,,127538,25369,8OG
5,,SING,P,O5',no,N,5,,127538,25369,8OG
6,,SING,OP2,HOP2,no,N,6,,127538,25369,8OG
7,,SING,O5',C5',no,N,7,,127538,25369,8OG
8,,SING,C5',C4',no,N,8,,127538,25369,8OG
9,,SING,C5',H5',no,N,9,,127538,25369,8OG
10,,SING,C5',H5'',no,N,10,,127538,25369,8OG
11,,SING,C4',O4',no,N,11,,127538,25369,8OG
12,,SING,C4',C3',no,N,12,,127538,25369,8OG
13,,SING,C4',H4',no,N,13,,127538,25369,8OG
14,,SING,O4',C1',no,N,14,,127538,25369,8OG
15,,SING,C3',O3',no,N,15,,127538,25369,8OG
16,,SING,C3',C2',no,N,16,,127538,25369,8OG
17,,SING,C3',H3',no,N,17,,127538,25369,8OG
18,,SING,O3',HO3',no,N,18,,127538,25369,8OG
19,,SING,C2',C1',no,N,19,,127538,25369,8OG
20,,SING,C2',H2',no,N,20,,127538,25369,8OG
21,,SING,C2',H2'',no,N,21,,127538,25369,8OG
22,,SING,C1',N9,no,N,22,,127538,25369,8OG
23,,SING,C1',H1',no,N,23,,127538,25369,8OG
24,,SING,N9,C8,no,N,24,,127538,25369,8OG
25,,SING,N9,C4,no,N,25,,127538,25369,8OG
26,,SING,C8,N7,no,N,26,,127538,25369,8OG
27,,DOUB,C8,O8,no,N,27,,127538,25369,8OG
28,,SING,N7,C5,no,N,28,,127538,25369,8OG
29,,SING,N7,H7,no,N,29,,127538,25369,8OG
30,,SING,C5,C6,no,N,30,,127538,25369,8OG
31,,DOUB,C5,C4,no,N,31,,127538,25369,8OG
32,,DOUB,C6,O6,no,N,32,,127538,25369,8OG
33,,SING,C6,N1,no,N,33,,127538,25369,8OG
34,,SING,N1,C2,no,N,34,,127538,25369,8OG
35,,SING,N1,H1,no,N,35,,127538,25369,8OG
36,,SING,C2,N2,no,N,36,,127538,25369,8OG
37,,DOUB,C2,N3,no,N,37,,127538,25369,8OG
38,,SING,N2,H21,no,N,38,,127538,25369,8OG
39,,SING,N2,H22,no,N,39,,127538,25369,8OG
40,,SING,N3,C4,no,N,40,,127538,25369,8OG
1,,SING,OP3,P,no,N,1,,127669,25378,8OG
2,,SING,OP3,HOP3,no,N,2,,127669,25378,8OG
3,,DOUB,P,OP1,no,N,3,,127669,25378,8OG
4,,SING,P,OP2,no,N,4,,127669,25378,8OG
5,,SING,P,O5',no,N,5,,127669,25378,8OG
6,,SING,OP2,HOP2,no,N,6,,127669,25378,8OG
7,,SING,O5',C5',no,N,7,,127669,25378,8OG
8,,SING,C5',C4',no,N,8,,127669,25378,8OG
9,,SING,C5',H5',no,N,9,,127669,25378,8OG
10,,SING,C5',H5'',no,N,10,,127669,25378,8OG
11,,SING,C4',O4',no,N,11,,127669,25378,8OG
12,,SING,C4',C3',no,N,12,,127669,25378,8OG
13,,SING,C4',H4',no,N,13,,127669,25378,8OG
14,,SING,O4',C1',no,N,14,,127669,25378,8OG
15,,SING,C3',O3',no,N,15,,127669,25378,8OG
16,,SING,C3',C2',no,N,16,,127669,25378,8OG
17,,SING,C3',H3',no,N,17,,127669,25378,8OG
18,,SING,O3',HO3',no,N,18,,127669,25378,8OG
19,,SING,C2',C1',no,N,19,,127669,25378,8OG
20,,SING,C2',H2',no,N,20,,127669,25378,8OG
21,,SING,C2',H2'',no,N,21,,127669,25378,8OG
22,,SING,C1',N9,no,N,22,,127669,25378,8OG
23,,SING,C1',H1',no,N,23,,127669,25378,8OG
24,,SING,N9,C8,no,N,24,,127669,25378,8OG
25,,SING,N9,C4,no,N,25,,127669,25378,8OG
26,,SING,C8,N7,no,N,26,,127669,25378,8OG
27,,DOUB,C8,O8,no,N,27,,127669,25378,8OG
28,,SING,N7,C5,no,N,28,,127669,25378,8OG
29,,SING,N7,H7,no,N,29,,127669,25378,8OG
30,,SING,C5,C6,no,N,30,,127669,25378,8OG
31,,DOUB,C5,C4,no,N,31,,127669,25378,8OG
32,,DOUB,C6,O6,no,N,32,,127669,25378,8OG
33,,SING,C6,N1,no,N,33,,127669,25378,8OG
34,,SING,N1,C2,no,N,34,,127669,25378,8OG
35,,SING,N1,H1,no,N,35,,127669,25378,8OG
36,,SING,C2,N2,no,N,36,,127669,25378,8OG
37,,DOUB,C2,N3,no,N,37,,127669,25378,8OG
38,,SING,N2,H21,no,N,38,,127669,25378,8OG
39,,SING,N2,H22,no,N,39,,127669,25378,8OG
40,,SING,N3,C4,no,N,40,,127669,25378,8OG
1,,DOUB,OP1,P,no,N,1,,127670,25378,3ZO
2,,SING,OP2,P,no,N,2,,127670,25378,3ZO
3,,SING,P,O5',no,N,3,,127670,25378,3ZO
4,,SING,O5',C5',no,N,4,,127670,25378,3ZO
5,,SING,C5',C4',no,N,5,,127670,25378,3ZO
6,,SING,C4',C3',no,N,6,,127670,25378,3ZO
7,,SING,C4',O4',no,N,7,,127670,25378,3ZO
8,,SING,C3',C2',no,N,8,,127670,25378,3ZO
9,,SING,C3',O3',no,N,9,,127670,25378,3ZO
10,,SING,O4',C1',no,N,10,,127670,25378,3ZO
11,,DOUB,C8,N7,yes,N,11,,127670,25378,3ZO
12,,SING,C8,N9,yes,N,12,,127670,25378,3ZO
13,,SING,C2',C1',no,N,13,,127670,25378,3ZO
14,,SING,N7,C5,yes,N,14,,127670,25378,3ZO
15,,SING,C1',N9,no,N,15,,127670,25378,3ZO
16,,SING,N9,C4,yes,N,16,,127670,25378,3ZO
17,,DOUB,C5,C4,yes,N,17,,127670,25378,3ZO
18,,SING,C5,C6,no,N,18,,127670,25378,3ZO
19,,SING,C4,N3,no,N,19,,127670,25378,3ZO
20,,DOUB,O6,C6,no,N,20,,127670,25378,3ZO
21,,SING,C6,N1,no,N,21,,127670,25378,3ZO
22,,SING,N3,C2,no,N,22,,127670,25378,3ZO
23,,SING,N1,C2,no,N,23,,127670,25378,3ZO
24,,DOUB,C2,O2,no,N,24,,127670,25378,3ZO
25,,SING,P,OP3,no,N,25,,127670,25378,3ZO
26,,SING,C5',H5'',no,N,26,,127670,25378,3ZO
27,,SING,C5',H5',no,N,27,,127670,25378,3ZO
28,,SING,C4',H4',no,N,28,,127670,25378,3ZO
29,,SING,C3',H3',no,N,29,,127670,25378,3ZO
30,,SING,O3',H2,no,N,30,,127670,25378,3ZO
31,,SING,C2',H2',no,N,31,,127670,25378,3ZO
32,,SING,C2',H2'',no,N,32,,127670,25378,3ZO
33,,SING,C1',H1',no,N,33,,127670,25378,3ZO
34,,SING,N1,H1,no,N,34,,127670,25378,3ZO
35,,SING,N3,H3,no,N,35,,127670,25378,3ZO
36,,SING,C8,H8,no,N,36,,127670,25378,3ZO
37,,SING,OP2,H4,no,N,37,,127670,25378,3ZO
38,,SING,OP3,HOP3,no,N,38,,127670,25378,3ZO
1,,SING,CHA,C1A,yes,N,1,,127846,25389,HEM
2,,DOUB,CHA,C4D,yes,N,2,,127846,25389,HEM
3,,SING,CHA,HHA,no,N,3,,127846,25389,HEM
4,,SING,CHB,C4A,yes,N,4,,127846,25389,HEM
5,,DOUB,CHB,C1B,yes,N,5,,127846,25389,HEM
6,,SING,CHB,HHB,no,N,6,,127846,25389,HEM
7,,SING,CHC,C4B,yes,N,7,,127846,25389,HEM
8,,DOUB,CHC,C1C,yes,N,8,,127846,25389,HEM
9,,SING,CHC,HHC,no,N,9,,127846,25389,HEM
10,,DOUB,CHD,C4C,yes,N,10,,127846,25389,HEM
11,,SING,CHD,C1D,yes,N,11,,127846,25389,HEM
12,,SING,CHD,HHD,no,N,12,,127846,25389,HEM
13,,DOUB,C1A,C2A,yes,N,13,,127846,25389,HEM
14,,SING,C1A,NA,yes,N,14,,127846,25389,HEM
15,,SING,C2A,C3A,yes,N,15,,127846,25389,HEM
16,,SING,C2A,CAA,no,N,16,,127846,25389,HEM
17,,DOUB,C3A,C4A,yes,N,17,,127846,25389,HEM
18,,SING,C3A,CMA,no,N,18,,127846,25389,HEM
19,,SING,C4A,NA,yes,N,19,,127846,25389,HEM
20,,SING,CMA,HMA,no,N,20,,127846,25389,HEM
21,,SING,CMA,HMAA,no,N,21,,127846,25389,HEM
22,,SING,CMA,HMAB,no,N,22,,127846,25389,HEM
23,,SING,CAA,CBA,no,N,23,,127846,25389,HEM
24,,SING,CAA,HAA,no,N,24,,127846,25389,HEM
25,,SING,CAA,HAAA,no,N,25,,127846,25389,HEM
26,,SING,CBA,CGA,no,N,26,,127846,25389,HEM
27,,SING,CBA,HBA,no,N,27,,127846,25389,HEM
28,,SING,CBA,HBAA,no,N,28,,127846,25389,HEM
29,,DOUB,CGA,O1A,no,N,29,,127846,25389,HEM
30,,SING,CGA,O2A,no,N,30,,127846,25389,HEM
31,,SING,C1B,C2B,no,N,31,,127846,25389,HEM
32,,SING,C1B,NB,yes,N,32,,127846,25389,HEM
33,,DOUB,C2B,C3B,yes,N,33,,127846,25389,HEM
34,,SING,C2B,CMB,yes,N,34,,127846,25389,HEM
35,,SING,C3B,C4B,no,N,35,,127846,25389,HEM
36,,SING,C3B,CAB,yes,N,36,,127846,25389,HEM
37,,DOUB,C4B,NB,no,N,37,,127846,25389,HEM
38,,SING,CMB,HMB,yes,N,38,,127846,25389,HEM
39,,SING,CMB,HMBA,no,N,39,,127846,25389,HEM
40,,SING,CMB,HMBB,no,N,40,,127846,25389,HEM
41,,DOUB,CAB,CBB,no,N,41,,127846,25389,HEM
42,,SING,CAB,HAB,no,N,42,,127846,25389,HEM
43,,SING,CBB,HBB,no,N,43,,127846,25389,HEM
44,,SING,CBB,HBBA,no,N,44,,127846,25389,HEM
45,,SING,C1C,C2C,no,N,45,,127846,25389,HEM
46,,SING,C1C,NC,yes,N,46,,127846,25389,HEM
47,,DOUB,C2C,C3C,yes,N,47,,127846,25389,HEM
48,,SING,C2C,CMC,yes,N,48,,127846,25389,HEM
49,,SING,C3C,C4C,no,N,49,,127846,25389,HEM
50,,SING,C3C,CAC,yes,N,50,,127846,25389,HEM
51,,SING,C4C,NC,no,N,51,,127846,25389,HEM
52,,SING,CMC,HMC,yes,N,52,,127846,25389,HEM
53,,SING,CMC,HMCA,no,N,53,,127846,25389,HEM
54,,SING,CMC,HMCB,no,N,54,,127846,25389,HEM
55,,DOUB,CAC,CBC,no,N,55,,127846,25389,HEM
56,,SING,CAC,HAC,no,N,56,,127846,25389,HEM
57,,SING,CBC,HBC,no,N,57,,127846,25389,HEM
58,,SING,CBC,HBCA,no,N,58,,127846,25389,HEM
59,,SING,C1D,C2D,no,N,59,,127846,25389,HEM
60,,DOUB,C1D,ND,yes,N,60,,127846,25389,HEM
61,,DOUB,C2D,C3D,yes,N,61,,127846,25389,HEM
62,,SING,C2D,CMD,yes,N,62,,127846,25389,HEM
63,,SING,C3D,C4D,no,N,63,,127846,25389,HEM
64,,SING,C3D,CAD,yes,N,64,,127846,25389,HEM
65,,SING,C4D,ND,no,N,65,,127846,25389,HEM
66,,SING,CMD,HMD,yes,N,66,,127846,25389,HEM
67,,SING,CMD,HMDA,no,N,67,,127846,25389,HEM
68,,SING,CMD,HMDB,no,N,68,,127846,25389,HEM
69,,SING,CAD,CBD,no,N,69,,127846,25389,HEM
70,,SING,CAD,HAD,no,N,70,,127846,25389,HEM
71,,SING,CAD,HADA,no,N,71,,127846,25389,HEM
72,,SING,CBD,CGD,no,N,72,,127846,25389,HEM
73,,SING,CBD,HBD,no,N,73,,127846,25389,HEM
74,,SING,CBD,HBDA,no,N,74,,127846,25389,HEM
75,,DOUB,CGD,O1D,no,N,75,,127846,25389,HEM
76,,SING,CGD,O2D,no,N,76,,127846,25389,HEM
77,,SING,O2A,H2A,no,N,77,,127846,25389,HEM
78,,SING,O2D,H2D,no,N,78,,127846,25389,HEM
79,,SING,FE,NA,no,N,79,,127846,25389,HEM
80,,SING,FE,NB,no,N,80,,127846,25389,HEM
81,,SING,FE,NC,no,N,81,,127846,25389,HEM
82,,SING,FE,ND,no,N,82,,127846,25389,HEM
1,,SING,CHA,C1A,yes,N,1,,127880,25390,HEM
2,,DOUB,CHA,C4D,yes,N,2,,127880,25390,HEM
3,,SING,CHA,HHA,no,N,3,,127880,25390,HEM
4,,SING,CHB,C4A,yes,N,4,,127880,25390,HEM
5,,DOUB,CHB,C1B,yes,N,5,,127880,25390,HEM
6,,SING,CHB,HHB,no,N,6,,127880,25390,HEM
7,,SING,CHC,C4B,yes,N,7,,127880,25390,HEM
8,,DOUB,CHC,C1C,yes,N,8,,127880,25390,HEM
9,,SING,CHC,HHC,no,N,9,,127880,25390,HEM
10,,DOUB,CHD,C4C,yes,N,10,,127880,25390,HEM
11,,SING,CHD,C1D,yes,N,11,,127880,25390,HEM
12,,SING,CHD,HHD,no,N,12,,127880,25390,HEM
13,,DOUB,C1A,C2A,yes,N,13,,127880,25390,HEM
14,,SING,C1A,NA,yes,N,14,,127880,25390,HEM
15,,SING,C2A,C3A,yes,N,15,,127880,25390,HEM
16,,SING,C2A,CAA,no,N,16,,127880,25390,HEM
17,,DOUB,C3A,C4A,yes,N,17,,127880,25390,HEM
18,,SING,C3A,CMA,no,N,18,,127880,25390,HEM
19,,SING,C4A,NA,yes,N,19,,127880,25390,HEM
20,,SING,CMA,HMA,no,N,20,,127880,25390,HEM
21,,SING,CMA,HMAA,no,N,21,,127880,25390,HEM
22,,SING,CMA,HMAB,no,N,22,,127880,25390,HEM
23,,SING,CAA,CBA,no,N,23,,127880,25390,HEM
24,,SING,CAA,HAA,no,N,24,,127880,25390,HEM
25,,SING,CAA,HAAA,no,N,25,,127880,25390,HEM
26,,SING,CBA,CGA,no,N,26,,127880,25390,HEM
27,,SING,CBA,HBA,no,N,27,,127880,25390,HEM
28,,SING,CBA,HBAA,no,N,28,,127880,25390,HEM
29,,DOUB,CGA,O1A,no,N,29,,127880,25390,HEM
30,,SING,CGA,O2A,no,N,30,,127880,25390,HEM
31,,SING,C1B,C2B,no,N,31,,127880,25390,HEM
32,,SING,C1B,NB,yes,N,32,,127880,25390,HEM
33,,DOUB,C2B,C3B,yes,N,33,,127880,25390,HEM
34,,SING,C2B,CMB,yes,N,34,,127880,25390,HEM
35,,SING,C3B,C4B,no,N,35,,127880,25390,HEM
36,,SING,C3B,CAB,yes,N,36,,127880,25390,HEM
37,,DOUB,C4B,NB,no,N,37,,127880,25390,HEM
38,,SING,CMB,HMB,yes,N,38,,127880,25390,HEM
39,,SING,CMB,HMBA,no,N,39,,127880,25390,HEM
40,,SING,CMB,HMBB,no,N,40,,127880,25390,HEM
41,,DOUB,CAB,CBB,no,N,41,,127880,25390,HEM
42,,SING,CAB,HAB,no,N,42,,127880,25390,HEM
43,,SING,CBB,HBB,no,N,43,,127880,25390,HEM
44,,SING,CBB,HBBA,no,N,44,,127880,25390,HEM
45,,SING,C1C,C2C,no,N,45,,127880,25390,HEM
46,,SING,C1C,NC,yes,N,46,,127880,25390,HEM
47,,DOUB,C2C,C3C,yes,N,47,,127880,25390,HEM
48,,SING,C2C,CMC,yes,N,48,,127880,25390,HEM
49,,SING,C3C,C4C,no,N,49,,127880,25390,HEM
50,,SING,C3C,CAC,yes,N,50,,127880,25390,HEM
51,,SING,C4C,NC,no,N,51,,127880,25390,HEM
1,,SING,N,CA,,,,,240395,6146,ABA_2
52,,SING,CMC,HMC,yes,N,52,,127880,25390,HEM
53,,SING,CMC,HMCA,no,N,53,,127880,25390,HEM
54,,SING,CMC,HMCB,no,N,54,,127880,25390,HEM
55,,DOUB,CAC,CBC,no,N,55,,127880,25390,HEM
56,,SING,CAC,HAC,no,N,56,,127880,25390,HEM
57,,SING,CBC,HBC,no,N,57,,127880,25390,HEM
58,,SING,CBC,HBCA,no,N,58,,127880,25390,HEM
59,,SING,C1D,C2D,no,N,59,,127880,25390,HEM
60,,DOUB,C1D,ND,yes,N,60,,127880,25390,HEM
61,,DOUB,C2D,C3D,yes,N,61,,127880,25390,HEM
62,,SING,C2D,CMD,yes,N,62,,127880,25390,HEM
63,,SING,C3D,C4D,no,N,63,,127880,25390,HEM
64,,SING,C3D,CAD,yes,N,64,,127880,25390,HEM
65,,SING,C4D,ND,no,N,65,,127880,25390,HEM
66,,SING,CMD,HMD,yes,N,66,,127880,25390,HEM
67,,SING,CMD,HMDA,no,N,67,,127880,25390,HEM
68,,SING,CMD,HMDB,no,N,68,,127880,25390,HEM
69,,SING,CAD,CBD,no,N,69,,127880,25390,HEM
70,,SING,CAD,HAD,no,N,70,,127880,25390,HEM
71,,SING,CAD,HADA,no,N,71,,127880,25390,HEM
72,,SING,CBD,CGD,no,N,72,,127880,25390,HEM
73,,SING,CBD,HBD,no,N,73,,127880,25390,HEM
74,,SING,CBD,HBDA,no,N,74,,127880,25390,HEM
75,,DOUB,CGD,O1D,no,N,75,,127880,25390,HEM
76,,SING,CGD,O2D,no,N,76,,127880,25390,HEM
77,,SING,O2A,H2A,no,N,77,,127880,25390,HEM
78,,SING,O2D,H2D,no,N,78,,127880,25390,HEM
79,,SING,FE,NA,no,N,79,,127880,25390,HEM
80,,SING,FE,NB,no,N,80,,127880,25390,HEM
81,,SING,FE,NC,no,N,81,,127880,25390,HEM
82,,SING,FE,ND,no,N,82,,127880,25390,HEM
1,,DOUB,C1,O1,no,N,1,,127930,25394,PHQ
2,,SING,C1,O2,no,N,2,,127930,25394,PHQ
3,,SING,C1,CL1,no,N,3,,127930,25394,PHQ
4,,SING,O2,C2,no,N,4,,127930,25394,PHQ
5,,SING,C2,C3,no,N,5,,127930,25394,PHQ
6,,SING,C2,H21,no,N,6,,127930,25394,PHQ
7,,SING,C2,H22,no,N,7,,127930,25394,PHQ
8,,DOUB,C3,C4,yes,N,8,,127930,25394,PHQ
9,,SING,C3,C8,yes,N,9,,127930,25394,PHQ
10,,SING,C4,C5,yes,N,10,,127930,25394,PHQ
11,,SING,C4,H41,no,N,11,,127930,25394,PHQ
12,,DOUB,C5,C6,yes,N,12,,127930,25394,PHQ
13,,SING,C5,H51,no,N,13,,127930,25394,PHQ
14,,SING,C6,C7,yes,N,14,,127930,25394,PHQ
15,,SING,C6,H61,no,N,15,,127930,25394,PHQ
16,,DOUB,C7,C8,yes,N,16,,127930,25394,PHQ
17,,SING,C7,H71,no,N,17,,127930,25394,PHQ
18,,SING,C8,H81,no,N,18,,127930,25394,PHQ
1,,DOUB,C1,O1,no,N,1,,128215,25411,MYR
2,,SING,C1,O2,no,N,2,,128215,25411,MYR
3,,SING,C1,C2,no,N,3,,128215,25411,MYR
4,,SING,O2,HO2,no,N,4,,128215,25411,MYR
5,,SING,C2,C3,no,N,5,,128215,25411,MYR
6,,SING,C2,H21,no,N,6,,128215,25411,MYR
7,,SING,C2,H22,no,N,7,,128215,25411,MYR
8,,SING,C3,C4,no,N,8,,128215,25411,MYR
9,,SING,C3,H31,no,N,9,,128215,25411,MYR
10,,SING,C3,H32,no,N,10,,128215,25411,MYR
11,,SING,C4,C5,no,N,11,,128215,25411,MYR
12,,SING,C4,H41,no,N,12,,128215,25411,MYR
13,,SING,C4,H42,no,N,13,,128215,25411,MYR
14,,SING,C5,C6,no,N,14,,128215,25411,MYR
15,,SING,C5,H51,no,N,15,,128215,25411,MYR
16,,SING,C5,H52,no,N,16,,128215,25411,MYR
17,,SING,C6,C7,no,N,17,,128215,25411,MYR
18,,SING,C6,H61,no,N,18,,128215,25411,MYR
19,,SING,C6,H62,no,N,19,,128215,25411,MYR
20,,SING,C7,C8,no,N,20,,128215,25411,MYR
21,,SING,C7,H71,no,N,21,,128215,25411,MYR
22,,SING,C7,H72,no,N,22,,128215,25411,MYR
23,,SING,C8,C9,no,N,23,,128215,25411,MYR
24,,SING,C8,H81,no,N,24,,128215,25411,MYR
25,,SING,C8,H82,no,N,25,,128215,25411,MYR
26,,SING,C9,C10,no,N,26,,128215,25411,MYR
27,,SING,C9,H91,no,N,27,,128215,25411,MYR
28,,SING,C9,H92,no,N,28,,128215,25411,MYR
29,,SING,C10,C11,no,N,29,,128215,25411,MYR
30,,SING,C10,H101,no,N,30,,128215,25411,MYR
31,,SING,C10,H102,no,N,31,,128215,25411,MYR
32,,SING,C11,C12,no,N,32,,128215,25411,MYR
33,,SING,C11,H111,no,N,33,,128215,25411,MYR
34,,SING,C11,H112,no,N,34,,128215,25411,MYR
35,,SING,C12,C13,no,N,35,,128215,25411,MYR
36,,SING,C12,H121,no,N,36,,128215,25411,MYR
37,,SING,C12,H122,no,N,37,,128215,25411,MYR
38,,SING,C13,C14,no,N,38,,128215,25411,MYR
39,,SING,C13,H131,no,N,39,,128215,25411,MYR
40,,SING,C13,H132,no,N,40,,128215,25411,MYR
41,,SING,C14,H141,no,N,41,,128215,25411,MYR
42,,SING,C14,H142,no,N,42,,128215,25411,MYR
43,,SING,C14,H143,no,N,43,,128215,25411,MYR
1,,SING,FE,NA,no,N,1,,128325,25418,HEC
2,,SING,FE,NB,no,N,2,,128325,25418,HEC
3,,SING,FE,NC,no,N,3,,128325,25418,HEC
4,,SING,FE,ND,no,N,4,,128325,25418,HEC
5,,DOUB,CHA,C1A,no,N,5,,128325,25418,HEC
6,,SING,CHA,C4D,no,N,6,,128325,25418,HEC
7,,SING,CHA,HHA,no,N,7,,128325,25418,HEC
8,,DOUB,CHB,C4A,no,N,8,,128325,25418,HEC
9,,SING,CHB,C1B,no,N,9,,128325,25418,HEC
10,,SING,CHB,HHB,no,N,10,,128325,25418,HEC
2,,SING,N,H,,,,,240395,6146,ABA_2
11,,DOUB,CHC,C4B,no,N,11,,128325,25418,HEC
12,,SING,CHC,C1C,no,N,12,,128325,25418,HEC
13,,SING,CHC,HHC,no,N,13,,128325,25418,HEC
14,,DOUB,CHD,C4C,no,N,14,,128325,25418,HEC
15,,SING,CHD,C1D,no,N,15,,128325,25418,HEC
16,,SING,CHD,HHD,no,N,16,,128325,25418,HEC
17,,SING,NA,C1A,yes,N,17,,128325,25418,HEC
18,,SING,NA,C4A,yes,N,18,,128325,25418,HEC
19,,SING,C1A,C2A,yes,N,19,,128325,25418,HEC
20,,DOUB,C2A,C3A,yes,N,20,,128325,25418,HEC
21,,SING,C2A,CAA,no,N,21,,128325,25418,HEC
22,,SING,C3A,C4A,yes,N,22,,128325,25418,HEC
23,,SING,C3A,CMA,no,N,23,,128325,25418,HEC
24,,SING,CMA,HMA1,no,N,24,,128325,25418,HEC
25,,SING,CMA,HMA2,no,N,25,,128325,25418,HEC
26,,SING,CMA,HMA3,no,N,26,,128325,25418,HEC
27,,SING,CAA,CBA,no,N,27,,128325,25418,HEC
28,,SING,CAA,HAA1,no,N,28,,128325,25418,HEC
29,,SING,CAA,HAA2,no,N,29,,128325,25418,HEC
30,,SING,CBA,CGA,no,N,30,,128325,25418,HEC
31,,SING,CBA,HBA1,no,N,31,,128325,25418,HEC
32,,SING,CBA,HBA2,no,N,32,,128325,25418,HEC
33,,DOUB,CGA,O1A,no,N,33,,128325,25418,HEC
34,,SING,CGA,O2A,no,N,34,,128325,25418,HEC
35,,SING,O2A,H2A,no,N,35,,128325,25418,HEC
36,,SING,NB,C1B,yes,N,36,,128325,25418,HEC
37,,SING,NB,C4B,yes,N,37,,128325,25418,HEC
38,,DOUB,C1B,C2B,yes,N,38,,128325,25418,HEC
39,,SING,C2B,C3B,yes,N,39,,128325,25418,HEC
40,,SING,C2B,CMB,no,N,40,,128325,25418,HEC
41,,SING,C3B,C4B,yes,N,41,,128325,25418,HEC
42,,DOUB,C3B,CAB,no,E,42,,128325,25418,HEC
43,,SING,CMB,HMB1,no,N,43,,128325,25418,HEC
44,,SING,CMB,HMB2,no,N,44,,128325,25418,HEC
45,,SING,CMB,HMB3,no,N,45,,128325,25418,HEC
46,,SING,CAB,CBB,no,N,46,,128325,25418,HEC
47,,SING,CAB,HAB,no,N,47,,128325,25418,HEC
48,,SING,CBB,HBB1,no,N,48,,128325,25418,HEC
49,,SING,CBB,HBB2,no,N,49,,128325,25418,HEC
50,,SING,CBB,HBB3,no,N,50,,128325,25418,HEC
51,,SING,NC,C1C,yes,N,51,,128325,25418,HEC
52,,SING,NC,C4C,yes,N,52,,128325,25418,HEC
53,,DOUB,C1C,C2C,yes,N,53,,128325,25418,HEC
54,,SING,C2C,C3C,yes,N,54,,128325,25418,HEC
55,,SING,C2C,CMC,no,N,55,,128325,25418,HEC
56,,SING,C3C,C4C,yes,N,56,,128325,25418,HEC
57,,DOUB,C3C,CAC,no,E,57,,128325,25418,HEC
58,,SING,CMC,HMC1,no,N,58,,128325,25418,HEC
59,,SING,CMC,HMC2,no,N,59,,128325,25418,HEC
60,,SING,CMC,HMC3,no,N,60,,128325,25418,HEC
61,,SING,CAC,CBC,no,N,61,,128325,25418,HEC
62,,SING,CAC,HAC,no,N,62,,128325,25418,HEC
63,,SING,CBC,HBC1,no,N,63,,128325,25418,HEC
64,,SING,CBC,HBC2,no,N,64,,128325,25418,HEC
65,,SING,CBC,HBC3,no,N,65,,128325,25418,HEC
66,,SING,ND,C1D,yes,N,66,,128325,25418,HEC
67,,SING,ND,C4D,yes,N,67,,128325,25418,HEC
68,,DOUB,C1D,C2D,yes,N,68,,128325,25418,HEC
69,,SING,C2D,C3D,yes,N,69,,128325,25418,HEC
70,,SING,C2D,CMD,no,N,70,,128325,25418,HEC
71,,DOUB,C3D,C4D,yes,N,71,,128325,25418,HEC
72,,SING,C3D,CAD,no,N,72,,128325,25418,HEC
73,,SING,CMD,HMD1,no,N,73,,128325,25418,HEC
74,,SING,CMD,HMD2,no,N,74,,128325,25418,HEC
75,,SING,CMD,HMD3,no,N,75,,128325,25418,HEC
76,,SING,CAD,CBD,no,N,76,,128325,25418,HEC
77,,SING,CAD,HAD1,no,N,77,,128325,25418,HEC
78,,SING,CAD,HAD2,no,N,78,,128325,25418,HEC
79,,SING,CBD,CGD,no,N,79,,128325,25418,HEC
80,,SING,CBD,HBD1,no,N,80,,128325,25418,HEC
81,,SING,CBD,HBD2,no,N,81,,128325,25418,HEC
82,,DOUB,CGD,O1D,no,N,82,,128325,25418,HEC
83,,SING,CGD,O2D,no,N,83,,128325,25418,HEC
84,,SING,O2D,H2D,no,N,84,,128325,25418,HEC
1,,SING,FE,NA,no,N,1,,128376,25420,HEC
2,,SING,FE,NB,no,N,2,,128376,25420,HEC
3,,SING,FE,NC,no,N,3,,128376,25420,HEC
4,,SING,FE,ND,no,N,4,,128376,25420,HEC
5,,DOUB,CHA,C1A,no,N,5,,128376,25420,HEC
6,,SING,CHA,C4D,no,N,6,,128376,25420,HEC
7,,SING,CHA,HHA,no,N,7,,128376,25420,HEC
8,,DOUB,CHB,C4A,no,N,8,,128376,25420,HEC
9,,SING,CHB,C1B,no,N,9,,128376,25420,HEC
10,,SING,CHB,HHB,no,N,10,,128376,25420,HEC
11,,DOUB,CHC,C4B,no,N,11,,128376,25420,HEC
12,,SING,CHC,C1C,no,N,12,,128376,25420,HEC
13,,SING,CHC,HHC,no,N,13,,128376,25420,HEC
14,,DOUB,CHD,C4C,no,N,14,,128376,25420,HEC
15,,SING,CHD,C1D,no,N,15,,128376,25420,HEC
16,,SING,CHD,HHD,no,N,16,,128376,25420,HEC
17,,SING,NA,C1A,yes,N,17,,128376,25420,HEC
18,,SING,NA,C4A,yes,N,18,,128376,25420,HEC
19,,SING,C1A,C2A,yes,N,19,,128376,25420,HEC
20,,DOUB,C2A,C3A,yes,N,20,,128376,25420,HEC
21,,SING,C2A,CAA,no,N,21,,128376,25420,HEC
22,,SING,C3A,C4A,yes,N,22,,128376,25420,HEC
23,,SING,C3A,CMA,no,N,23,,128376,25420,HEC
24,,SING,CMA,HMA1,no,N,24,,128376,25420,HEC
25,,SING,CMA,HMA2,no,N,25,,128376,25420,HEC
26,,SING,CMA,HMA3,no,N,26,,128376,25420,HEC
27,,SING,CAA,CBA,no,N,27,,128376,25420,HEC
28,,SING,CAA,HAA1,no,N,28,,128376,25420,HEC
29,,SING,CAA,HAA2,no,N,29,,128376,25420,HEC
30,,SING,CBA,CGA,no,N,30,,128376,25420,HEC
31,,SING,CBA,HBA1,no,N,31,,128376,25420,HEC
32,,SING,CBA,HBA2,no,N,32,,128376,25420,HEC
33,,DOUB,CGA,O1A,no,N,33,,128376,25420,HEC
34,,SING,CGA,O2A,no,N,34,,128376,25420,HEC
35,,SING,O2A,H2A,no,N,35,,128376,25420,HEC
36,,SING,NB,C1B,yes,N,36,,128376,25420,HEC
37,,SING,NB,C4B,yes,N,37,,128376,25420,HEC
38,,DOUB,C1B,C2B,yes,N,38,,128376,25420,HEC
39,,SING,C2B,C3B,yes,N,39,,128376,25420,HEC
40,,SING,C2B,CMB,no,N,40,,128376,25420,HEC
41,,SING,C3B,C4B,yes,N,41,,128376,25420,HEC
42,,DOUB,C3B,CAB,no,E,42,,128376,25420,HEC
43,,SING,CMB,HMB1,no,N,43,,128376,25420,HEC
44,,SING,CMB,HMB2,no,N,44,,128376,25420,HEC
45,,SING,CMB,HMB3,no,N,45,,128376,25420,HEC
46,,SING,CAB,CBB,no,N,46,,128376,25420,HEC
47,,SING,CAB,HAB,no,N,47,,128376,25420,HEC
48,,SING,CBB,HBB1,no,N,48,,128376,25420,HEC
49,,SING,CBB,HBB2,no,N,49,,128376,25420,HEC
50,,SING,CBB,HBB3,no,N,50,,128376,25420,HEC
51,,SING,NC,C1C,yes,N,51,,128376,25420,HEC
52,,SING,NC,C4C,yes,N,52,,128376,25420,HEC
53,,DOUB,C1C,C2C,yes,N,53,,128376,25420,HEC
54,,SING,C2C,C3C,yes,N,54,,128376,25420,HEC
55,,SING,C2C,CMC,no,N,55,,128376,25420,HEC
56,,SING,C3C,C4C,yes,N,56,,128376,25420,HEC
57,,DOUB,C3C,CAC,no,E,57,,128376,25420,HEC
58,,SING,CMC,HMC1,no,N,58,,128376,25420,HEC
59,,SING,CMC,HMC2,no,N,59,,128376,25420,HEC
60,,SING,CMC,HMC3,no,N,60,,128376,25420,HEC
61,,SING,CAC,CBC,no,N,61,,128376,25420,HEC
62,,SING,CAC,HAC,no,N,62,,128376,25420,HEC
63,,SING,CBC,HBC1,no,N,63,,128376,25420,HEC
64,,SING,CBC,HBC2,no,N,64,,128376,25420,HEC
65,,SING,CBC,HBC3,no,N,65,,128376,25420,HEC
66,,SING,ND,C1D,yes,N,66,,128376,25420,HEC
67,,SING,ND,C4D,yes,N,67,,128376,25420,HEC
68,,DOUB,C1D,C2D,yes,N,68,,128376,25420,HEC
69,,SING,C2D,C3D,yes,N,69,,128376,25420,HEC
70,,SING,C2D,CMD,no,N,70,,128376,25420,HEC
71,,DOUB,C3D,C4D,yes,N,71,,128376,25420,HEC
72,,SING,C3D,CAD,no,N,72,,128376,25420,HEC
73,,SING,CMD,HMD1,no,N,73,,128376,25420,HEC
74,,SING,CMD,HMD2,no,N,74,,128376,25420,HEC
75,,SING,CMD,HMD3,no,N,75,,128376,25420,HEC
76,,SING,CAD,CBD,no,N,76,,128376,25420,HEC
77,,SING,CAD,HAD1,no,N,77,,128376,25420,HEC
78,,SING,CAD,HAD2,no,N,78,,128376,25420,HEC
79,,SING,CBD,CGD,no,N,79,,128376,25420,HEC
80,,SING,CBD,HBD1,no,N,80,,128376,25420,HEC
81,,SING,CBD,HBD2,no,N,81,,128376,25420,HEC
82,,DOUB,CGD,O1D,no,N,82,,128376,25420,HEC
83,,SING,CGD,O2D,no,N,83,,128376,25420,HEC
84,,SING,O2D,H2D,no,N,84,,128376,25420,HEC
1,,SING,FE,NA,no,N,1,,128416,25422,HEC
2,,SING,FE,NB,no,N,2,,128416,25422,HEC
3,,SING,FE,NC,no,N,3,,128416,25422,HEC
4,,SING,FE,ND,no,N,4,,128416,25422,HEC
5,,DOUB,CHA,C1A,no,N,5,,128416,25422,HEC
6,,SING,CHA,C4D,no,N,6,,128416,25422,HEC
7,,SING,CHA,HHA,no,N,7,,128416,25422,HEC
8,,DOUB,CHB,C4A,no,N,8,,128416,25422,HEC
9,,SING,CHB,C1B,no,N,9,,128416,25422,HEC
10,,SING,CHB,HHB,no,N,10,,128416,25422,HEC
11,,DOUB,CHC,C4B,no,N,11,,128416,25422,HEC
12,,SING,CHC,C1C,no,N,12,,128416,25422,HEC
13,,SING,CHC,HHC,no,N,13,,128416,25422,HEC
14,,DOUB,CHD,C4C,no,N,14,,128416,25422,HEC
15,,SING,CHD,C1D,no,N,15,,128416,25422,HEC
16,,SING,CHD,HHD,no,N,16,,128416,25422,HEC
17,,SING,NA,C1A,yes,N,17,,128416,25422,HEC
18,,SING,NA,C4A,yes,N,18,,128416,25422,HEC
19,,SING,C1A,C2A,yes,N,19,,128416,25422,HEC
20,,DOUB,C2A,C3A,yes,N,20,,128416,25422,HEC
21,,SING,C2A,CAA,no,N,21,,128416,25422,HEC
22,,SING,C3A,C4A,yes,N,22,,128416,25422,HEC
23,,SING,C3A,CMA,no,N,23,,128416,25422,HEC
24,,SING,CMA,HMA1,no,N,24,,128416,25422,HEC
25,,SING,CMA,HMA2,no,N,25,,128416,25422,HEC
26,,SING,CMA,HMA3,no,N,26,,128416,25422,HEC
27,,SING,CAA,CBA,no,N,27,,128416,25422,HEC
28,,SING,CAA,HAA1,no,N,28,,128416,25422,HEC
29,,SING,CAA,HAA2,no,N,29,,128416,25422,HEC
30,,SING,CBA,CGA,no,N,30,,128416,25422,HEC
31,,SING,CBA,HBA1,no,N,31,,128416,25422,HEC
32,,SING,CBA,HBA2,no,N,32,,128416,25422,HEC
33,,DOUB,CGA,O1A,no,N,33,,128416,25422,HEC
34,,SING,CGA,O2A,no,N,34,,128416,25422,HEC
35,,SING,O2A,H2A,no,N,35,,128416,25422,HEC
36,,SING,NB,C1B,yes,N,36,,128416,25422,HEC
37,,SING,NB,C4B,yes,N,37,,128416,25422,HEC
38,,DOUB,C1B,C2B,yes,N,38,,128416,25422,HEC
39,,SING,C2B,C3B,yes,N,39,,128416,25422,HEC
40,,SING,C2B,CMB,no,N,40,,128416,25422,HEC
41,,SING,C3B,C4B,yes,N,41,,128416,25422,HEC
42,,DOUB,C3B,CAB,no,E,42,,128416,25422,HEC
43,,SING,CMB,HMB1,no,N,43,,128416,25422,HEC
44,,SING,CMB,HMB2,no,N,44,,128416,25422,HEC
45,,SING,CMB,HMB3,no,N,45,,128416,25422,HEC
46,,SING,CAB,CBB,no,N,46,,128416,25422,HEC
47,,SING,CAB,HAB,no,N,47,,128416,25422,HEC
48,,SING,CBB,HBB1,no,N,48,,128416,25422,HEC
49,,SING,CBB,HBB2,no,N,49,,128416,25422,HEC
50,,SING,CBB,HBB3,no,N,50,,128416,25422,HEC
51,,SING,NC,C1C,yes,N,51,,128416,25422,HEC
52,,SING,NC,C4C,yes,N,52,,128416,25422,HEC
53,,DOUB,C1C,C2C,yes,N,53,,128416,25422,HEC
54,,SING,C2C,C3C,yes,N,54,,128416,25422,HEC
55,,SING,C2C,CMC,no,N,55,,128416,25422,HEC
56,,SING,C3C,C4C,yes,N,56,,128416,25422,HEC
57,,DOUB,C3C,CAC,no,E,57,,128416,25422,HEC
58,,SING,CMC,HMC1,no,N,58,,128416,25422,HEC
59,,SING,CMC,HMC2,no,N,59,,128416,25422,HEC
60,,SING,CMC,HMC3,no,N,60,,128416,25422,HEC
61,,SING,CAC,CBC,no,N,61,,128416,25422,HEC
62,,SING,CAC,HAC,no,N,62,,128416,25422,HEC
63,,SING,CBC,HBC1,no,N,63,,128416,25422,HEC
64,,SING,CBC,HBC2,no,N,64,,128416,25422,HEC
65,,SING,CBC,HBC3,no,N,65,,128416,25422,HEC
66,,SING,ND,C1D,yes,N,66,,128416,25422,HEC
67,,SING,ND,C4D,yes,N,67,,128416,25422,HEC
68,,DOUB,C1D,C2D,yes,N,68,,128416,25422,HEC
69,,SING,C2D,C3D,yes,N,69,,128416,25422,HEC
70,,SING,C2D,CMD,no,N,70,,128416,25422,HEC
71,,DOUB,C3D,C4D,yes,N,71,,128416,25422,HEC
72,,SING,C3D,CAD,no,N,72,,128416,25422,HEC
73,,SING,CMD,HMD1,no,N,73,,128416,25422,HEC
74,,SING,CMD,HMD2,no,N,74,,128416,25422,HEC
75,,SING,CMD,HMD3,no,N,75,,128416,25422,HEC
76,,SING,CAD,CBD,no,N,76,,128416,25422,HEC
77,,SING,CAD,HAD1,no,N,77,,128416,25422,HEC
78,,SING,CAD,HAD2,no,N,78,,128416,25422,HEC
79,,SING,CBD,CGD,no,N,79,,128416,25422,HEC
80,,SING,CBD,HBD1,no,N,80,,128416,25422,HEC
81,,SING,CBD,HBD2,no,N,81,,128416,25422,HEC
82,,DOUB,CGD,O1D,no,N,82,,128416,25422,HEC
83,,SING,CGD,O2D,no,N,83,,128416,25422,HEC
84,,SING,O2D,H2D,no,N,84,,128416,25422,HEC
1,,SING,C11,O11,no,N,1,,128514,25427,PAR
2,,SING,C11,C21,no,N,2,,128514,25427,PAR
3,,SING,C11,O51,no,N,3,,128514,25427,PAR
4,,SING,C11,H11,no,N,4,,128514,25427,PAR
5,,SING,O11,C42,no,N,5,,128514,25427,PAR
6,,SING,C21,N21,no,N,6,,128514,25427,PAR
7,,SING,C21,C31,no,N,7,,128514,25427,PAR
8,,SING,C21,H21,no,N,8,,128514,25427,PAR
9,,SING,N21,HN21,no,N,9,,128514,25427,PAR
10,,SING,N21,HN22,no,N,10,,128514,25427,PAR
11,,SING,C31,O31,no,N,11,,128514,25427,PAR
12,,SING,C31,C41,no,N,12,,128514,25427,PAR
13,,SING,C31,H31,no,N,13,,128514,25427,PAR
14,,SING,O31,HO31,no,N,14,,128514,25427,PAR
15,,SING,C41,O41,no,N,15,,128514,25427,PAR
16,,SING,C41,C51,no,N,16,,128514,25427,PAR
17,,SING,C41,H41,no,N,17,,128514,25427,PAR
18,,SING,O41,HO41,no,N,18,,128514,25427,PAR
19,,SING,C51,O51,no,N,19,,128514,25427,PAR
20,,SING,C51,C61,no,N,20,,128514,25427,PAR
21,,SING,C51,H51,no,N,21,,128514,25427,PAR
22,,SING,C61,O61,no,N,22,,128514,25427,PAR
23,,SING,C61,H611,no,N,23,,128514,25427,PAR
24,,SING,C61,H612,no,N,24,,128514,25427,PAR
25,,SING,O61,HO61,no,N,25,,128514,25427,PAR
26,,SING,C12,N12,no,N,26,,128514,25427,PAR
27,,SING,C12,C22,no,N,27,,128514,25427,PAR
28,,SING,C12,C62,no,N,28,,128514,25427,PAR
29,,SING,C12,H12,no,N,29,,128514,25427,PAR
30,,SING,N12,H121,no,N,30,,128514,25427,PAR
31,,SING,N12,H122,no,N,31,,128514,25427,PAR
32,,SING,C22,C32,no,N,32,,128514,25427,PAR
33,,SING,C22,H221,no,N,33,,128514,25427,PAR
34,,SING,C22,H222,no,N,34,,128514,25427,PAR
35,,SING,C32,N32,no,N,35,,128514,25427,PAR
36,,SING,C32,C42,no,N,36,,128514,25427,PAR
37,,SING,C32,H32,no,N,37,,128514,25427,PAR
38,,SING,N32,H321,no,N,38,,128514,25427,PAR
39,,SING,N32,H322,no,N,39,,128514,25427,PAR
40,,SING,C42,C52,no,N,40,,128514,25427,PAR
41,,SING,C42,H42,no,N,41,,128514,25427,PAR
42,,SING,C52,O52,no,N,42,,128514,25427,PAR
43,,SING,C52,C62,no,N,43,,128514,25427,PAR
44,,SING,C52,H52,no,N,44,,128514,25427,PAR
45,,SING,O52,C13,no,N,45,,128514,25427,PAR
46,,SING,C62,O62,no,N,46,,128514,25427,PAR
47,,SING,C62,H62,no,N,47,,128514,25427,PAR
48,,SING,O62,HO62,no,N,48,,128514,25427,PAR
49,,SING,C13,C23,no,N,49,,128514,25427,PAR
50,,SING,C13,O43,no,N,50,,128514,25427,PAR
51,,SING,C13,H13,no,N,51,,128514,25427,PAR
52,,SING,C23,O23,no,N,52,,128514,25427,PAR
53,,SING,C23,C33,no,N,53,,128514,25427,PAR
54,,SING,C23,H23,no,N,54,,128514,25427,PAR
55,,SING,O23,HO23,no,N,55,,128514,25427,PAR
56,,SING,C33,O33,no,N,56,,128514,25427,PAR
57,,SING,C33,C43,no,N,57,,128514,25427,PAR
58,,SING,C33,H33,no,N,58,,128514,25427,PAR
59,,SING,O33,C14,no,N,59,,128514,25427,PAR
60,,SING,C43,O43,no,N,60,,128514,25427,PAR
61,,SING,C43,C53,no,N,61,,128514,25427,PAR
62,,SING,C43,H43,no,N,62,,128514,25427,PAR
63,,SING,C53,O53,no,N,63,,128514,25427,PAR
64,,SING,C53,H531,no,N,64,,128514,25427,PAR
65,,SING,C53,H532,no,N,65,,128514,25427,PAR
66,,SING,O53,HO53,no,N,66,,128514,25427,PAR
67,,SING,C14,C24,no,N,67,,128514,25427,PAR
68,,SING,C14,O54,no,N,68,,128514,25427,PAR
69,,SING,C14,H14,no,N,69,,128514,25427,PAR
70,,SING,C24,N24,no,N,70,,128514,25427,PAR
71,,SING,C24,C34,no,N,71,,128514,25427,PAR
72,,SING,C24,H24,no,N,72,,128514,25427,PAR
73,,SING,N24,H241,no,N,73,,128514,25427,PAR
74,,SING,N24,H242,no,N,74,,128514,25427,PAR
75,,SING,C34,O34,no,N,75,,128514,25427,PAR
76,,SING,C34,C44,no,N,76,,128514,25427,PAR
77,,SING,C34,H34,no,N,77,,128514,25427,PAR
78,,SING,O34,HO34,no,N,78,,128514,25427,PAR
79,,SING,C44,O44,no,N,79,,128514,25427,PAR
80,,SING,C44,C54,no,N,80,,128514,25427,PAR
81,,SING,C44,H44,no,N,81,,128514,25427,PAR
82,,SING,O44,HO44,no,N,82,,128514,25427,PAR
83,,SING,C54,O54,no,N,83,,128514,25427,PAR
84,,SING,C54,C64,no,N,84,,128514,25427,PAR
85,,SING,C54,H54,no,N,85,,128514,25427,PAR
86,,SING,C64,N64,no,N,86,,128514,25427,PAR
87,,SING,C64,H641,no,N,87,,128514,25427,PAR
88,,SING,C64,H642,no,N,88,,128514,25427,PAR
89,,SING,N64,HN61,no,N,89,,128514,25427,PAR
90,,SING,N64,HN62,no,N,90,,128514,25427,PAR
1,,SING,O23,P24,no,N,1,,128822,25446,PNS
2,,SING,O23,HOP1,no,N,2,,128822,25446,PNS
3,,SING,P24,O25,no,N,3,,128822,25446,PNS
4,,DOUB,P24,O26,no,N,4,,128822,25446,PNS
5,,SING,P24,O27,no,N,5,,128822,25446,PNS
6,,SING,O25,HOP2,no,N,6,,128822,25446,PNS
7,,SING,O27,C28,no,N,7,,128822,25446,PNS
8,,SING,C28,C29,no,N,8,,128822,25446,PNS
9,,SING,C28,H282,no,N,9,,128822,25446,PNS
10,,SING,C28,H281,no,N,10,,128822,25446,PNS
11,,SING,C29,C30,no,N,11,,128822,25446,PNS
12,,SING,C29,C31,no,N,12,,128822,25446,PNS
13,,SING,C29,C32,no,N,13,,128822,25446,PNS
14,,SING,C30,H303,no,N,14,,128822,25446,PNS
15,,SING,C30,H302,no,N,15,,128822,25446,PNS
16,,SING,C30,H301,no,N,16,,128822,25446,PNS
17,,SING,C31,H313,no,N,17,,128822,25446,PNS
18,,SING,C31,H312,no,N,18,,128822,25446,PNS
19,,SING,C31,H311,no,N,19,,128822,25446,PNS
20,,SING,C32,O33,no,N,20,,128822,25446,PNS
21,,SING,C32,C34,no,N,21,,128822,25446,PNS
22,,SING,C32,H32,no,N,22,,128822,25446,PNS
23,,SING,O33,H33,no,N,23,,128822,25446,PNS
24,,DOUB,C34,O35,no,N,24,,128822,25446,PNS
25,,SING,C34,N36,no,N,25,,128822,25446,PNS
26,,SING,N36,C37,no,N,26,,128822,25446,PNS
27,,SING,N36,H36,no,N,27,,128822,25446,PNS
28,,SING,C37,C38,no,N,28,,128822,25446,PNS
29,,SING,C37,H372,no,N,29,,128822,25446,PNS
30,,SING,C37,H371,no,N,30,,128822,25446,PNS
31,,SING,C38,C39,no,N,31,,128822,25446,PNS
32,,SING,C38,H382,no,N,32,,128822,25446,PNS
33,,SING,C38,H381,no,N,33,,128822,25446,PNS
34,,DOUB,C39,O40,no,N,34,,128822,25446,PNS
35,,SING,C39,N41,no,N,35,,128822,25446,PNS
36,,SING,N41,C42,no,N,36,,128822,25446,PNS
37,,SING,N41,H41,no,N,37,,128822,25446,PNS
38,,SING,C42,C43,no,N,38,,128822,25446,PNS
39,,SING,C42,H422,no,N,39,,128822,25446,PNS
40,,SING,C42,H421,no,N,40,,128822,25446,PNS
41,,SING,C43,S44,no,N,41,,128822,25446,PNS
42,,SING,C43,H431,no,N,42,,128822,25446,PNS
43,,SING,C43,H432,no,N,43,,128822,25446,PNS
44,,SING,S44,H44,no,N,44,,128822,25446,PNS
1,,SING,CHA,C1A,yes,N,1,,128972,25455,HEM
2,,DOUB,CHA,C4D,yes,N,2,,128972,25455,HEM
3,,SING,CHA,HHA,no,N,3,,128972,25455,HEM
4,,SING,CHB,C4A,yes,N,4,,128972,25455,HEM
5,,DOUB,CHB,C1B,yes,N,5,,128972,25455,HEM
6,,SING,CHB,HHB,no,N,6,,128972,25455,HEM
7,,SING,CHC,C4B,yes,N,7,,128972,25455,HEM
8,,DOUB,CHC,C1C,yes,N,8,,128972,25455,HEM
9,,SING,CHC,HHC,no,N,9,,128972,25455,HEM
10,,DOUB,CHD,C4C,yes,N,10,,128972,25455,HEM
11,,SING,CHD,C1D,yes,N,11,,128972,25455,HEM
12,,SING,CHD,HHD,no,N,12,,128972,25455,HEM
13,,DOUB,C1A,C2A,yes,N,13,,128972,25455,HEM
14,,SING,C1A,NA,yes,N,14,,128972,25455,HEM
15,,SING,C2A,C3A,yes,N,15,,128972,25455,HEM
16,,SING,C2A,CAA,no,N,16,,128972,25455,HEM
3,,SING,CA,CB,,,,,240395,6146,ABA_2
17,,DOUB,C3A,C4A,yes,N,17,,128972,25455,HEM
18,,SING,C3A,CMA,no,N,18,,128972,25455,HEM
19,,SING,C4A,NA,yes,N,19,,128972,25455,HEM
20,,SING,CMA,HMA,no,N,20,,128972,25455,HEM
21,,SING,CMA,HMAA,no,N,21,,128972,25455,HEM
22,,SING,CMA,HMAB,no,N,22,,128972,25455,HEM
23,,SING,CAA,CBA,no,N,23,,128972,25455,HEM
24,,SING,CAA,HAA,no,N,24,,128972,25455,HEM
25,,SING,CAA,HAAA,no,N,25,,128972,25455,HEM
26,,SING,CBA,CGA,no,N,26,,128972,25455,HEM
27,,SING,CBA,HBA,no,N,27,,128972,25455,HEM
28,,SING,CBA,HBAA,no,N,28,,128972,25455,HEM
29,,DOUB,CGA,O1A,no,N,29,,128972,25455,HEM
30,,SING,CGA,O2A,no,N,30,,128972,25455,HEM
31,,SING,C1B,C2B,no,N,31,,128972,25455,HEM
32,,SING,C1B,NB,yes,N,32,,128972,25455,HEM
33,,DOUB,C2B,C3B,yes,N,33,,128972,25455,HEM
34,,SING,C2B,CMB,yes,N,34,,128972,25455,HEM
35,,SING,C3B,C4B,no,N,35,,128972,25455,HEM
36,,SING,C3B,CAB,yes,N,36,,128972,25455,HEM
37,,DOUB,C4B,NB,no,N,37,,128972,25455,HEM
38,,SING,CMB,HMB,yes,N,38,,128972,25455,HEM
39,,SING,CMB,HMBA,no,N,39,,128972,25455,HEM
40,,SING,CMB,HMBB,no,N,40,,128972,25455,HEM
41,,DOUB,CAB,CBB,no,N,41,,128972,25455,HEM
42,,SING,CAB,HAB,no,N,42,,128972,25455,HEM
43,,SING,CBB,HBB,no,N,43,,128972,25455,HEM
44,,SING,CBB,HBBA,no,N,44,,128972,25455,HEM
45,,SING,C1C,C2C,no,N,45,,128972,25455,HEM
46,,SING,C1C,NC,yes,N,46,,128972,25455,HEM
47,,DOUB,C2C,C3C,yes,N,47,,128972,25455,HEM
48,,SING,C2C,CMC,yes,N,48,,128972,25455,HEM
49,,SING,C3C,C4C,no,N,49,,128972,25455,HEM
50,,SING,C3C,CAC,yes,N,50,,128972,25455,HEM
51,,SING,C4C,NC,no,N,51,,128972,25455,HEM
52,,SING,CMC,HMC,yes,N,52,,128972,25455,HEM
53,,SING,CMC,HMCA,no,N,53,,128972,25455,HEM
54,,SING,CMC,HMCB,no,N,54,,128972,25455,HEM
55,,DOUB,CAC,CBC,no,N,55,,128972,25455,HEM
56,,SING,CAC,HAC,no,N,56,,128972,25455,HEM
57,,SING,CBC,HBC,no,N,57,,128972,25455,HEM
58,,SING,CBC,HBCA,no,N,58,,128972,25455,HEM
59,,SING,C1D,C2D,no,N,59,,128972,25455,HEM
60,,DOUB,C1D,ND,yes,N,60,,128972,25455,HEM
61,,DOUB,C2D,C3D,yes,N,61,,128972,25455,HEM
62,,SING,C2D,CMD,yes,N,62,,128972,25455,HEM
63,,SING,C3D,C4D,no,N,63,,128972,25455,HEM
64,,SING,C3D,CAD,yes,N,64,,128972,25455,HEM
65,,SING,C4D,ND,no,N,65,,128972,25455,HEM
66,,SING,CMD,HMD,yes,N,66,,128972,25455,HEM
67,,SING,CMD,HMDA,no,N,67,,128972,25455,HEM
68,,SING,CMD,HMDB,no,N,68,,128972,25455,HEM
69,,SING,CAD,CBD,no,N,69,,128972,25455,HEM
70,,SING,CAD,HAD,no,N,70,,128972,25455,HEM
71,,SING,CAD,HADA,no,N,71,,128972,25455,HEM
72,,SING,CBD,CGD,no,N,72,,128972,25455,HEM
73,,SING,CBD,HBD,no,N,73,,128972,25455,HEM
74,,SING,CBD,HBDA,no,N,74,,128972,25455,HEM
75,,DOUB,CGD,O1D,no,N,75,,128972,25455,HEM
76,,SING,CGD,O2D,no,N,76,,128972,25455,HEM
77,,SING,O2A,H2A,no,N,77,,128972,25455,HEM
78,,SING,O2D,H2D,no,N,78,,128972,25455,HEM
79,,SING,FE,NA,no,N,79,,128972,25455,HEM
80,,SING,FE,NB,no,N,80,,128972,25455,HEM
81,,SING,FE,NC,no,N,81,,128972,25455,HEM
82,,SING,FE,ND,no,N,82,,128972,25455,HEM
1,,SING,C,CA,no,N,1,,128989,25456,MK8
2,,SING,C,O2,no,N,2,,128989,25456,MK8
3,,SING,N,HN,no,N,3,,128989,25456,MK8
4,,SING,N,HNA,no,N,4,,128989,25456,MK8
5,,DOUB,O,C,no,N,5,,128989,25456,MK8
6,,SING,CA,N,no,N,6,,128989,25456,MK8
7,,SING,CA,CB,no,N,7,,128989,25456,MK8
8,,SING,CB,HB,no,N,8,,128989,25456,MK8
9,,SING,CB,HBA,no,N,9,,128989,25456,MK8
10,,SING,CD,CG,no,N,10,,128989,25456,MK8
11,,SING,CD,HD,no,N,11,,128989,25456,MK8
12,,SING,CD,HDA,no,N,12,,128989,25456,MK8
13,,SING,CE,CD,no,N,13,,128989,25456,MK8
14,,SING,CE,HE,no,N,14,,128989,25456,MK8
15,,SING,CE,HEA,no,N,15,,128989,25456,MK8
16,,SING,CE,HEB,no,N,16,,128989,25456,MK8
17,,SING,CG,CB,no,N,17,,128989,25456,MK8
18,,SING,CG,HG,no,N,18,,128989,25456,MK8
19,,SING,CG,HGA,no,N,19,,128989,25456,MK8
20,,SING,CB1,CA,no,N,20,,128989,25456,MK8
21,,SING,CB1,HB1,no,N,21,,128989,25456,MK8
22,,SING,CB1,HB1A,no,N,22,,128989,25456,MK8
23,,SING,CB1,HB1B,no,N,23,,128989,25456,MK8
24,,SING,O2,H15,no,N,24,,128989,25456,MK8
1,,SING,C,CA,no,N,1,,129004,25457,MK8
2,,SING,C,O2,no,N,2,,129004,25457,MK8
3,,SING,N,HN,no,N,3,,129004,25457,MK8
4,,SING,N,HNA,no,N,4,,129004,25457,MK8
5,,DOUB,O,C,no,N,5,,129004,25457,MK8
6,,SING,CA,N,no,N,6,,129004,25457,MK8
7,,SING,CA,CB,no,N,7,,129004,25457,MK8
8,,SING,CB,HB,no,N,8,,129004,25457,MK8
9,,SING,CB,HBA,no,N,9,,129004,25457,MK8
10,,SING,CD,CG,no,N,10,,129004,25457,MK8
4,,SING,CA,HA,,,,,240395,6146,ABA_2
11,,SING,CD,HD,no,N,11,,129004,25457,MK8
12,,SING,CD,HDA,no,N,12,,129004,25457,MK8
13,,SING,CE,CD,no,N,13,,129004,25457,MK8
14,,SING,CE,HE,no,N,14,,129004,25457,MK8
15,,SING,CE,HEA,no,N,15,,129004,25457,MK8
16,,SING,CE,HEB,no,N,16,,129004,25457,MK8
17,,SING,CG,CB,no,N,17,,129004,25457,MK8
18,,SING,CG,HG,no,N,18,,129004,25457,MK8
19,,SING,CG,HGA,no,N,19,,129004,25457,MK8
20,,SING,CB1,CA,no,N,20,,129004,25457,MK8
21,,SING,CB1,HB1,no,N,21,,129004,25457,MK8
22,,SING,CB1,HB1A,no,N,22,,129004,25457,MK8
23,,SING,CB1,HB1B,no,N,23,,129004,25457,MK8
24,,SING,O2,H15,no,N,24,,129004,25457,MK8
1,,DOUB,C,O,no,N,1,,129019,25458,ACE
2,,SING,C,CH3,no,N,2,,129019,25458,ACE
3,,SING,C,H,no,N,3,,129019,25458,ACE
4,,SING,CH3,H1,no,N,4,,129019,25458,ACE
5,,SING,CH3,H2,no,N,5,,129019,25458,ACE
6,,SING,CH3,H3,no,N,6,,129019,25458,ACE
1,,SING,N,HN1,no,N,1,,129020,25458,NH2
2,,SING,N,HN2,no,N,2,,129020,25458,NH2
1,,SING,N,CA,no,N,1,,129172,25465,CGU
2,,SING,N,H,no,N,2,,129172,25465,CGU
3,,SING,N,HN2,no,N,3,,129172,25465,CGU
4,,SING,CA,C,no,N,4,,129172,25465,CGU
5,,SING,CA,CB,no,N,5,,129172,25465,CGU
6,,SING,CA,HA,no,N,6,,129172,25465,CGU
7,,DOUB,C,O,no,N,7,,129172,25465,CGU
8,,SING,C,OXT,no,N,8,,129172,25465,CGU
9,,SING,OXT,HXT,no,N,9,,129172,25465,CGU
10,,SING,CB,CG,no,N,10,,129172,25465,CGU
11,,SING,CB,HB2,no,N,11,,129172,25465,CGU
12,,SING,CB,HB3,no,N,12,,129172,25465,CGU
13,,SING,CG,CD1,no,N,13,,129172,25465,CGU
14,,SING,CG,CD2,no,N,14,,129172,25465,CGU
15,,SING,CG,HG,no,N,15,,129172,25465,CGU
16,,DOUB,CD1,OE11,no,N,16,,129172,25465,CGU
17,,SING,CD1,OE12,no,N,17,,129172,25465,CGU
18,,DOUB,CD2,OE21,no,N,18,,129172,25465,CGU
19,,SING,CD2,OE22,no,N,19,,129172,25465,CGU
20,,SING,OE12,HE12,no,N,20,,129172,25465,CGU
21,,SING,OE22,HE22,no,N,21,,129172,25465,CGU
1,,SING,N,HN1,no,N,1,,129173,25465,NH2
2,,SING,N,HN2,no,N,2,,129173,25465,NH2
1,,SING,N,CA,no,N,1,,129275,25470,SEP
2,,SING,N,H,no,N,2,,129275,25470,SEP
3,,SING,N,H2,no,N,3,,129275,25470,SEP
4,,SING,CA,CB,no,N,4,,129275,25470,SEP
5,,SING,CA,C,no,N,5,,129275,25470,SEP
6,,SING,CA,HA,no,N,6,,129275,25470,SEP
7,,SING,CB,OG,no,N,7,,129275,25470,SEP
8,,SING,CB,HB2,no,N,8,,129275,25470,SEP
9,,SING,CB,HB3,no,N,9,,129275,25470,SEP
10,,SING,OG,P,no,N,10,,129275,25470,SEP
11,,DOUB,C,O,no,N,11,,129275,25470,SEP
12,,SING,C,OXT,no,N,12,,129275,25470,SEP
13,,SING,OXT,HXT,no,N,13,,129275,25470,SEP
14,,DOUB,P,O1P,no,N,14,,129275,25470,SEP
15,,SING,P,O2P,no,N,15,,129275,25470,SEP
16,,SING,P,O3P,no,N,16,,129275,25470,SEP
17,,SING,O2P,HOP2,no,N,17,,129275,25470,SEP
18,,SING,O3P,HOP3,no,N,18,,129275,25470,SEP
1,,SING,N,CA,no,N,1,,129290,25471,SEP
2,,SING,N,H,no,N,2,,129290,25471,SEP
3,,SING,N,H2,no,N,3,,129290,25471,SEP
4,,SING,CA,CB,no,N,4,,129290,25471,SEP
5,,SING,CA,C,no,N,5,,129290,25471,SEP
6,,SING,CA,HA,no,N,6,,129290,25471,SEP
7,,SING,CB,OG,no,N,7,,129290,25471,SEP
8,,SING,CB,HB2,no,N,8,,129290,25471,SEP
9,,SING,CB,HB3,no,N,9,,129290,25471,SEP
10,,SING,OG,P,no,N,10,,129290,25471,SEP
11,,DOUB,C,O,no,N,11,,129290,25471,SEP
12,,SING,C,OXT,no,N,12,,129290,25471,SEP
13,,SING,OXT,HXT,no,N,13,,129290,25471,SEP
14,,DOUB,P,O1P,no,N,14,,129290,25471,SEP
15,,SING,P,O2P,no,N,15,,129290,25471,SEP
16,,SING,P,O3P,no,N,16,,129290,25471,SEP
17,,SING,O2P,HOP2,no,N,17,,129290,25471,SEP
18,,SING,O3P,HOP3,no,N,18,,129290,25471,SEP
1,,SING,FE,NA,no,N,1,,129398,25477,HEC
2,,SING,FE,NB,no,N,2,,129398,25477,HEC
3,,SING,FE,NC,no,N,3,,129398,25477,HEC
4,,SING,FE,ND,no,N,4,,129398,25477,HEC
5,,DOUB,CHA,C1A,no,N,5,,129398,25477,HEC
6,,SING,CHA,C4D,no,N,6,,129398,25477,HEC
7,,SING,CHA,HHA,no,N,7,,129398,25477,HEC
8,,DOUB,CHB,C4A,no,N,8,,129398,25477,HEC
9,,SING,CHB,C1B,no,N,9,,129398,25477,HEC
10,,SING,CHB,HHB,no,N,10,,129398,25477,HEC
11,,DOUB,CHC,C4B,no,N,11,,129398,25477,HEC
12,,SING,CHC,C1C,no,N,12,,129398,25477,HEC
13,,SING,CHC,HHC,no,N,13,,129398,25477,HEC
14,,DOUB,CHD,C4C,no,N,14,,129398,25477,HEC
15,,SING,CHD,C1D,no,N,15,,129398,25477,HEC
16,,SING,CHD,HHD,no,N,16,,129398,25477,HEC
17,,SING,NA,C1A,yes,N,17,,129398,25477,HEC
18,,SING,NA,C4A,yes,N,18,,129398,25477,HEC
19,,SING,C1A,C2A,yes,N,19,,129398,25477,HEC
20,,DOUB,C2A,C3A,yes,N,20,,129398,25477,HEC
21,,SING,C2A,CAA,no,N,21,,129398,25477,HEC
22,,SING,C3A,C4A,yes,N,22,,129398,25477,HEC
23,,SING,C3A,CMA,no,N,23,,129398,25477,HEC
24,,SING,CMA,HMA1,no,N,24,,129398,25477,HEC
25,,SING,CMA,HMA2,no,N,25,,129398,25477,HEC
26,,SING,CMA,HMA3,no,N,26,,129398,25477,HEC
27,,SING,CAA,CBA,no,N,27,,129398,25477,HEC
28,,SING,CAA,HAA1,no,N,28,,129398,25477,HEC
29,,SING,CAA,HAA2,no,N,29,,129398,25477,HEC
30,,SING,CBA,CGA,no,N,30,,129398,25477,HEC
31,,SING,CBA,HBA1,no,N,31,,129398,25477,HEC
32,,SING,CBA,HBA2,no,N,32,,129398,25477,HEC
33,,DOUB,CGA,O1A,no,N,33,,129398,25477,HEC
34,,SING,CGA,O2A,no,N,34,,129398,25477,HEC
35,,SING,O2A,H2A,no,N,35,,129398,25477,HEC
36,,SING,NB,C1B,yes,N,36,,129398,25477,HEC
37,,SING,NB,C4B,yes,N,37,,129398,25477,HEC
38,,DOUB,C1B,C2B,yes,N,38,,129398,25477,HEC
39,,SING,C2B,C3B,yes,N,39,,129398,25477,HEC
40,,SING,C2B,CMB,no,N,40,,129398,25477,HEC
41,,SING,C3B,C4B,yes,N,41,,129398,25477,HEC
42,,DOUB,C3B,CAB,no,E,42,,129398,25477,HEC
43,,SING,CMB,HMB1,no,N,43,,129398,25477,HEC
44,,SING,CMB,HMB2,no,N,44,,129398,25477,HEC
45,,SING,CMB,HMB3,no,N,45,,129398,25477,HEC
46,,SING,CAB,CBB,no,N,46,,129398,25477,HEC
47,,SING,CAB,HAB,no,N,47,,129398,25477,HEC
48,,SING,CBB,HBB1,no,N,48,,129398,25477,HEC
49,,SING,CBB,HBB2,no,N,49,,129398,25477,HEC
50,,SING,CBB,HBB3,no,N,50,,129398,25477,HEC
51,,SING,NC,C1C,yes,N,51,,129398,25477,HEC
52,,SING,NC,C4C,yes,N,52,,129398,25477,HEC
53,,DOUB,C1C,C2C,yes,N,53,,129398,25477,HEC
54,,SING,C2C,C3C,yes,N,54,,129398,25477,HEC
55,,SING,C2C,CMC,no,N,55,,129398,25477,HEC
56,,SING,C3C,C4C,yes,N,56,,129398,25477,HEC
57,,DOUB,C3C,CAC,no,E,57,,129398,25477,HEC
58,,SING,CMC,HMC1,no,N,58,,129398,25477,HEC
59,,SING,CMC,HMC2,no,N,59,,129398,25477,HEC
60,,SING,CMC,HMC3,no,N,60,,129398,25477,HEC
61,,SING,CAC,CBC,no,N,61,,129398,25477,HEC
62,,SING,CAC,HAC,no,N,62,,129398,25477,HEC
63,,SING,CBC,HBC1,no,N,63,,129398,25477,HEC
64,,SING,CBC,HBC2,no,N,64,,129398,25477,HEC
65,,SING,CBC,HBC3,no,N,65,,129398,25477,HEC
66,,SING,ND,C1D,yes,N,66,,129398,25477,HEC
67,,SING,ND,C4D,yes,N,67,,129398,25477,HEC
68,,DOUB,C1D,C2D,yes,N,68,,129398,25477,HEC
69,,SING,C2D,C3D,yes,N,69,,129398,25477,HEC
70,,SING,C2D,CMD,no,N,70,,129398,25477,HEC
71,,DOUB,C3D,C4D,yes,N,71,,129398,25477,HEC
72,,SING,C3D,CAD,no,N,72,,129398,25477,HEC
73,,SING,CMD,HMD1,no,N,73,,129398,25477,HEC
74,,SING,CMD,HMD2,no,N,74,,129398,25477,HEC
75,,SING,CMD,HMD3,no,N,75,,129398,25477,HEC
76,,SING,CAD,CBD,no,N,76,,129398,25477,HEC
77,,SING,CAD,HAD1,no,N,77,,129398,25477,HEC
78,,SING,CAD,HAD2,no,N,78,,129398,25477,HEC
79,,SING,CBD,CGD,no,N,79,,129398,25477,HEC
80,,SING,CBD,HBD1,no,N,80,,129398,25477,HEC
81,,SING,CBD,HBD2,no,N,81,,129398,25477,HEC
82,,DOUB,CGD,O1D,no,N,82,,129398,25477,HEC
83,,SING,CGD,O2D,no,N,83,,129398,25477,HEC
84,,SING,O2D,H2D,no,N,84,,129398,25477,HEC
1,,SING,N,CA,no,N,1,,129416,25478,SEP
2,,SING,N,H,no,N,2,,129416,25478,SEP
3,,SING,N,H2,no,N,3,,129416,25478,SEP
4,,SING,CA,CB,no,N,4,,129416,25478,SEP
5,,SING,CA,C,no,N,5,,129416,25478,SEP
6,,SING,CA,HA,no,N,6,,129416,25478,SEP
7,,SING,CB,OG,no,N,7,,129416,25478,SEP
8,,SING,CB,HB2,no,N,8,,129416,25478,SEP
9,,SING,CB,HB3,no,N,9,,129416,25478,SEP
10,,SING,OG,P,no,N,10,,129416,25478,SEP
11,,DOUB,C,O,no,N,11,,129416,25478,SEP
12,,SING,C,OXT,no,N,12,,129416,25478,SEP
13,,SING,OXT,HXT,no,N,13,,129416,25478,SEP
14,,DOUB,P,O1P,no,N,14,,129416,25478,SEP
15,,SING,P,O2P,no,N,15,,129416,25478,SEP
16,,SING,P,O3P,no,N,16,,129416,25478,SEP
17,,SING,O2P,HOP2,no,N,17,,129416,25478,SEP
18,,SING,O3P,HOP3,no,N,18,,129416,25478,SEP
1,,SING,O1,P1,no,N,1,,129593,25488,PX4
2,,SING,O1,H1P,no,N,2,,129593,25488,PX4
3,,DOUB,O2,P1,no,N,3,,129593,25488,PX4
4,,SING,P1,O3,no,N,4,,129593,25488,PX4
5,,SING,P1,O4,no,N,5,,129593,25488,PX4
6,,SING,O3,C1,no,N,6,,129593,25488,PX4
7,,SING,C1,C2,no,N,7,,129593,25488,PX4
8,,SING,C1,H1,no,N,8,,129593,25488,PX4
9,,SING,C1,H2,no,N,9,,129593,25488,PX4
10,,SING,C2,N1,no,N,10,,129593,25488,PX4
11,,SING,C2,H3,no,N,11,,129593,25488,PX4
12,,SING,C2,H4,no,N,12,,129593,25488,PX4
13,,SING,N1,C3,no,N,13,,129593,25488,PX4
14,,SING,N1,C4,no,N,14,,129593,25488,PX4
15,,SING,N1,C5,no,N,15,,129593,25488,PX4
16,,SING,C3,H5,no,N,16,,129593,25488,PX4
17,,SING,C3,H6,no,N,17,,129593,25488,PX4
18,,SING,C3,H7,no,N,18,,129593,25488,PX4
19,,SING,C4,H8,no,N,19,,129593,25488,PX4
20,,SING,C4,H9,no,N,20,,129593,25488,PX4
21,,SING,C4,H10,no,N,21,,129593,25488,PX4
22,,SING,C5,H11,no,N,22,,129593,25488,PX4
23,,SING,C5,H12,no,N,23,,129593,25488,PX4
24,,SING,C5,H13,no,N,24,,129593,25488,PX4
25,,SING,O4,C6,no,N,25,,129593,25488,PX4
26,,SING,C6,C7,no,N,26,,129593,25488,PX4
27,,SING,C6,H14,no,N,27,,129593,25488,PX4
28,,SING,C6,H15,no,N,28,,129593,25488,PX4
29,,SING,C7,C8,no,N,29,,129593,25488,PX4
30,,SING,C7,O7,no,N,30,,129593,25488,PX4
31,,SING,C7,H16,no,N,31,,129593,25488,PX4
32,,SING,C8,O5,no,N,32,,129593,25488,PX4
33,,SING,C8,H17,no,N,33,,129593,25488,PX4
34,,SING,C8,H18,no,N,34,,129593,25488,PX4
35,,SING,O5,C9,no,N,35,,129593,25488,PX4
36,,DOUB,C9,O6,no,N,36,,129593,25488,PX4
37,,SING,C9,C10,no,N,37,,129593,25488,PX4
38,,SING,C10,C11,no,N,38,,129593,25488,PX4
39,,SING,C10,H19,no,N,39,,129593,25488,PX4
40,,SING,C10,H20,no,N,40,,129593,25488,PX4
41,,SING,C11,C12,no,N,41,,129593,25488,PX4
42,,SING,C11,H21,no,N,42,,129593,25488,PX4
43,,SING,C11,H22,no,N,43,,129593,25488,PX4
44,,SING,C12,C13,no,N,44,,129593,25488,PX4
45,,SING,C12,H23,no,N,45,,129593,25488,PX4
46,,SING,C12,H24,no,N,46,,129593,25488,PX4
47,,SING,C13,C14,no,N,47,,129593,25488,PX4
48,,SING,C13,H25,no,N,48,,129593,25488,PX4
49,,SING,C13,H26,no,N,49,,129593,25488,PX4
50,,SING,C14,C15,no,N,50,,129593,25488,PX4
51,,SING,C14,H27,no,N,51,,129593,25488,PX4
52,,SING,C14,H28,no,N,52,,129593,25488,PX4
53,,SING,C15,C16,no,N,53,,129593,25488,PX4
54,,SING,C15,H29,no,N,54,,129593,25488,PX4
55,,SING,C15,H30,no,N,55,,129593,25488,PX4
56,,SING,C16,C17,no,N,56,,129593,25488,PX4
57,,SING,C16,H31,no,N,57,,129593,25488,PX4
58,,SING,C16,H32,no,N,58,,129593,25488,PX4
59,,SING,C17,C18,no,N,59,,129593,25488,PX4
60,,SING,C17,H33,no,N,60,,129593,25488,PX4
61,,SING,C17,H34,no,N,61,,129593,25488,PX4
62,,SING,C18,C19,no,N,62,,129593,25488,PX4
63,,SING,C18,H35,no,N,63,,129593,25488,PX4
64,,SING,C18,H36,no,N,64,,129593,25488,PX4
65,,SING,C19,C20,no,N,65,,129593,25488,PX4
66,,SING,C19,H37,no,N,66,,129593,25488,PX4
67,,SING,C19,H38,no,N,67,,129593,25488,PX4
68,,SING,C20,C21,no,N,68,,129593,25488,PX4
69,,SING,C20,H39,no,N,69,,129593,25488,PX4
70,,SING,C20,H40,no,N,70,,129593,25488,PX4
71,,SING,C21,C22,no,N,71,,129593,25488,PX4
72,,SING,C21,H41,no,N,72,,129593,25488,PX4
73,,SING,C21,H42,no,N,73,,129593,25488,PX4
74,,SING,C22,H43,no,N,74,,129593,25488,PX4
75,,SING,C22,H44,no,N,75,,129593,25488,PX4
76,,SING,C22,H45,no,N,76,,129593,25488,PX4
77,,SING,O7,C23,no,N,77,,129593,25488,PX4
78,,DOUB,C23,O8,no,N,78,,129593,25488,PX4
79,,SING,C23,C24,no,N,79,,129593,25488,PX4
80,,SING,C24,C25,no,N,80,,129593,25488,PX4
81,,SING,C24,H46,no,N,81,,129593,25488,PX4
82,,SING,C24,H47,no,N,82,,129593,25488,PX4
83,,SING,C25,C26,no,N,83,,129593,25488,PX4
84,,SING,C25,H48,no,N,84,,129593,25488,PX4
85,,SING,C25,H49,no,N,85,,129593,25488,PX4
86,,SING,C26,C27,no,N,86,,129593,25488,PX4
87,,SING,C26,H50,no,N,87,,129593,25488,PX4
88,,SING,C26,H51,no,N,88,,129593,25488,PX4
89,,SING,C27,C28,no,N,89,,129593,25488,PX4
90,,SING,C27,H52,no,N,90,,129593,25488,PX4
91,,SING,C27,H53,no,N,91,,129593,25488,PX4
92,,SING,C28,C29,no,N,92,,129593,25488,PX4
93,,SING,C28,H54,no,N,93,,129593,25488,PX4
94,,SING,C28,H55,no,N,94,,129593,25488,PX4
95,,SING,C29,C30,no,N,95,,129593,25488,PX4
96,,SING,C29,H56,no,N,96,,129593,25488,PX4
97,,SING,C29,H57,no,N,97,,129593,25488,PX4
98,,SING,C30,C31,no,N,98,,129593,25488,PX4
99,,SING,C30,H58,no,N,99,,129593,25488,PX4
100,,SING,C30,H59,no,N,100,,129593,25488,PX4
101,,SING,C31,C32,no,N,101,,129593,25488,PX4
102,,SING,C31,H60,no,N,102,,129593,25488,PX4
103,,SING,C31,H61,no,N,103,,129593,25488,PX4
104,,SING,C32,C33,no,N,104,,129593,25488,PX4
105,,SING,C32,H62,no,N,105,,129593,25488,PX4
106,,SING,C32,H63,no,N,106,,129593,25488,PX4
107,,SING,C33,C34,no,N,107,,129593,25488,PX4
108,,SING,C33,H64,no,N,108,,129593,25488,PX4
109,,SING,C33,H65,no,N,109,,129593,25488,PX4
110,,SING,C34,C35,no,N,110,,129593,25488,PX4
111,,SING,C34,H66,no,N,111,,129593,25488,PX4
112,,SING,C34,H67,no,N,112,,129593,25488,PX4
113,,SING,C35,C36,no,N,113,,129593,25488,PX4
114,,SING,C35,H68,no,N,114,,129593,25488,PX4
115,,SING,C35,H69,no,N,115,,129593,25488,PX4
116,,SING,C36,H70,no,N,116,,129593,25488,PX4
117,,SING,C36,H71,no,N,117,,129593,25488,PX4
118,,SING,C36,H72,no,N,118,,129593,25488,PX4
1,,SING,O1,P1,no,N,1,,129618,25489,PX4
2,,SING,O1,H1P,no,N,2,,129618,25489,PX4
3,,DOUB,O2,P1,no,N,3,,129618,25489,PX4
4,,SING,P1,O3,no,N,4,,129618,25489,PX4
5,,SING,P1,O4,no,N,5,,129618,25489,PX4
6,,SING,O3,C1,no,N,6,,129618,25489,PX4
7,,SING,C1,C2,no,N,7,,129618,25489,PX4
8,,SING,C1,H1,no,N,8,,129618,25489,PX4
9,,SING,C1,H2,no,N,9,,129618,25489,PX4
10,,SING,C2,N1,no,N,10,,129618,25489,PX4
11,,SING,C2,H3,no,N,11,,129618,25489,PX4
12,,SING,C2,H4,no,N,12,,129618,25489,PX4
13,,SING,N1,C3,no,N,13,,129618,25489,PX4
14,,SING,N1,C4,no,N,14,,129618,25489,PX4
15,,SING,N1,C5,no,N,15,,129618,25489,PX4
16,,SING,C3,H5,no,N,16,,129618,25489,PX4
17,,SING,C3,H6,no,N,17,,129618,25489,PX4
18,,SING,C3,H7,no,N,18,,129618,25489,PX4
19,,SING,C4,H8,no,N,19,,129618,25489,PX4
20,,SING,C4,H9,no,N,20,,129618,25489,PX4
21,,SING,C4,H10,no,N,21,,129618,25489,PX4
22,,SING,C5,H11,no,N,22,,129618,25489,PX4
23,,SING,C5,H12,no,N,23,,129618,25489,PX4
24,,SING,C5,H13,no,N,24,,129618,25489,PX4
25,,SING,O4,C6,no,N,25,,129618,25489,PX4
26,,SING,C6,C7,no,N,26,,129618,25489,PX4
27,,SING,C6,H14,no,N,27,,129618,25489,PX4
28,,SING,C6,H15,no,N,28,,129618,25489,PX4
29,,SING,C7,C8,no,N,29,,129618,25489,PX4
30,,SING,C7,O7,no,N,30,,129618,25489,PX4
31,,SING,C7,H16,no,N,31,,129618,25489,PX4
32,,SING,C8,O5,no,N,32,,129618,25489,PX4
33,,SING,C8,H17,no,N,33,,129618,25489,PX4
34,,SING,C8,H18,no,N,34,,129618,25489,PX4
35,,SING,O5,C9,no,N,35,,129618,25489,PX4
36,,DOUB,C9,O6,no,N,36,,129618,25489,PX4
37,,SING,C9,C10,no,N,37,,129618,25489,PX4
38,,SING,C10,C11,no,N,38,,129618,25489,PX4
39,,SING,C10,H19,no,N,39,,129618,25489,PX4
40,,SING,C10,H20,no,N,40,,129618,25489,PX4
41,,SING,C11,C12,no,N,41,,129618,25489,PX4
42,,SING,C11,H21,no,N,42,,129618,25489,PX4
43,,SING,C11,H22,no,N,43,,129618,25489,PX4
44,,SING,C12,C13,no,N,44,,129618,25489,PX4
45,,SING,C12,H23,no,N,45,,129618,25489,PX4
46,,SING,C12,H24,no,N,46,,129618,25489,PX4
47,,SING,C13,C14,no,N,47,,129618,25489,PX4
48,,SING,C13,H25,no,N,48,,129618,25489,PX4
49,,SING,C13,H26,no,N,49,,129618,25489,PX4
50,,SING,C14,C15,no,N,50,,129618,25489,PX4
51,,SING,C14,H27,no,N,51,,129618,25489,PX4
52,,SING,C14,H28,no,N,52,,129618,25489,PX4
53,,SING,C15,C16,no,N,53,,129618,25489,PX4
54,,SING,C15,H29,no,N,54,,129618,25489,PX4
55,,SING,C15,H30,no,N,55,,129618,25489,PX4
56,,SING,C16,C17,no,N,56,,129618,25489,PX4
57,,SING,C16,H31,no,N,57,,129618,25489,PX4
58,,SING,C16,H32,no,N,58,,129618,25489,PX4
59,,SING,C17,C18,no,N,59,,129618,25489,PX4
60,,SING,C17,H33,no,N,60,,129618,25489,PX4
61,,SING,C17,H34,no,N,61,,129618,25489,PX4
62,,SING,C18,C19,no,N,62,,129618,25489,PX4
63,,SING,C18,H35,no,N,63,,129618,25489,PX4
64,,SING,C18,H36,no,N,64,,129618,25489,PX4
65,,SING,C19,C20,no,N,65,,129618,25489,PX4
66,,SING,C19,H37,no,N,66,,129618,25489,PX4
67,,SING,C19,H38,no,N,67,,129618,25489,PX4
68,,SING,C20,C21,no,N,68,,129618,25489,PX4
69,,SING,C20,H39,no,N,69,,129618,25489,PX4
70,,SING,C20,H40,no,N,70,,129618,25489,PX4
71,,SING,C21,C22,no,N,71,,129618,25489,PX4
72,,SING,C21,H41,no,N,72,,129618,25489,PX4
73,,SING,C21,H42,no,N,73,,129618,25489,PX4
74,,SING,C22,H43,no,N,74,,129618,25489,PX4
75,,SING,C22,H44,no,N,75,,129618,25489,PX4
76,,SING,C22,H45,no,N,76,,129618,25489,PX4
77,,SING,O7,C23,no,N,77,,129618,25489,PX4
78,,DOUB,C23,O8,no,N,78,,129618,25489,PX4
79,,SING,C23,C24,no,N,79,,129618,25489,PX4
80,,SING,C24,C25,no,N,80,,129618,25489,PX4
81,,SING,C24,H46,no,N,81,,129618,25489,PX4
82,,SING,C24,H47,no,N,82,,129618,25489,PX4
83,,SING,C25,C26,no,N,83,,129618,25489,PX4
84,,SING,C25,H48,no,N,84,,129618,25489,PX4
85,,SING,C25,H49,no,N,85,,129618,25489,PX4
86,,SING,C26,C27,no,N,86,,129618,25489,PX4
87,,SING,C26,H50,no,N,87,,129618,25489,PX4
88,,SING,C26,H51,no,N,88,,129618,25489,PX4
89,,SING,C27,C28,no,N,89,,129618,25489,PX4
90,,SING,C27,H52,no,N,90,,129618,25489,PX4
91,,SING,C27,H53,no,N,91,,129618,25489,PX4
92,,SING,C28,C29,no,N,92,,129618,25489,PX4
93,,SING,C28,H54,no,N,93,,129618,25489,PX4
94,,SING,C28,H55,no,N,94,,129618,25489,PX4
95,,SING,C29,C30,no,N,95,,129618,25489,PX4
96,,SING,C29,H56,no,N,96,,129618,25489,PX4
97,,SING,C29,H57,no,N,97,,129618,25489,PX4
98,,SING,C30,C31,no,N,98,,129618,25489,PX4
99,,SING,C30,H58,no,N,99,,129618,25489,PX4
100,,SING,C30,H59,no,N,100,,129618,25489,PX4
101,,SING,C31,C32,no,N,101,,129618,25489,PX4
102,,SING,C31,H60,no,N,102,,129618,25489,PX4
103,,SING,C31,H61,no,N,103,,129618,25489,PX4
104,,SING,C32,C33,no,N,104,,129618,25489,PX4
105,,SING,C32,H62,no,N,105,,129618,25489,PX4
106,,SING,C32,H63,no,N,106,,129618,25489,PX4
107,,SING,C33,C34,no,N,107,,129618,25489,PX4
108,,SING,C33,H64,no,N,108,,129618,25489,PX4
109,,SING,C33,H65,no,N,109,,129618,25489,PX4
110,,SING,C34,C35,no,N,110,,129618,25489,PX4
111,,SING,C34,H66,no,N,111,,129618,25489,PX4
112,,SING,C34,H67,no,N,112,,129618,25489,PX4
113,,SING,C35,C36,no,N,113,,129618,25489,PX4
114,,SING,C35,H68,no,N,114,,129618,25489,PX4
115,,SING,C35,H69,no,N,115,,129618,25489,PX4
116,,SING,C36,H70,no,N,116,,129618,25489,PX4
117,,SING,C36,H71,no,N,117,,129618,25489,PX4
118,,SING,C36,H72,no,N,118,,129618,25489,PX4
1,,SING,C65,C63,no,N,1,,129619,25489,C3S
2,,SING,C65,H651,no,N,2,,129619,25489,C3S
3,,SING,C65,H652,no,N,3,,129619,25489,C3S
4,,SING,C65,H653,no,N,4,,129619,25489,C3S
5,,SING,C63,C69,no,N,5,,129619,25489,C3S
6,,SING,C63,C60,no,N,6,,129619,25489,C3S
7,,SING,C63,H63,no,N,7,,129619,25489,C3S
8,,SING,C69,H691,no,N,8,,129619,25489,C3S
9,,SING,C69,H692,no,N,9,,129619,25489,C3S
10,,SING,C69,H693,no,N,10,,129619,25489,C3S
11,,SING,C60,C57,no,N,11,,129619,25489,C3S
12,,SING,C60,H601,no,N,12,,129619,25489,C3S
13,,SING,C60,H602,no,N,13,,129619,25489,C3S
14,,SING,C57,C54,no,N,14,,129619,25489,C3S
15,,SING,C57,H571,no,N,15,,129619,25489,C3S
16,,SING,C57,H572,no,N,16,,129619,25489,C3S
17,,SING,C54,C48,no,N,17,,129619,25489,C3S
18,,SING,C54,H541,no,N,18,,129619,25489,C3S
19,,SING,C54,H542,no,N,19,,129619,25489,C3S
20,,SING,C48,C50,no,N,20,,129619,25489,C3S
21,,SING,C48,C38,no,N,21,,129619,25489,C3S
22,,SING,C48,H48,no,N,22,,129619,25489,C3S
23,,SING,C50,H501,no,N,23,,129619,25489,C3S
24,,SING,C50,H502,no,N,24,,129619,25489,C3S
25,,SING,C50,H503,no,N,25,,129619,25489,C3S
26,,SING,C38,C35,no,N,26,,129619,25489,C3S
27,,SING,C38,C29,no,N,27,,129619,25489,C3S
28,,SING,C38,H38,no,N,28,,129619,25489,C3S
29,,SING,C35,C32,no,N,29,,129619,25489,C3S
30,,SING,C35,H351,no,N,30,,129619,25489,C3S
31,,SING,C35,H352,no,N,31,,129619,25489,C3S
32,,SING,C29,C26,no,N,32,,129619,25489,C3S
33,,SING,C29,C40,no,N,33,,129619,25489,C3S
34,,SING,C29,C30,no,N,34,,129619,25489,C3S
35,,SING,C26,C23,no,N,35,,129619,25489,C3S
36,,SING,C26,H261,no,N,36,,129619,25489,C3S
37,,SING,C26,H262,no,N,37,,129619,25489,C3S
38,,SING,C40,H401,no,N,38,,129619,25489,C3S
39,,SING,C40,H402,no,N,39,,129619,25489,C3S
40,,SING,C40,H403,no,N,40,,129619,25489,C3S
41,,SING,C30,C32,no,N,41,,129619,25489,C3S
42,,SING,C30,C18,no,N,42,,129619,25489,C3S
43,,SING,C30,H30,no,N,43,,129619,25489,C3S
44,,SING,C32,H321,no,N,44,,129619,25489,C3S
45,,SING,C32,H322,no,N,45,,129619,25489,C3S
46,,SING,C18,C15,no,N,46,,129619,25489,C3S
47,,SING,C18,C20,no,N,47,,129619,25489,C3S
48,,SING,C18,H18,no,N,48,,129619,25489,C3S
49,,SING,C15,C13,no,N,49,,129619,25489,C3S
50,,SING,C15,H151,no,N,50,,129619,25489,C3S
51,,SING,C15,H152,no,N,51,,129619,25489,C3S
52,,SING,C20,C23,no,N,52,,129619,25489,C3S
53,,SING,C20,C22,no,N,53,,129619,25489,C3S
54,,SING,C20,H20,no,N,54,,129619,25489,C3S
55,,SING,C23,H231,no,N,55,,129619,25489,C3S
56,,SING,C23,H232,no,N,56,,129619,25489,C3S
57,,SING,C22,C44,no,N,57,,129619,25489,C3S
58,,SING,C22,C12,no,N,58,,129619,25489,C3S
59,,SING,C22,C1,no,N,59,,129619,25489,C3S
60,,SING,C44,H441,no,N,60,,129619,25489,C3S
61,,SING,C44,H442,no,N,61,,129619,25489,C3S
62,,SING,C44,H443,no,N,62,,129619,25489,C3S
63,,SING,C12,C9,no,N,63,,129619,25489,C3S
64,,DOUB,C12,C13,no,N,64,,129619,25489,C3S
65,,SING,C9,C7,no,N,65,,129619,25489,C3S
66,,SING,C9,H91,no,N,66,,129619,25489,C3S
67,,SING,C9,H92,no,N,67,,129619,25489,C3S
68,,SING,C13,H13,no,N,68,,129619,25489,C3S
69,,SING,C1,C4,no,N,69,,129619,25489,C3S
70,,SING,C1,H11,no,N,70,,129619,25489,C3S
71,,SING,C1,H12,no,N,71,,129619,25489,C3S
72,,SING,C4,C7,no,N,72,,129619,25489,C3S
73,,SING,C4,H41,no,N,73,,129619,25489,C3S
74,,SING,C4,H42,no,N,74,,129619,25489,C3S
75,,SING,C7,O6,no,N,75,,129619,25489,C3S
76,,SING,C7,H7,no,N,76,,129619,25489,C3S
77,,SING,O6,S1,no,N,77,,129619,25489,C3S
78,,SING,S1,O3,no,N,78,,129619,25489,C3S
79,,DOUB,S1,O2,no,N,79,,129619,25489,C3S
80,,DOUB,S1,O4,no,N,80,,129619,25489,C3S
81,,SING,O3,HO3,no,N,81,,129619,25489,C3S
1,,SING,C1,C2,no,N,1,,129638,25490,GLA
2,,SING,C1,O1,no,N,2,,129638,25490,GLA
3,,SING,C1,O5,no,N,3,,129638,25490,GLA
4,,SING,C1,H1,no,N,4,,129638,25490,GLA
5,,SING,C2,C3,no,N,5,,129638,25490,GLA
6,,SING,C2,O2,no,N,6,,129638,25490,GLA
7,,SING,C2,H2,no,N,7,,129638,25490,GLA
8,,SING,C3,C4,no,N,8,,129638,25490,GLA
9,,SING,C3,O3,no,N,9,,129638,25490,GLA
10,,SING,C3,H3,no,N,10,,129638,25490,GLA
11,,SING,C4,C5,no,N,11,,129638,25490,GLA
12,,SING,C4,O4,no,N,12,,129638,25490,GLA
13,,SING,C4,H4,no,N,13,,129638,25490,GLA
14,,SING,C5,C6,no,N,14,,129638,25490,GLA
15,,SING,C5,O5,no,N,15,,129638,25490,GLA
16,,SING,C5,H5,no,N,16,,129638,25490,GLA
17,,SING,C6,O6,no,N,17,,129638,25490,GLA
18,,SING,C6,H61,no,N,18,,129638,25490,GLA
19,,SING,C6,H62,no,N,19,,129638,25490,GLA
20,,SING,O1,HO1,no,N,20,,129638,25490,GLA
21,,SING,O2,HO2,no,N,21,,129638,25490,GLA
22,,SING,O3,HO3,no,N,22,,129638,25490,GLA
23,,SING,O4,HO4,no,N,23,,129638,25490,GLA
24,,SING,O6,HO6,no,N,24,,129638,25490,GLA
1,,SING,N,CA,no,N,1,,129639,25490,HYP
2,,SING,N,CD,no,N,2,,129639,25490,HYP
3,,SING,N,H,no,N,3,,129639,25490,HYP
4,,SING,CA,C,no,N,4,,129639,25490,HYP
5,,SING,CA,CB,no,N,5,,129639,25490,HYP
6,,SING,CA,HA,no,N,6,,129639,25490,HYP
7,,DOUB,C,O,no,N,7,,129639,25490,HYP
8,,SING,C,OXT,no,N,8,,129639,25490,HYP
9,,SING,CB,CG,no,N,9,,129639,25490,HYP
10,,SING,CB,HB2,no,N,10,,129639,25490,HYP
11,,SING,CB,HB3,no,N,11,,129639,25490,HYP
12,,SING,CG,CD,no,N,12,,129639,25490,HYP
13,,SING,CG,OD1,no,N,13,,129639,25490,HYP
14,,SING,CG,HG,no,N,14,,129639,25490,HYP
15,,SING,CD,HD22,no,N,15,,129639,25490,HYP
16,,SING,CD,HD23,no,N,16,,129639,25490,HYP
17,,SING,OD1,HD1,no,N,17,,129639,25490,HYP
18,,SING,OXT,HXT,no,N,18,,129639,25490,HYP
1,,SING,N,HN1,no,N,1,,129640,25490,NH2
2,,SING,N,HN2,no,N,2,,129640,25490,NH2
1,,SING,N,CA,no,N,1,,129658,25491,CGU
2,,SING,N,H,no,N,2,,129658,25491,CGU
3,,SING,N,HN2,no,N,3,,129658,25491,CGU
4,,SING,CA,C,no,N,4,,129658,25491,CGU
5,,SING,CA,CB,no,N,5,,129658,25491,CGU
6,,SING,CA,HA,no,N,6,,129658,25491,CGU
7,,DOUB,C,O,no,N,7,,129658,25491,CGU
8,,SING,C,OXT,no,N,8,,129658,25491,CGU
9,,SING,OXT,HXT,no,N,9,,129658,25491,CGU
10,,SING,CB,CG,no,N,10,,129658,25491,CGU
11,,SING,CB,HB2,no,N,11,,129658,25491,CGU
12,,SING,CB,HB3,no,N,12,,129658,25491,CGU
13,,SING,CG,CD1,no,N,13,,129658,25491,CGU
14,,SING,CG,CD2,no,N,14,,129658,25491,CGU
15,,SING,CG,HG,no,N,15,,129658,25491,CGU
16,,DOUB,CD1,OE11,no,N,16,,129658,25491,CGU
17,,SING,CD1,OE12,no,N,17,,129658,25491,CGU
18,,DOUB,CD2,OE21,no,N,18,,129658,25491,CGU
19,,SING,CD2,OE22,no,N,19,,129658,25491,CGU
20,,SING,OE12,HE12,no,N,20,,129658,25491,CGU
21,,SING,OE22,HE22,no,N,21,,129658,25491,CGU
1,,SING,N,CA,no,N,1,,129659,25491,HYP
2,,SING,N,CD,no,N,2,,129659,25491,HYP
3,,SING,N,H,no,N,3,,129659,25491,HYP
4,,SING,CA,C,no,N,4,,129659,25491,HYP
5,,SING,CA,CB,no,N,5,,129659,25491,HYP
6,,SING,CA,HA,no,N,6,,129659,25491,HYP
7,,DOUB,C,O,no,N,7,,129659,25491,HYP
8,,SING,C,OXT,no,N,8,,129659,25491,HYP
9,,SING,CB,CG,no,N,9,,129659,25491,HYP
10,,SING,CB,HB2,no,N,10,,129659,25491,HYP
11,,SING,CB,HB3,no,N,11,,129659,25491,HYP
12,,SING,CG,CD,no,N,12,,129659,25491,HYP
13,,SING,CG,OD1,no,N,13,,129659,25491,HYP
14,,SING,CG,HG,no,N,14,,129659,25491,HYP
15,,SING,CD,HD22,no,N,15,,129659,25491,HYP
16,,SING,CD,HD23,no,N,16,,129659,25491,HYP
17,,SING,OD1,HD1,no,N,17,,129659,25491,HYP
18,,SING,OXT,HXT,no,N,18,,129659,25491,HYP
1,,SING,N,HN1,no,N,1,,129660,25491,NH2
2,,SING,N,HN2,no,N,2,,129660,25491,NH2
1,,SING,OA1,C4,no,N,1,,129886,25502,ORI
2,,DOUB,C6,C7,yes,N,2,,129886,25502,ORI
3,,SING,C6,C5,yes,N,3,,129886,25502,ORI
4,,DOUB,C4,C5,yes,N,4,,129886,25502,ORI
5,,SING,C4,C3,yes,N,5,,129886,25502,ORI
6,,SING,C7,C8,yes,N,6,,129886,25502,ORI
7,,SING,C5,C10,yes,N,7,,129886,25502,ORI
8,,DOUB,C3,C2,yes,N,8,,129886,25502,ORI
9,,DOUB,C8,C9,yes,N,9,,129886,25502,ORI
10,,SING,C10,C9,yes,N,10,,129886,25502,ORI
11,,DOUB,C10,C1,yes,N,11,,129886,25502,ORI
12,,SING,C2,C1,yes,N,12,,129886,25502,ORI
13,,SING,C1,N1,no,N,13,,129886,25502,ORI
14,,DOUB,N1,N2,no,N,14,,129886,25502,ORI
15,,SING,N2,CB1,no,N,15,,129886,25502,ORI
16,,DOUB,CB1,CB2,yes,N,16,,129886,25502,ORI
17,,SING,CB1,CB6,yes,N,17,,129886,25502,ORI
18,,SING,CB2,CB3,yes,N,18,,129886,25502,ORI
19,,DOUB,CB6,CB5,yes,N,19,,129886,25502,ORI
20,,DOUB,CB3,CB4,yes,N,20,,129886,25502,ORI
21,,SING,CB5,CB4,yes,N,21,,129886,25502,ORI
22,,SING,CB4,SB,no,N,22,,129886,25502,ORI
23,,DOUB,OB4,SB,no,N,23,,129886,25502,ORI
24,,DOUB,SB,OB2,no,N,24,,129886,25502,ORI
25,,SING,SB,OB3,no,N,25,,129886,25502,ORI
26,,SING,CB5,H1,no,N,26,,129886,25502,ORI
27,,SING,CB6,H2,no,N,27,,129886,25502,ORI
28,,SING,CB3,H3,no,N,28,,129886,25502,ORI
29,,SING,CB2,H4,no,N,29,,129886,25502,ORI
30,,SING,C2,H5,no,N,30,,129886,25502,ORI
31,,SING,C3,H6,no,N,31,,129886,25502,ORI
32,,SING,OA1,H7,no,N,32,,129886,25502,ORI
33,,SING,C6,H8,no,N,33,,129886,25502,ORI
34,,SING,C7,H9,no,N,34,,129886,25502,ORI
35,,SING,C8,H10,no,N,35,,129886,25502,ORI
36,,SING,C9,H11,no,N,36,,129886,25502,ORI
37,,SING,OB3,H12,no,N,37,,129886,25502,ORI
1,,TRIPLE,RE,O1,no,N,1,,129952,25506,Re1O1
1,covalent,SING,C2,S1,no,N,1,,129953,25506,SDPhe
2,covalent,SING,C2,H3,no,N,2,,129953,25506,SDPhe
3,covalent,SING,C2,C4,no,N,3,,129953,25506,SDPhe
4,carbonyl,DOUB,C4,O5,no,N,4,,129953,25506,SDPhe
5,ester,SING,C4,O6,no,N,5,,129953,25506,SDPhe
6,covalent,SING,C2,C7,no,N,6,,129953,25506,SDPhe
7,covalent,SING,C7,C8,no,N,7,,129953,25506,SDPhe
8,covalent,AROM,C8,C9,yes,N,8,,129953,25506,SDPhe
9,covalent,AROM,C9,C10,yes,N,9,,129953,25506,SDPhe
10,covalent,AROM,C10,C11,yes,N,10,,129953,25506,SDPhe
11,covalent,AROM,C11,C12,yes,N,11,,129953,25506,SDPhe
12,covalent,AROM,C12,C13,yes,N,12,,129953,25506,SDPhe
13,covalent,AROM,C8,C13,yes,N,13,,129953,25506,SDPhe
14,covalent,SING,S1,H14,no,N,14,,129953,25506,SDPhe
15,covalent,SING,O6,H15,no,N,15,,129953,25506,SDPhe
16,covalent,SING,C7,H16,no,N,16,,129953,25506,SDPhe
17,covalent,SING,C7,H17,no,N,17,,129953,25506,SDPhe
18,covalent,SING,C9,H18,no,N,18,,129953,25506,SDPhe
19,covalent,SING,C10,H19,no,N,19,,129953,25506,SDPhe
20,covalent,SING,C11,H20,no,N,20,,129953,25506,SDPhe
21,covalent,SING,C12,H21,no,N,21,,129953,25506,SDPhe
22,covalent,SING,C13,H22,no,N,22,,129953,25506,SDPhe
1,,SING,N,CA,no,N,1,,129954,25506,DTR
2,,SING,N,H,no,N,2,,129954,25506,DTR
3,,SING,N,HN2,no,N,3,,129954,25506,DTR
4,,SING,CA,CB,no,N,4,,129954,25506,DTR
5,,SING,CA,C,no,N,5,,129954,25506,DTR
6,,SING,CA,HA,no,N,6,,129954,25506,DTR
7,,SING,CB,CG,no,N,7,,129954,25506,DTR
8,,SING,CB,HB2,no,N,8,,129954,25506,DTR
9,,SING,CB,HB3,no,N,9,,129954,25506,DTR
10,,DOUB,CG,CD1,yes,N,10,,129954,25506,DTR
11,,SING,CG,CD2,yes,N,11,,129954,25506,DTR
12,,SING,CD1,NE1,yes,N,12,,129954,25506,DTR
13,,SING,CD1,HD1,no,N,13,,129954,25506,DTR
14,,SING,NE1,CE2,yes,N,14,,129954,25506,DTR
15,,SING,NE1,HE1,no,N,15,,129954,25506,DTR
16,,DOUB,CE2,CZ2,yes,N,16,,129954,25506,DTR
17,,SING,CE2,CD2,yes,N,17,,129954,25506,DTR
18,,SING,CZ2,CH2,yes,N,18,,129954,25506,DTR
19,,SING,CZ2,HZ2,no,N,19,,129954,25506,DTR
20,,DOUB,CH2,CZ3,yes,N,20,,129954,25506,DTR
21,,SING,CH2,HH2,no,N,21,,129954,25506,DTR
22,,SING,CZ3,CE3,yes,N,22,,129954,25506,DTR
23,,SING,CZ3,HZ3,no,N,23,,129954,25506,DTR
24,,DOUB,CE3,CD2,yes,N,24,,129954,25506,DTR
25,,SING,CE3,HE3,no,N,25,,129954,25506,DTR
26,,DOUB,C,O,no,N,26,,129954,25506,DTR
27,,SING,C,OXT,no,N,27,,129954,25506,DTR
28,,SING,OXT,HXT,no,N,28,,129954,25506,DTR
1,covalent,SING,C2,S1,no,N,1,,129971,25507,SDPhe
2,covalent,SING,C2,H3,no,N,2,,129971,25507,SDPhe
3,covalent,SING,C2,C4,no,N,3,,129971,25507,SDPhe
4,carbonyl,DOUB,C4,O5,no,N,4,,129971,25507,SDPhe
5,ester,SING,C4,O6,no,N,5,,129971,25507,SDPhe
6,covalent,SING,C2,C7,no,N,6,,129971,25507,SDPhe
7,covalent,SING,C7,C8,no,N,7,,129971,25507,SDPhe
8,covalent,AROM,C8,C9,yes,N,8,,129971,25507,SDPhe
9,covalent,AROM,C9,C10,yes,N,9,,129971,25507,SDPhe
10,covalent,AROM,C10,C11,yes,N,10,,129971,25507,SDPhe
11,covalent,AROM,C11,C12,yes,N,11,,129971,25507,SDPhe
12,covalent,AROM,C12,C13,yes,N,12,,129971,25507,SDPhe
13,covalent,AROM,C8,C13,yes,N,13,,129971,25507,SDPhe
14,covalent,SING,S1,H14,no,N,14,,129971,25507,SDPhe
15,covalent,SING,O6,H15,no,N,15,,129971,25507,SDPhe
16,covalent,SING,C7,H16,no,N,16,,129971,25507,SDPhe
17,covalent,SING,C7,H17,no,N,17,,129971,25507,SDPhe
18,covalent,SING,C9,H18,no,N,18,,129971,25507,SDPhe
19,covalent,SING,C10,H19,no,N,19,,129971,25507,SDPhe
20,covalent,SING,C11,H20,no,N,20,,129971,25507,SDPhe
21,covalent,SING,C12,H21,no,N,21,,129971,25507,SDPhe
22,covalent,SING,C13,H22,no,N,22,,129971,25507,SDPhe
1,,SING,N,CA,no,N,1,,129972,25507,DTR
2,,SING,N,H,no,N,2,,129972,25507,DTR
3,,SING,N,HN2,no,N,3,,129972,25507,DTR
4,,SING,CA,CB,no,N,4,,129972,25507,DTR
5,,SING,CA,C,no,N,5,,129972,25507,DTR
6,,SING,CA,HA,no,N,6,,129972,25507,DTR
7,,SING,CB,CG,no,N,7,,129972,25507,DTR
8,,SING,CB,HB2,no,N,8,,129972,25507,DTR
9,,SING,CB,HB3,no,N,9,,129972,25507,DTR
10,,DOUB,CG,CD1,yes,N,10,,129972,25507,DTR
11,,SING,CG,CD2,yes,N,11,,129972,25507,DTR
12,,SING,CD1,NE1,yes,N,12,,129972,25507,DTR
13,,SING,CD1,HD1,no,N,13,,129972,25507,DTR
14,,SING,NE1,CE2,yes,N,14,,129972,25507,DTR
15,,SING,NE1,HE1,no,N,15,,129972,25507,DTR
16,,DOUB,CE2,CZ2,yes,N,16,,129972,25507,DTR
17,,SING,CE2,CD2,yes,N,17,,129972,25507,DTR
18,,SING,CZ2,CH2,yes,N,18,,129972,25507,DTR
19,,SING,CZ2,HZ2,no,N,19,,129972,25507,DTR
20,,DOUB,CH2,CZ3,yes,N,20,,129972,25507,DTR
21,,SING,CH2,HH2,no,N,21,,129972,25507,DTR
22,,SING,CZ3,CE3,yes,N,22,,129972,25507,DTR
23,,SING,CZ3,HZ3,no,N,23,,129972,25507,DTR
24,,DOUB,CE3,CD2,yes,N,24,,129972,25507,DTR
25,,SING,CE3,HE3,no,N,25,,129972,25507,DTR
26,,DOUB,C,O,no,N,26,,129972,25507,DTR
27,,SING,C,OXT,no,N,27,,129972,25507,DTR
28,,SING,OXT,HXT,no,N,28,,129972,25507,DTR
1,,DOUB,C,O,no,N,1,,130094,25512,ACE
2,,SING,C,CH3,no,N,2,,130094,25512,ACE
3,,SING,C,H,no,N,3,,130094,25512,ACE
4,,SING,CH3,H1,no,N,4,,130094,25512,ACE
5,,SING,CH3,H2,no,N,5,,130094,25512,ACE
6,,SING,CH3,H3,no,N,6,,130094,25512,ACE
1,,SING,N,HN1,no,N,1,,130095,25512,NH2
2,,SING,N,HN2,no,N,2,,130095,25512,NH2
1,,DOUB,C22,C23,yes,N,1,,130116,25513,PKA
2,,SING,C22,C21,yes,N,2,,130116,25513,PKA
3,,SING,C23,C24,yes,N,3,,130116,25513,PKA
4,,DOUB,C21,C20,yes,N,4,,130116,25513,PKA
5,,SING,C24,CL,no,N,5,,130116,25513,PKA
6,,DOUB,C24,C19,yes,N,6,,130116,25513,PKA
7,,DOUB,C14,C15,yes,N,7,,130116,25513,PKA
8,,SING,C14,C13,yes,N,8,,130116,25513,PKA
9,,SING,C20,C19,yes,N,9,,130116,25513,PKA
10,,SING,C15,C16,yes,N,10,,130116,25513,PKA
11,,SING,C19,C17,no,N,11,,130116,25513,PKA
12,,DOUB,C13,C12,yes,N,12,,130116,25513,PKA
13,,DOUB,C16,C17,yes,N,13,,130116,25513,PKA
14,,SING,C16,C11,yes,N,14,,130116,25513,PKA
15,,SING,C17,N18,yes,N,15,,130116,25513,PKA
16,,SING,C12,C11,yes,N,16,,130116,25513,PKA
17,,DOUB,C11,C10,yes,N,17,,130116,25513,PKA
18,,DOUB,N18,C9,yes,N,18,,130116,25513,PKA
19,,SING,C10,C9,yes,N,19,,130116,25513,PKA
20,,SING,C9,C7,no,N,20,,130116,25513,PKA
21,,SING,C1,C2,no,N,21,,130116,25513,PKA
22,,SING,C3,C4,no,N,22,,130116,25513,PKA
23,,SING,C3,C2,no,N,23,,130116,25513,PKA
24,,SING,C3,N5,no,N,24,,130116,25513,PKA
25,,SING,C7,N5,no,N,25,,130116,25513,PKA
26,,DOUB,C7,O8,no,N,26,,130116,25513,PKA
27,,SING,N5,C6,no,N,27,,130116,25513,PKA
28,,SING,C1,H1C,no,N,28,,130116,25513,PKA
29,,SING,C1,H1A,no,N,29,,130116,25513,PKA
30,,SING,C1,H1B,no,N,30,,130116,25513,PKA
31,,SING,C2,H2A,no,N,31,,130116,25513,PKA
32,,SING,C2,H2B,no,N,32,,130116,25513,PKA
33,,SING,C3,H3,no,N,33,,130116,25513,PKA
34,,SING,C4,H4C,no,N,34,,130116,25513,PKA
35,,SING,C4,H4A,no,N,35,,130116,25513,PKA
36,,SING,C4,H4B,no,N,36,,130116,25513,PKA
37,,SING,C6,H6A,no,N,37,,130116,25513,PKA
38,,SING,C6,H6B,no,N,38,,130116,25513,PKA
39,,SING,C6,H6C,no,N,39,,130116,25513,PKA
40,,SING,C10,H10,no,N,40,,130116,25513,PKA
41,,SING,C12,H12,no,N,41,,130116,25513,PKA
42,,SING,C13,H13,no,N,42,,130116,25513,PKA
43,,SING,C14,H14,no,N,43,,130116,25513,PKA
44,,SING,C15,H15,no,N,44,,130116,25513,PKA
45,,SING,C23,H23,no,N,45,,130116,25513,PKA
46,,SING,C20,H20,no,N,46,,130116,25513,PKA
47,,SING,C21,H21,no,N,47,,130116,25513,PKA
48,,SING,C22,H22,no,N,48,,130116,25513,PKA
1,,SING,N,CA,no,N,1,,130138,25514,SEP
2,,SING,N,H,no,N,2,,130138,25514,SEP
3,,SING,N,H2,no,N,3,,130138,25514,SEP
4,,SING,CA,CB,no,N,4,,130138,25514,SEP
5,,SING,CA,C,no,N,5,,130138,25514,SEP
6,,SING,CA,HA,no,N,6,,130138,25514,SEP
7,,SING,CB,OG,no,N,7,,130138,25514,SEP
8,,SING,CB,HB2,no,N,8,,130138,25514,SEP
9,,SING,CB,HB3,no,N,9,,130138,25514,SEP
10,,SING,OG,P,no,N,10,,130138,25514,SEP
11,,DOUB,C,O,no,N,11,,130138,25514,SEP
12,,SING,C,OXT,no,N,12,,130138,25514,SEP
13,,SING,OXT,HXT,no,N,13,,130138,25514,SEP
14,,DOUB,P,O1P,no,N,14,,130138,25514,SEP
15,,SING,P,O2P,no,N,15,,130138,25514,SEP
16,,SING,P,O3P,no,N,16,,130138,25514,SEP
17,,SING,O2P,HOP2,no,N,17,,130138,25514,SEP
18,,SING,O3P,HOP3,no,N,18,,130138,25514,SEP
1,,SING,N,HN1,no,N,1,,130190,25517,NH2
2,,SING,N,HN2,no,N,2,,130190,25517,NH2
1,,SING,N,HN1,no,N,1,,130228,25519,NH2
2,,SING,N,HN2,no,N,2,,130228,25519,NH2
1,,SING,N,HN1,no,N,1,,130248,25520,NH2
2,,SING,N,HN2,no,N,2,,130248,25520,NH2
1,,SING,N,HN1,no,N,1,,130265,25521,NH2
2,,SING,N,HN2,no,N,2,,130265,25521,NH2
1,,SING,N,HN1,no,N,1,,130282,25522,NH2
2,,SING,N,HN2,no,N,2,,130282,25522,NH2
1,,SING,N,HN1,no,N,1,,130299,25523,NH2
2,,SING,N,HN2,no,N,2,,130299,25523,NH2
1,,SING,N,HN1,no,N,1,,130319,25524,NH2
2,,SING,N,HN2,no,N,2,,130319,25524,NH2
1,,SING,N,HN1,no,N,1,,130336,25525,NH2
2,,SING,N,HN2,no,N,2,,130336,25525,NH2
1,,SING,O1,C1,no,N,1,,130360,25526,RIO
2,,SING,C1,C2,no,N,2,,130360,25526,RIO
3,,SING,C2,O2,no,N,3,,130360,25526,RIO
4,,SING,C2,C17,no,N,4,,130360,25526,RIO
5,,SING,O2,C3,no,N,5,,130360,25526,RIO
6,,SING,C3,O3,no,N,6,,130360,25526,RIO
7,,SING,C3,C16,no,N,7,,130360,25526,RIO
8,,SING,O3,C4,no,N,8,,130360,25526,RIO
9,,SING,C4,C5,no,N,9,,130360,25526,RIO
10,,SING,C4,C9,no,N,10,,130360,25526,RIO
11,,SING,C5,O4,no,N,11,,130360,25526,RIO
12,,SING,C5,C6,no,N,12,,130360,25526,RIO
13,,SING,C6,N1,no,N,13,,130360,25526,RIO
14,,SING,C6,C7,no,N,14,,130360,25526,RIO
15,,SING,C7,C8,no,N,15,,130360,25526,RIO
16,,SING,C8,N2,no,N,16,,130360,25526,RIO
17,,SING,C8,C9,no,N,17,,130360,25526,RIO
18,,SING,C9,O5,no,N,18,,130360,25526,RIO
19,,SING,O5,C10,no,N,19,,130360,25526,RIO
20,,SING,C10,O6,no,N,20,,130360,25526,RIO
21,,SING,C10,C15,no,N,21,,130360,25526,RIO
22,,SING,O6,C11,no,N,22,,130360,25526,RIO
23,,SING,C11,C12,no,N,23,,130360,25526,RIO
24,,SING,C11,C13,no,N,24,,130360,25526,RIO
25,,SING,C12,N3,no,N,25,,130360,25526,RIO
26,,SING,C13,O7,no,N,26,,130360,25526,RIO
27,,SING,C13,C14,no,N,27,,130360,25526,RIO
28,,SING,C14,O8,no,N,28,,130360,25526,RIO
29,,SING,C14,C15,no,N,29,,130360,25526,RIO
30,,SING,C15,N4,no,N,30,,130360,25526,RIO
31,,SING,C16,O9,no,N,31,,130360,25526,RIO
32,,SING,C16,C17,no,N,32,,130360,25526,RIO
33,,SING,C17,O10,no,N,33,,130360,25526,RIO
34,,SING,O1,HO1,no,N,34,,130360,25526,RIO
35,,SING,C1,H1,no,N,35,,130360,25526,RIO
36,,SING,C1,H1A,no,N,36,,130360,25526,RIO
37,,SING,C2,H2,no,N,37,,130360,25526,RIO
38,,SING,C3,H3,no,N,38,,130360,25526,RIO
39,,SING,C4,H4,no,N,39,,130360,25526,RIO
40,,SING,C5,H5,no,N,40,,130360,25526,RIO
41,,SING,O4,HO4,no,N,41,,130360,25526,RIO
42,,SING,C6,H6,no,N,42,,130360,25526,RIO
43,,SING,N1,HN1,no,N,43,,130360,25526,RIO
44,,SING,N1,HN1A,no,N,44,,130360,25526,RIO
45,,SING,C7,H7,no,N,45,,130360,25526,RIO
46,,SING,C7,H7A,no,N,46,,130360,25526,RIO
47,,SING,C8,H8,no,N,47,,130360,25526,RIO
48,,SING,N2,HN2,no,N,48,,130360,25526,RIO
49,,SING,N2,HN2A,no,N,49,,130360,25526,RIO
50,,SING,C9,H9,no,N,50,,130360,25526,RIO
51,,SING,C10,H10,no,N,51,,130360,25526,RIO
52,,SING,C11,H11,no,N,52,,130360,25526,RIO
53,,SING,C12,H12,no,N,53,,130360,25526,RIO
54,,SING,C12,H12A,no,N,54,,130360,25526,RIO
55,,SING,N3,HN3,no,N,55,,130360,25526,RIO
56,,SING,N3,HN3A,no,N,56,,130360,25526,RIO
57,,SING,C13,H13,no,N,57,,130360,25526,RIO
58,,SING,O7,HO7,no,N,58,,130360,25526,RIO
59,,SING,C14,H14,no,N,59,,130360,25526,RIO
60,,SING,O8,HO8,no,N,60,,130360,25526,RIO
61,,SING,C15,H15,no,N,61,,130360,25526,RIO
62,,SING,N4,HN4,no,N,62,,130360,25526,RIO
63,,SING,N4,HN4A,no,N,63,,130360,25526,RIO
64,,SING,C16,H16,no,N,64,,130360,25526,RIO
65,,SING,O9,HO9,no,N,65,,130360,25526,RIO
66,,SING,C17,H17,no,N,66,,130360,25526,RIO
67,,SING,O10,HO10,no,N,67,,130360,25526,RIO
1,,SING,OP3,P,no,N,1,,130420,25528,8OG
2,,SING,OP3,HOP3,no,N,2,,130420,25528,8OG
3,,DOUB,P,OP1,no,N,3,,130420,25528,8OG
4,,SING,P,OP2,no,N,4,,130420,25528,8OG
5,,SING,P,O5',no,N,5,,130420,25528,8OG
6,,SING,OP2,HOP2,no,N,6,,130420,25528,8OG
7,,SING,O5',C5',no,N,7,,130420,25528,8OG
8,,SING,C5',C4',no,N,8,,130420,25528,8OG
9,,SING,C5',H5',no,N,9,,130420,25528,8OG
10,,SING,C5',H5'',no,N,10,,130420,25528,8OG
11,,SING,C4',O4',no,N,11,,130420,25528,8OG
12,,SING,C4',C3',no,N,12,,130420,25528,8OG
13,,SING,C4',H4',no,N,13,,130420,25528,8OG
14,,SING,O4',C1',no,N,14,,130420,25528,8OG
15,,SING,C3',O3',no,N,15,,130420,25528,8OG
16,,SING,C3',C2',no,N,16,,130420,25528,8OG
17,,SING,C3',H3',no,N,17,,130420,25528,8OG
18,,SING,O3',HO3',no,N,18,,130420,25528,8OG
19,,SING,C2',C1',no,N,19,,130420,25528,8OG
20,,SING,C2',H2',no,N,20,,130420,25528,8OG
21,,SING,C2',H2'',no,N,21,,130420,25528,8OG
22,,SING,C1',N9,no,N,22,,130420,25528,8OG
23,,SING,C1',H1',no,N,23,,130420,25528,8OG
24,,SING,N9,C8,no,N,24,,130420,25528,8OG
25,,SING,N9,C4,no,N,25,,130420,25528,8OG
26,,SING,C8,N7,no,N,26,,130420,25528,8OG
27,,DOUB,C8,O8,no,N,27,,130420,25528,8OG
28,,SING,N7,C5,no,N,28,,130420,25528,8OG
29,,SING,N7,H7,no,N,29,,130420,25528,8OG
30,,SING,C5,C6,no,N,30,,130420,25528,8OG
31,,DOUB,C5,C4,no,N,31,,130420,25528,8OG
5,,SING,CA,C,,,,,240395,6146,ABA_2
32,,DOUB,C6,O6,no,N,32,,130420,25528,8OG
33,,SING,C6,N1,no,N,33,,130420,25528,8OG
34,,SING,N1,C2,no,N,34,,130420,25528,8OG
35,,SING,N1,H1,no,N,35,,130420,25528,8OG
36,,SING,C2,N2,no,N,36,,130420,25528,8OG
37,,DOUB,C2,N3,no,N,37,,130420,25528,8OG
38,,SING,N2,H21,no,N,38,,130420,25528,8OG
39,,SING,N2,H22,no,N,39,,130420,25528,8OG
40,,SING,N3,C4,no,N,40,,130420,25528,8OG
1,,SING,N14,C14,no,N,1,,130478,25531,IQG
2,,DOUB,C14,N15,yes,N,2,,130478,25531,IQG
3,,SING,C14,N13,yes,N,3,,130478,25531,IQG
4,,SING,C13,N13,no,N,4,,130478,25531,IQG
5,,SING,O3',C3',no,N,5,,130478,25531,IQG
6,,SING,N15,C16,yes,N,6,,130478,25531,IQG
7,,DOUB,OP1,P,no,N,7,,130478,25531,IQG
8,,SING,N13,C12,yes,N,8,,130478,25531,IQG
9,,SING,C3',C4',no,N,9,,130478,25531,IQG
10,,SING,C3',C2',no,N,10,,130478,25531,IQG
11,,SING,C5',C4',no,N,11,,130478,25531,IQG
12,,SING,C5',O5',no,N,12,,130478,25531,IQG
13,,SING,C4',O4',no,N,13,,130478,25531,IQG
14,,SING,O5',P,no,N,14,,130478,25531,IQG
15,,SING,C16,C12,yes,N,15,,130478,25531,IQG
16,,DOUB,C16,C17,yes,N,16,,130478,25531,IQG
17,,SING,P,OP2,no,N,17,,130478,25531,IQG
18,,DOUB,C12,C11,yes,N,18,,130478,25531,IQG
19,,SING,C2',C1',no,N,19,,130478,25531,IQG
20,,SING,C18,C17,yes,N,20,,130478,25531,IQG
21,,DOUB,C18,C19,yes,N,21,,130478,25531,IQG
22,,SING,O4',C1',no,N,22,,130478,25531,IQG
23,,SING,C17,C22,yes,N,23,,130478,25531,IQG
24,,SING,C11,C23,yes,N,24,,130478,25531,IQG
25,,SING,C1',N9,no,N,25,,130478,25531,IQG
26,,SING,C19,C20,yes,N,26,,130478,25531,IQG
27,,DOUB,C22,C23,yes,N,27,,130478,25531,IQG
28,,SING,C22,N21,yes,N,28,,130478,25531,IQG
29,,SING,C23,N2,no,N,29,,130478,25531,IQG
30,,SING,N9,C4,yes,N,30,,130478,25531,IQG
31,,SING,N9,C8,yes,N,31,,130478,25531,IQG
32,,SING,N3,C4,no,N,32,,130478,25531,IQG
33,,DOUB,N3,C2,no,N,33,,130478,25531,IQG
34,,DOUB,C20,N21,yes,N,34,,130478,25531,IQG
35,,DOUB,C4,C5,yes,N,35,,130478,25531,IQG
36,,SING,N2,C2,no,N,36,,130478,25531,IQG
37,,DOUB,C8,N7,yes,N,37,,130478,25531,IQG
38,,SING,C2,N1,no,N,38,,130478,25531,IQG
39,,SING,C5,N7,yes,N,39,,130478,25531,IQG
40,,SING,C5,C6,no,N,40,,130478,25531,IQG
41,,SING,N1,C6,no,N,41,,130478,25531,IQG
42,,DOUB,C6,O6,no,N,42,,130478,25531,IQG
43,,SING,OP2,HO2',no,N,43,,130478,25531,IQG
44,,SING,C5',H5'2,no,N,44,,130478,25531,IQG
45,,SING,C5',H5'1,no,N,45,,130478,25531,IQG
46,,SING,C4',H4',no,N,46,,130478,25531,IQG
47,,SING,C1',H1',no,N,47,,130478,25531,IQG
48,,SING,C8,H8,no,N,48,,130478,25531,IQG
49,,SING,N1,H1,no,N,49,,130478,25531,IQG
50,,SING,N2,H2,no,N,50,,130478,25531,IQG
51,,SING,C20,H20,no,N,51,,130478,25531,IQG
52,,SING,C19,H19,no,N,52,,130478,25531,IQG
53,,SING,C18,H18,no,N,53,,130478,25531,IQG
54,,SING,N14,H14,no,N,54,,130478,25531,IQG
55,,SING,N14,H14',no,N,55,,130478,25531,IQG
56,,SING,C13,H13,no,N,56,,130478,25531,IQG
57,,SING,C13,H13',no,N,57,,130478,25531,IQG
58,,SING,C13,H12,no,N,58,,130478,25531,IQG
59,,SING,C11,H11,no,N,59,,130478,25531,IQG
60,,SING,C3',H3',no,N,60,,130478,25531,IQG
61,,SING,C2',H2'1,no,N,61,,130478,25531,IQG
62,,SING,C2',H2'2,no,N,62,,130478,25531,IQG
63,,SING,O3',H3,no,N,63,,130478,25531,IQG
64,,SING,P,OP3,no,N,64,,130478,25531,IQG
65,,SING,OP3,HO3',no,N,65,,130478,25531,IQG
1,,SING,C01,C02,no,N,1,,130561,25536,CM7
2,,SING,C02,C03,no,N,2,,130561,25536,CM7
3,,DOUB,C03,C04,yes,N,3,,130561,25536,CM7
4,,SING,C03,C17,yes,N,4,,130561,25536,CM7
5,,SING,C04,N05,yes,N,5,,130561,25536,CM7
6,,SING,N05,C06,no,N,6,,130561,25536,CM7
7,,SING,N05,C18,yes,N,7,,130561,25536,CM7
8,,SING,C06,C07,no,N,8,,130561,25536,CM7
9,,SING,C07,S08,no,N,9,,130561,25536,CM7
10,,DOUB,S08,O09,no,N,10,,130561,25536,CM7
11,,DOUB,S08,O10,no,N,11,,130561,25536,CM7
12,,SING,S08,N11,no,N,12,,130561,25536,CM7
13,,SING,N11,C12,no,N,13,,130561,25536,CM7
14,,SING,N11,C13,no,N,14,,130561,25536,CM7
15,,SING,C13,C14,yes,N,15,,130561,25536,CM7
16,,DOUB,C13,C18,yes,N,16,,130561,25536,CM7
17,,DOUB,C14,C15,yes,N,17,,130561,25536,CM7
18,,SING,C15,C16,yes,N,18,,130561,25536,CM7
19,,SING,C15,C19,no,N,19,,130561,25536,CM7
20,,DOUB,C16,C17,yes,N,20,,130561,25536,CM7
21,,SING,C17,C18,yes,N,21,,130561,25536,CM7
22,,DOUB,C19,O20,no,N,22,,130561,25536,CM7
23,,SING,C19,N21,no,N,23,,130561,25536,CM7
24,,SING,N21,C22,no,N,24,,130561,25536,CM7
25,,SING,C22,C23,no,N,25,,130561,25536,CM7
26,,SING,C22,C30,no,N,26,,130561,25536,CM7
27,,SING,C23,C24,no,N,27,,130561,25536,CM7
6,,SING,CB,HB2,,,,,240395,6146,ABA_2
28,,SING,C24,C25,yes,N,28,,130561,25536,CM7
29,,DOUB,C24,C29,yes,N,29,,130561,25536,CM7
30,,DOUB,C25,C26,yes,N,30,,130561,25536,CM7
31,,SING,C26,C27,yes,N,31,,130561,25536,CM7
32,,DOUB,C27,C28,yes,N,32,,130561,25536,CM7
33,,SING,C28,C29,yes,N,33,,130561,25536,CM7
34,,SING,C30,O31,no,N,34,,130561,25536,CM7
35,,SING,C30,C32,no,N,35,,130561,25536,CM7
36,,SING,C32,N33,no,N,36,,130561,25536,CM7
37,,SING,N33,C34,no,N,37,,130561,25536,CM7
38,,SING,C34,C35,no,N,38,,130561,25536,CM7
39,,SING,C35,C36,yes,N,39,,130561,25536,CM7
40,,DOUB,C35,C40,yes,N,40,,130561,25536,CM7
41,,DOUB,C36,C37,yes,N,41,,130561,25536,CM7
42,,SING,C37,C38,yes,N,42,,130561,25536,CM7
43,,DOUB,C38,C39,yes,N,43,,130561,25536,CM7
44,,SING,C39,C40,yes,N,44,,130561,25536,CM7
45,,SING,C39,C41,no,N,45,,130561,25536,CM7
46,,SING,C41,F42,no,N,46,,130561,25536,CM7
47,,SING,C41,F43,no,N,47,,130561,25536,CM7
48,,SING,C41,F44,no,N,48,,130561,25536,CM7
49,,SING,C01,H011,no,N,49,,130561,25536,CM7
50,,SING,C01,H012,no,N,50,,130561,25536,CM7
51,,SING,C01,H013,no,N,51,,130561,25536,CM7
52,,SING,C02,H021,no,N,52,,130561,25536,CM7
53,,SING,C02,H022,no,N,53,,130561,25536,CM7
54,,SING,C04,H04,no,N,54,,130561,25536,CM7
55,,SING,C06,H061,no,N,55,,130561,25536,CM7
56,,SING,C06,H062,no,N,56,,130561,25536,CM7
57,,SING,C07,H071,no,N,57,,130561,25536,CM7
58,,SING,C07,H072,no,N,58,,130561,25536,CM7
59,,SING,C12,H121,no,N,59,,130561,25536,CM7
60,,SING,C12,H122,no,N,60,,130561,25536,CM7
61,,SING,C12,H123,no,N,61,,130561,25536,CM7
62,,SING,C14,H14,no,N,62,,130561,25536,CM7
63,,SING,C16,H16,no,N,63,,130561,25536,CM7
64,,SING,N21,H21,no,N,64,,130561,25536,CM7
65,,SING,C22,H22,no,N,65,,130561,25536,CM7
66,,SING,C23,H231,no,N,66,,130561,25536,CM7
67,,SING,C23,H232,no,N,67,,130561,25536,CM7
68,,SING,C30,H30,no,N,68,,130561,25536,CM7
69,,SING,C25,H25,no,N,69,,130561,25536,CM7
70,,SING,C29,H29,no,N,70,,130561,25536,CM7
71,,SING,C26,H26,no,N,71,,130561,25536,CM7
72,,SING,C27,H27,no,N,72,,130561,25536,CM7
73,,SING,C28,H28,no,N,73,,130561,25536,CM7
74,,SING,O31,H31,no,N,74,,130561,25536,CM7
75,,SING,C32,H321,no,N,75,,130561,25536,CM7
76,,SING,C32,H322,no,N,76,,130561,25536,CM7
77,,SING,N33,H33,no,N,77,,130561,25536,CM7
78,,SING,C34,H341,no,N,78,,130561,25536,CM7
79,,SING,C34,H342,no,N,79,,130561,25536,CM7
80,,SING,C36,H36,no,N,80,,130561,25536,CM7
81,,SING,C40,H40,no,N,81,,130561,25536,CM7
82,,SING,C37,H37,no,N,82,,130561,25536,CM7
83,,SING,C38,H38,no,N,83,,130561,25536,CM7
1,,SING,N,HN1,no,N,1,,130579,25537,NH2
2,,SING,N,HN2,no,N,2,,130579,25537,NH2
1,,DOUB,N,C6,no,N,1,,130597,25538,48L
2,,SING,N,C7,no,N,2,,130597,25538,48L
3,,DOUB,CG1,CD1,yes,N,3,,130597,25538,48L
4,,SING,CG1,CD2,yes,N,4,,130597,25538,48L
5,,SING,CG1,C8,no,N,5,,130597,25538,48L
6,,DOUB,CG2,CD3,yes,N,6,,130597,25538,48L
7,,SING,CG2,CD4,yes,N,7,,130597,25538,48L
8,,SING,CG2,C7,no,N,8,,130597,25538,48L
9,,DOUB,CG3,CD5,yes,N,9,,130597,25538,48L
10,,SING,CG3,CD6,yes,N,10,,130597,25538,48L
11,,SING,CG3,C6,no,N,11,,130597,25538,48L
12,,SING,CD1,CE1,yes,N,12,,130597,25538,48L
13,,DOUB,CD2,CE2,yes,N,13,,130597,25538,48L
14,,SING,CD3,CE4,yes,N,14,,130597,25538,48L
15,,DOUB,CD4,CE3,yes,N,15,,130597,25538,48L
16,,SING,CD4,F,no,N,16,,130597,25538,48L
17,,SING,CD5,CE5,yes,N,17,,130597,25538,48L
18,,DOUB,CD6,CE6,yes,N,18,,130597,25538,48L
19,,SING,CD6,O6,no,N,19,,130597,25538,48L
20,,DOUB,CE1,CZ1,yes,N,20,,130597,25538,48L
21,,SING,CE2,CZ1,yes,N,21,,130597,25538,48L
22,,SING,CE3,CZ2,yes,N,22,,130597,25538,48L
23,,DOUB,CE4,CZ2,yes,N,23,,130597,25538,48L
24,,DOUB,CE5,CZ3,yes,N,24,,130597,25538,48L
25,,SING,CE6,CZ3,yes,N,25,,130597,25538,48L
26,,SING,CZ3,O3,no,N,26,,130597,25538,48L
27,,SING,CM1,O3,no,N,27,,130597,25538,48L
28,,SING,CM2,C9,no,N,28,,130597,25538,48L
29,,SING,CM3,C9,no,N,29,,130597,25538,48L
30,,SING,C1,N1,no,N,30,,130597,25538,48L
31,,DOUB,C1,O1,no,N,31,,130597,25538,48L
32,,SING,C1,C4,no,N,32,,130597,25538,48L
33,,SING,N1,C2,no,N,33,,130597,25538,48L
34,,SING,C2,C3,no,N,34,,130597,25538,48L
35,,SING,N2,C3,no,N,35,,130597,25538,48L
36,,SING,N2,C4,no,N,36,,130597,25538,48L
37,,SING,N2,C5,no,N,37,,130597,25538,48L
38,,SING,N3,C5,no,N,38,,130597,25538,48L
39,,SING,N3,C6,no,N,39,,130597,25538,48L
40,,SING,N3,C8,no,N,40,,130597,25538,48L
41,,DOUB,C5,O5,no,N,41,,130597,25538,48L
42,,SING,O6,C9,no,N,42,,130597,25538,48L
43,,SING,C7,C8,no,N,43,,130597,25538,48L
44,,SING,CZ1,CL,no,N,44,,130597,25538,48L
45,,SING,CE4,BR,no,N,45,,130597,25538,48L
46,,SING,CD1,HD1,no,N,46,,130597,25538,48L
47,,SING,CD2,HD2,no,N,47,,130597,25538,48L
48,,SING,CD3,HD3,no,N,48,,130597,25538,48L
49,,SING,CD5,HD5,no,N,49,,130597,25538,48L
50,,SING,CE1,HE1,no,N,50,,130597,25538,48L
51,,SING,CE2,HE2,no,N,51,,130597,25538,48L
52,,SING,CE3,HE3,no,N,52,,130597,25538,48L
53,,SING,CE5,HE5,no,N,53,,130597,25538,48L
54,,SING,CE6,HE6,no,N,54,,130597,25538,48L
55,,SING,CZ2,HZ2,no,N,55,,130597,25538,48L
56,,SING,CM1,HM11,no,N,56,,130597,25538,48L
57,,SING,CM1,HM12,no,N,57,,130597,25538,48L
58,,SING,CM1,HM13,no,N,58,,130597,25538,48L
59,,SING,CM2,HM21,no,N,59,,130597,25538,48L
60,,SING,CM2,HM22,no,N,60,,130597,25538,48L
61,,SING,CM2,HM23,no,N,61,,130597,25538,48L
62,,SING,CM3,HM31,no,N,62,,130597,25538,48L
63,,SING,CM3,HM32,no,N,63,,130597,25538,48L
64,,SING,CM3,HM33,no,N,64,,130597,25538,48L
65,,SING,N1,HN1,no,N,65,,130597,25538,48L
66,,SING,C2,H21,no,N,66,,130597,25538,48L
67,,SING,C2,H22,no,N,67,,130597,25538,48L
68,,SING,C3,H31,no,N,68,,130597,25538,48L
69,,SING,C3,H32,no,N,69,,130597,25538,48L
70,,SING,C4,H41,no,N,70,,130597,25538,48L
71,,SING,C4,H42,no,N,71,,130597,25538,48L
72,,SING,C7,H7,no,N,72,,130597,25538,48L
73,,SING,C8,H8,no,N,73,,130597,25538,48L
74,,SING,C9,H9,no,N,74,,130597,25538,48L
1,,SING,C7,C8,no,N,1,,130743,25546,CM5
2,,SING,C7,C6,no,N,2,,130743,25546,CM5
3,,SING,C7,H71,no,N,3,,130743,25546,CM5
4,,SING,C7,H72,no,N,4,,130743,25546,CM5
5,,SING,C8,C9,no,N,5,,130743,25546,CM5
6,,SING,C8,H81,no,N,6,,130743,25546,CM5
7,,SING,C8,H82,no,N,7,,130743,25546,CM5
8,,SING,C9,C10,no,N,8,,130743,25546,CM5
9,,SING,C9,H91,no,N,9,,130743,25546,CM5
10,,SING,C9,H92,no,N,10,,130743,25546,CM5
11,,SING,C10,C11,no,N,11,,130743,25546,CM5
12,,SING,C10,H101,no,N,12,,130743,25546,CM5
13,,SING,C10,H102,no,N,13,,130743,25546,CM5
14,,SING,C11,C6,no,N,14,,130743,25546,CM5
15,,SING,C11,H111,no,N,15,,130743,25546,CM5
16,,SING,C11,H112,no,N,16,,130743,25546,CM5
17,,SING,C6,C5,no,N,17,,130743,25546,CM5
18,,SING,C6,H6,no,N,18,,130743,25546,CM5
19,,SING,C5,C4,no,N,19,,130743,25546,CM5
20,,SING,C5,H51,no,N,20,,130743,25546,CM5
21,,SING,C5,H52,no,N,21,,130743,25546,CM5
22,,SING,C4,C3,no,N,22,,130743,25546,CM5
23,,SING,C4,H41,no,N,23,,130743,25546,CM5
24,,SING,C4,H42,no,N,24,,130743,25546,CM5
25,,SING,C3,C2,no,N,25,,130743,25546,CM5
26,,SING,C3,H31A,no,N,26,,130743,25546,CM5
27,,SING,C3,H32A,no,N,27,,130743,25546,CM5
28,,SING,C2,C1,no,N,28,,130743,25546,CM5
29,,SING,C2,H21A,no,N,29,,130743,25546,CM5
30,,SING,C2,H22A,no,N,30,,130743,25546,CM5
31,,SING,C1,O12,no,N,31,,130743,25546,CM5
32,,SING,C1,H11,no,N,32,,130743,25546,CM5
33,,SING,C1,H12,no,N,33,,130743,25546,CM5
34,,SING,O12,C13,no,N,34,,130743,25546,CM5
35,,SING,C13,C18,no,N,35,,130743,25546,CM5
36,,SING,C13,O14,no,N,36,,130743,25546,CM5
37,,SING,C13,H13,no,N,37,,130743,25546,CM5
38,,SING,C18,O22,no,N,38,,130743,25546,CM5
39,,SING,C18,C17,no,N,39,,130743,25546,CM5
40,,SING,C18,H18,no,N,40,,130743,25546,CM5
41,,SING,O22,H22,no,N,41,,130743,25546,CM5
42,,SING,C17,O21,no,N,42,,130743,25546,CM5
43,,SING,C17,C16,no,N,43,,130743,25546,CM5
44,,SING,C17,H17,no,N,44,,130743,25546,CM5
45,,SING,O21,H21,no,N,45,,130743,25546,CM5
46,,SING,O14,C15,no,N,46,,130743,25546,CM5
47,,SING,C15,C19,no,N,47,,130743,25546,CM5
48,,SING,C15,C16,no,N,48,,130743,25546,CM5
49,,SING,C15,H15,no,N,49,,130743,25546,CM5
50,,SING,C19,O20,no,N,50,,130743,25546,CM5
51,,SING,C19,H191,no,N,51,,130743,25546,CM5
52,,SING,C19,H192,no,N,52,,130743,25546,CM5
53,,SING,O20,H20,no,N,53,,130743,25546,CM5
54,,SING,C16,O23,no,N,54,,130743,25546,CM5
55,,SING,C16,H16,no,N,55,,130743,25546,CM5
56,,SING,O23,C24,no,N,56,,130743,25546,CM5
57,,SING,C24,O25,no,N,57,,130743,25546,CM5
58,,SING,C24,C29,no,N,58,,130743,25546,CM5
59,,SING,C24,H24,no,N,59,,130743,25546,CM5
60,,SING,O25,C26,no,N,60,,130743,25546,CM5
61,,SING,C26,C30,no,N,61,,130743,25546,CM5
62,,SING,C26,C27,no,N,62,,130743,25546,CM5
63,,SING,C26,H26,no,N,63,,130743,25546,CM5
64,,SING,C30,O31,no,N,64,,130743,25546,CM5
65,,SING,C30,H301,no,N,65,,130743,25546,CM5
66,,SING,C30,H302,no,N,66,,130743,25546,CM5
67,,SING,O31,H31,no,N,67,,130743,25546,CM5
68,,SING,C27,O32,no,N,68,,130743,25546,CM5
69,,SING,C27,C28,no,N,69,,130743,25546,CM5
70,,SING,C27,H27,no,N,70,,130743,25546,CM5
71,,SING,O32,H32,no,N,71,,130743,25546,CM5
72,,SING,C28,O33,no,N,72,,130743,25546,CM5
73,,SING,C28,C29,no,N,73,,130743,25546,CM5
74,,SING,C28,H28,no,N,74,,130743,25546,CM5
75,,SING,O33,H33,no,N,75,,130743,25546,CM5
76,,SING,C29,O34,no,N,76,,130743,25546,CM5
77,,SING,C29,H29,no,N,77,,130743,25546,CM5
78,,SING,O34,H34,no,N,78,,130743,25546,CM5
1,,SING,CHA,C1A,yes,N,1,,130795,25551,HEM
2,,DOUB,CHA,C4D,yes,N,2,,130795,25551,HEM
3,,SING,CHA,HHA,no,N,3,,130795,25551,HEM
4,,SING,CHB,C4A,yes,N,4,,130795,25551,HEM
5,,DOUB,CHB,C1B,yes,N,5,,130795,25551,HEM
6,,SING,CHB,HHB,no,N,6,,130795,25551,HEM
7,,SING,CHC,C4B,yes,N,7,,130795,25551,HEM
8,,DOUB,CHC,C1C,yes,N,8,,130795,25551,HEM
9,,SING,CHC,HHC,no,N,9,,130795,25551,HEM
10,,DOUB,CHD,C4C,yes,N,10,,130795,25551,HEM
11,,SING,CHD,C1D,yes,N,11,,130795,25551,HEM
12,,SING,CHD,HHD,no,N,12,,130795,25551,HEM
13,,DOUB,C1A,C2A,yes,N,13,,130795,25551,HEM
14,,SING,C1A,NA,yes,N,14,,130795,25551,HEM
15,,SING,C2A,C3A,yes,N,15,,130795,25551,HEM
16,,SING,C2A,CAA,no,N,16,,130795,25551,HEM
17,,DOUB,C3A,C4A,yes,N,17,,130795,25551,HEM
18,,SING,C3A,CMA,no,N,18,,130795,25551,HEM
19,,SING,C4A,NA,yes,N,19,,130795,25551,HEM
20,,SING,CMA,HMA,no,N,20,,130795,25551,HEM
21,,SING,CMA,HMAA,no,N,21,,130795,25551,HEM
22,,SING,CMA,HMAB,no,N,22,,130795,25551,HEM
23,,SING,CAA,CBA,no,N,23,,130795,25551,HEM
24,,SING,CAA,HAA,no,N,24,,130795,25551,HEM
25,,SING,CAA,HAAA,no,N,25,,130795,25551,HEM
26,,SING,CBA,CGA,no,N,26,,130795,25551,HEM
27,,SING,CBA,HBA,no,N,27,,130795,25551,HEM
28,,SING,CBA,HBAA,no,N,28,,130795,25551,HEM
29,,DOUB,CGA,O1A,no,N,29,,130795,25551,HEM
30,,SING,CGA,O2A,no,N,30,,130795,25551,HEM
31,,SING,C1B,C2B,no,N,31,,130795,25551,HEM
32,,SING,C1B,NB,yes,N,32,,130795,25551,HEM
33,,DOUB,C2B,C3B,yes,N,33,,130795,25551,HEM
34,,SING,C2B,CMB,yes,N,34,,130795,25551,HEM
35,,SING,C3B,C4B,no,N,35,,130795,25551,HEM
36,,SING,C3B,CAB,yes,N,36,,130795,25551,HEM
37,,DOUB,C4B,NB,no,N,37,,130795,25551,HEM
38,,SING,CMB,HMB,yes,N,38,,130795,25551,HEM
39,,SING,CMB,HMBA,no,N,39,,130795,25551,HEM
40,,SING,CMB,HMBB,no,N,40,,130795,25551,HEM
41,,DOUB,CAB,CBB,no,N,41,,130795,25551,HEM
42,,SING,CAB,HAB,no,N,42,,130795,25551,HEM
43,,SING,CBB,HBB,no,N,43,,130795,25551,HEM
44,,SING,CBB,HBBA,no,N,44,,130795,25551,HEM
45,,SING,C1C,C2C,no,N,45,,130795,25551,HEM
46,,SING,C1C,NC,yes,N,46,,130795,25551,HEM
47,,DOUB,C2C,C3C,yes,N,47,,130795,25551,HEM
48,,SING,C2C,CMC,yes,N,48,,130795,25551,HEM
49,,SING,C3C,C4C,no,N,49,,130795,25551,HEM
50,,SING,C3C,CAC,yes,N,50,,130795,25551,HEM
51,,SING,C4C,NC,no,N,51,,130795,25551,HEM
52,,SING,CMC,HMC,yes,N,52,,130795,25551,HEM
53,,SING,CMC,HMCA,no,N,53,,130795,25551,HEM
54,,SING,CMC,HMCB,no,N,54,,130795,25551,HEM
55,,DOUB,CAC,CBC,no,N,55,,130795,25551,HEM
56,,SING,CAC,HAC,no,N,56,,130795,25551,HEM
57,,SING,CBC,HBC,no,N,57,,130795,25551,HEM
58,,SING,CBC,HBCA,no,N,58,,130795,25551,HEM
59,,SING,C1D,C2D,no,N,59,,130795,25551,HEM
60,,DOUB,C1D,ND,yes,N,60,,130795,25551,HEM
61,,DOUB,C2D,C3D,yes,N,61,,130795,25551,HEM
62,,SING,C2D,CMD,yes,N,62,,130795,25551,HEM
63,,SING,C3D,C4D,no,N,63,,130795,25551,HEM
64,,SING,C3D,CAD,yes,N,64,,130795,25551,HEM
65,,SING,C4D,ND,no,N,65,,130795,25551,HEM
66,,SING,CMD,HMD,yes,N,66,,130795,25551,HEM
67,,SING,CMD,HMDA,no,N,67,,130795,25551,HEM
68,,SING,CMD,HMDB,no,N,68,,130795,25551,HEM
69,,SING,CAD,CBD,no,N,69,,130795,25551,HEM
70,,SING,CAD,HAD,no,N,70,,130795,25551,HEM
71,,SING,CAD,HADA,no,N,71,,130795,25551,HEM
72,,SING,CBD,CGD,no,N,72,,130795,25551,HEM
73,,SING,CBD,HBD,no,N,73,,130795,25551,HEM
74,,SING,CBD,HBDA,no,N,74,,130795,25551,HEM
75,,DOUB,CGD,O1D,no,N,75,,130795,25551,HEM
76,,SING,CGD,O2D,no,N,76,,130795,25551,HEM
77,,SING,O2A,H2A,no,N,77,,130795,25551,HEM
78,,SING,O2D,H2D,no,N,78,,130795,25551,HEM
79,,SING,FE,NA,no,N,79,,130795,25551,HEM
80,,SING,FE,NB,no,N,80,,130795,25551,HEM
81,,SING,FE,NC,no,N,81,,130795,25551,HEM
82,,SING,FE,ND,no,N,82,,130795,25551,HEM
1,,SING,FE,NA,no,N,1,,130796,25551,HEC
2,,SING,FE,NB,no,N,2,,130796,25551,HEC
3,,SING,FE,NC,no,N,3,,130796,25551,HEC
4,,SING,FE,ND,no,N,4,,130796,25551,HEC
5,,DOUB,CHA,C1A,no,N,5,,130796,25551,HEC
6,,SING,CHA,C4D,no,N,6,,130796,25551,HEC
7,,SING,CHA,HHA,no,N,7,,130796,25551,HEC
8,,DOUB,CHB,C4A,no,N,8,,130796,25551,HEC
9,,SING,CHB,C1B,no,N,9,,130796,25551,HEC
10,,SING,CHB,HHB,no,N,10,,130796,25551,HEC
11,,DOUB,CHC,C4B,no,N,11,,130796,25551,HEC
12,,SING,CHC,C1C,no,N,12,,130796,25551,HEC
13,,SING,CHC,HHC,no,N,13,,130796,25551,HEC
14,,DOUB,CHD,C4C,no,N,14,,130796,25551,HEC
15,,SING,CHD,C1D,no,N,15,,130796,25551,HEC
16,,SING,CHD,HHD,no,N,16,,130796,25551,HEC
17,,SING,NA,C1A,yes,N,17,,130796,25551,HEC
18,,SING,NA,C4A,yes,N,18,,130796,25551,HEC
19,,SING,C1A,C2A,yes,N,19,,130796,25551,HEC
20,,DOUB,C2A,C3A,yes,N,20,,130796,25551,HEC
21,,SING,C2A,CAA,no,N,21,,130796,25551,HEC
22,,SING,C3A,C4A,yes,N,22,,130796,25551,HEC
23,,SING,C3A,CMA,no,N,23,,130796,25551,HEC
24,,SING,CMA,HMA1,no,N,24,,130796,25551,HEC
25,,SING,CMA,HMA2,no,N,25,,130796,25551,HEC
26,,SING,CMA,HMA3,no,N,26,,130796,25551,HEC
27,,SING,CAA,CBA,no,N,27,,130796,25551,HEC
28,,SING,CAA,HAA1,no,N,28,,130796,25551,HEC
29,,SING,CAA,HAA2,no,N,29,,130796,25551,HEC
30,,SING,CBA,CGA,no,N,30,,130796,25551,HEC
31,,SING,CBA,HBA1,no,N,31,,130796,25551,HEC
32,,SING,CBA,HBA2,no,N,32,,130796,25551,HEC
33,,DOUB,CGA,O1A,no,N,33,,130796,25551,HEC
34,,SING,CGA,O2A,no,N,34,,130796,25551,HEC
35,,SING,O2A,H2A,no,N,35,,130796,25551,HEC
36,,SING,NB,C1B,yes,N,36,,130796,25551,HEC
37,,SING,NB,C4B,yes,N,37,,130796,25551,HEC
38,,DOUB,C1B,C2B,yes,N,38,,130796,25551,HEC
39,,SING,C2B,C3B,yes,N,39,,130796,25551,HEC
40,,SING,C2B,CMB,no,N,40,,130796,25551,HEC
41,,SING,C3B,C4B,yes,N,41,,130796,25551,HEC
42,,DOUB,C3B,CAB,no,E,42,,130796,25551,HEC
43,,SING,CMB,HMB1,no,N,43,,130796,25551,HEC
44,,SING,CMB,HMB2,no,N,44,,130796,25551,HEC
45,,SING,CMB,HMB3,no,N,45,,130796,25551,HEC
46,,SING,CAB,CBB,no,N,46,,130796,25551,HEC
47,,SING,CAB,HAB,no,N,47,,130796,25551,HEC
48,,SING,CBB,HBB1,no,N,48,,130796,25551,HEC
49,,SING,CBB,HBB2,no,N,49,,130796,25551,HEC
50,,SING,CBB,HBB3,no,N,50,,130796,25551,HEC
51,,SING,NC,C1C,yes,N,51,,130796,25551,HEC
52,,SING,NC,C4C,yes,N,52,,130796,25551,HEC
53,,DOUB,C1C,C2C,yes,N,53,,130796,25551,HEC
54,,SING,C2C,C3C,yes,N,54,,130796,25551,HEC
55,,SING,C2C,CMC,no,N,55,,130796,25551,HEC
56,,SING,C3C,C4C,yes,N,56,,130796,25551,HEC
57,,DOUB,C3C,CAC,no,E,57,,130796,25551,HEC
58,,SING,CMC,HMC1,no,N,58,,130796,25551,HEC
59,,SING,CMC,HMC2,no,N,59,,130796,25551,HEC
60,,SING,CMC,HMC3,no,N,60,,130796,25551,HEC
61,,SING,CAC,CBC,no,N,61,,130796,25551,HEC
62,,SING,CAC,HAC,no,N,62,,130796,25551,HEC
63,,SING,CBC,HBC1,no,N,63,,130796,25551,HEC
64,,SING,CBC,HBC2,no,N,64,,130796,25551,HEC
65,,SING,CBC,HBC3,no,N,65,,130796,25551,HEC
66,,SING,ND,C1D,yes,N,66,,130796,25551,HEC
67,,SING,ND,C4D,yes,N,67,,130796,25551,HEC
68,,DOUB,C1D,C2D,yes,N,68,,130796,25551,HEC
69,,SING,C2D,C3D,yes,N,69,,130796,25551,HEC
70,,SING,C2D,CMD,no,N,70,,130796,25551,HEC
71,,DOUB,C3D,C4D,yes,N,71,,130796,25551,HEC
72,,SING,C3D,CAD,no,N,72,,130796,25551,HEC
73,,SING,CMD,HMD1,no,N,73,,130796,25551,HEC
74,,SING,CMD,HMD2,no,N,74,,130796,25551,HEC
75,,SING,CMD,HMD3,no,N,75,,130796,25551,HEC
76,,SING,CAD,CBD,no,N,76,,130796,25551,HEC
77,,SING,CAD,HAD1,no,N,77,,130796,25551,HEC
78,,SING,CAD,HAD2,no,N,78,,130796,25551,HEC
79,,SING,CBD,CGD,no,N,79,,130796,25551,HEC
80,,SING,CBD,HBD1,no,N,80,,130796,25551,HEC
81,,SING,CBD,HBD2,no,N,81,,130796,25551,HEC
82,,DOUB,CGD,O1D,no,N,82,,130796,25551,HEC
83,,SING,CGD,O2D,no,N,83,,130796,25551,HEC
84,,SING,O2D,H2D,no,N,84,,130796,25551,HEC
1,,SING,N,CA,no,N,1,,130921,25558,DPR
2,,SING,N,CD,no,N,2,,130921,25558,DPR
3,,SING,N,H,no,N,3,,130921,25558,DPR
4,,SING,CA,CB,no,N,4,,130921,25558,DPR
5,,SING,CA,C,no,N,5,,130921,25558,DPR
6,,SING,CA,HA,no,N,6,,130921,25558,DPR
7,,SING,CB,CG,no,N,7,,130921,25558,DPR
8,,SING,CB,HB2,no,N,8,,130921,25558,DPR
9,,SING,CB,HB3,no,N,9,,130921,25558,DPR
10,,SING,CG,CD,no,N,10,,130921,25558,DPR
11,,SING,CG,HG2,no,N,11,,130921,25558,DPR
12,,SING,CG,HG3,no,N,12,,130921,25558,DPR
13,,SING,CD,HD2,no,N,13,,130921,25558,DPR
14,,SING,CD,HD3,no,N,14,,130921,25558,DPR
15,,DOUB,C,O,no,N,15,,130921,25558,DPR
16,,SING,C,OXT,no,N,16,,130921,25558,DPR
17,,SING,OXT,HXT,no,N,17,,130921,25558,DPR
1,,SING,N,CA,no,N,1,,131117,25569,SEP
2,,SING,N,H,no,N,2,,131117,25569,SEP
3,,SING,N,H2,no,N,3,,131117,25569,SEP
4,,SING,CA,CB,no,N,4,,131117,25569,SEP
5,,SING,CA,C,no,N,5,,131117,25569,SEP
6,,SING,CA,HA,no,N,6,,131117,25569,SEP
7,,SING,CB,OG,no,N,7,,131117,25569,SEP
8,,SING,CB,HB2,no,N,8,,131117,25569,SEP
9,,SING,CB,HB3,no,N,9,,131117,25569,SEP
10,,SING,OG,P,no,N,10,,131117,25569,SEP
11,,DOUB,C,O,no,N,11,,131117,25569,SEP
12,,SING,C,OXT,no,N,12,,131117,25569,SEP
13,,SING,OXT,HXT,no,N,13,,131117,25569,SEP
14,,DOUB,P,O1P,no,N,14,,131117,25569,SEP
15,,SING,P,O2P,no,N,15,,131117,25569,SEP
16,,SING,P,O3P,no,N,16,,131117,25569,SEP
17,,SING,O2P,HOP2,no,N,17,,131117,25569,SEP
18,,SING,O3P,HOP3,no,N,18,,131117,25569,SEP
1,,DOUB,C1,O1,no,N,1,,131205,25573,MYR
2,,SING,C1,O2,no,N,2,,131205,25573,MYR
3,,SING,C1,C2,no,N,3,,131205,25573,MYR
4,,SING,O2,HO2,no,N,4,,131205,25573,MYR
5,,SING,C2,C3,no,N,5,,131205,25573,MYR
6,,SING,C2,H21,no,N,6,,131205,25573,MYR
7,,SING,C2,H22,no,N,7,,131205,25573,MYR
8,,SING,C3,C4,no,N,8,,131205,25573,MYR
9,,SING,C3,H31,no,N,9,,131205,25573,MYR
10,,SING,C3,H32,no,N,10,,131205,25573,MYR
11,,SING,C4,C5,no,N,11,,131205,25573,MYR
12,,SING,C4,H41,no,N,12,,131205,25573,MYR
13,,SING,C4,H42,no,N,13,,131205,25573,MYR
14,,SING,C5,C6,no,N,14,,131205,25573,MYR
15,,SING,C5,H51,no,N,15,,131205,25573,MYR
16,,SING,C5,H52,no,N,16,,131205,25573,MYR
17,,SING,C6,C7,no,N,17,,131205,25573,MYR
18,,SING,C6,H61,no,N,18,,131205,25573,MYR
19,,SING,C6,H62,no,N,19,,131205,25573,MYR
20,,SING,C7,C8,no,N,20,,131205,25573,MYR
21,,SING,C7,H71,no,N,21,,131205,25573,MYR
22,,SING,C7,H72,no,N,22,,131205,25573,MYR
23,,SING,C8,C9,no,N,23,,131205,25573,MYR
24,,SING,C8,H81,no,N,24,,131205,25573,MYR
25,,SING,C8,H82,no,N,25,,131205,25573,MYR
26,,SING,C9,C10,no,N,26,,131205,25573,MYR
27,,SING,C9,H91,no,N,27,,131205,25573,MYR
28,,SING,C9,H92,no,N,28,,131205,25573,MYR
29,,SING,C10,C11,no,N,29,,131205,25573,MYR
30,,SING,C10,H101,no,N,30,,131205,25573,MYR
31,,SING,C10,H102,no,N,31,,131205,25573,MYR
32,,SING,C11,C12,no,N,32,,131205,25573,MYR
33,,SING,C11,H111,no,N,33,,131205,25573,MYR
34,,SING,C11,H112,no,N,34,,131205,25573,MYR
35,,SING,C12,C13,no,N,35,,131205,25573,MYR
36,,SING,C12,H121,no,N,36,,131205,25573,MYR
37,,SING,C12,H122,no,N,37,,131205,25573,MYR
38,,SING,C13,C14,no,N,38,,131205,25573,MYR
39,,SING,C13,H131,no,N,39,,131205,25573,MYR
40,,SING,C13,H132,no,N,40,,131205,25573,MYR
41,,SING,C14,H141,no,N,41,,131205,25573,MYR
42,,SING,C14,H142,no,N,42,,131205,25573,MYR
43,,SING,C14,H143,no,N,43,,131205,25573,MYR
1,,SING,N,CA,no,N,1,,131353,25585,PCA
2,,SING,N,CD,no,N,2,,131353,25585,PCA
3,,SING,N,H,no,N,3,,131353,25585,PCA
4,,SING,CA,CB,no,N,4,,131353,25585,PCA
5,,SING,CA,C,no,N,5,,131353,25585,PCA
6,,SING,CA,HA,no,N,6,,131353,25585,PCA
7,,SING,CB,CG,no,N,7,,131353,25585,PCA
8,,SING,CB,HB2,no,N,8,,131353,25585,PCA
9,,SING,CB,HB3,no,N,9,,131353,25585,PCA
10,,SING,CG,CD,no,N,10,,131353,25585,PCA
11,,SING,CG,HG2,no,N,11,,131353,25585,PCA
12,,SING,CG,HG3,no,N,12,,131353,25585,PCA
13,,DOUB,CD,OE,no,N,13,,131353,25585,PCA
14,,DOUB,C,O,no,N,14,,131353,25585,PCA
15,,SING,C,OXT,no,N,15,,131353,25585,PCA
16,,SING,OXT,HXT,no,N,16,,131353,25585,PCA
1,,SING,C40,C38,no,N,1,,131423,25588,4DY
2,,SING,C30,C33,no,N,2,,131423,25588,4DY
3,,SING,C30,C27,no,N,3,,131423,25588,4DY
4,,SING,C37,C38,no,N,4,,131423,25588,4DY
5,,DOUB,C37,C36,no,E,5,,131423,25588,4DY
6,,SING,C33,C36,no,N,6,,131423,25588,4DY
7,,SING,C38,C44,no,N,7,,131423,25588,4DY
8,,SING,C24,C27,no,N,8,,131423,25588,4DY
9,,SING,C24,C22,no,N,9,,131423,25588,4DY
10,,DOUB,C5,C6,yes,N,10,,131423,25588,4DY
11,,SING,C5,C4,yes,N,11,,131423,25588,4DY
12,,SING,C6,C1,yes,N,12,,131423,25588,4DY
13,,SING,N21,C22,no,N,13,,131423,25588,4DY
14,,SING,N21,C17,no,N,14,,131423,25588,4DY
15,,DOUB,C22,O23,no,N,15,,131423,25588,4DY
16,,SING,O10,C4,no,N,16,,131423,25588,4DY
17,,DOUB,C4,C3,yes,N,17,,131423,25588,4DY
18,,SING,C1,C17,no,N,18,,131423,25588,4DY
19,,DOUB,C1,C2,yes,N,19,,131423,25588,4DY
20,,SING,C3,C2,yes,N,20,,131423,25588,4DY
21,,SING,C3,O12,no,N,21,,131423,25588,4DY
22,,SING,O12,C13,no,N,22,,131423,25588,4DY
23,,SING,C2,H2,no,N,23,,131423,25588,4DY
24,,SING,C5,H5,no,N,24,,131423,25588,4DY
25,,SING,C40,H40,no,N,25,,131423,25588,4DY
26,,SING,C40,H6T,no,N,26,,131423,25588,4DY
27,,SING,C40,H6S,no,N,27,,131423,25588,4DY
28,,SING,C38,H38,no,N,28,,131423,25588,4DY
29,,SING,C44,H6U,no,N,29,,131423,25588,4DY
30,,SING,C44,H6V,no,N,30,,131423,25588,4DY
31,,SING,C44,H44,no,N,31,,131423,25588,4DY
32,,SING,C37,H37,no,N,32,,131423,25588,4DY
33,,SING,C36,H36,no,N,33,,131423,25588,4DY
34,,SING,C33,H33,no,N,34,,131423,25588,4DY
35,,SING,C33,H6R,no,N,35,,131423,25588,4DY
36,,SING,C30,H6Q,no,N,36,,131423,25588,4DY
37,,SING,C30,H30,no,N,37,,131423,25588,4DY
38,,SING,C27,H27,no,N,38,,131423,25588,4DY
39,,SING,C27,H6P,no,N,39,,131423,25588,4DY
40,,SING,C24,H6O,no,N,40,,131423,25588,4DY
41,,SING,C24,H24,no,N,41,,131423,25588,4DY
42,,SING,N21,H21,no,N,42,,131423,25588,4DY
43,,SING,C17,H6N,no,N,43,,131423,25588,4DY
44,,SING,C17,H17,no,N,44,,131423,25588,4DY
45,,SING,C6,H6,no,N,45,,131423,25588,4DY
46,,SING,O10,H10,no,N,46,,131423,25588,4DY
47,,SING,C13,H6M,no,N,47,,131423,25588,4DY
48,,SING,C13,H6L,no,N,48,,131423,25588,4DY
49,,SING,C13,H13,no,N,49,,131423,25588,4DY
1,,SING,N,C1,no,N,1,,131461,25591,ANI
2,,SING,N,HN1,no,N,2,,131461,25591,ANI
3,,SING,N,HN2,no,N,3,,131461,25591,ANI
4,,DOUB,C1,C2,yes,N,4,,131461,25591,ANI
5,,SING,C1,C6,yes,N,5,,131461,25591,ANI
6,,SING,C2,C3,yes,N,6,,131461,25591,ANI
7,,SING,C2,H2,no,N,7,,131461,25591,ANI
8,,DOUB,C3,C4,yes,N,8,,131461,25591,ANI
9,,SING,C3,H3,no,N,9,,131461,25591,ANI
10,,SING,C4,C5,yes,N,10,,131461,25591,ANI
11,,SING,C4,C7,no,N,11,,131461,25591,ANI
12,,DOUB,C5,C6,yes,N,12,,131461,25591,ANI
13,,SING,C5,H5,no,N,13,,131461,25591,ANI
14,,SING,C6,H6,no,N,14,,131461,25591,ANI
15,,SING,C7,F1,no,N,15,,131461,25591,ANI
16,,SING,C7,F2,no,N,16,,131461,25591,ANI
17,,SING,C7,F3,no,N,17,,131461,25591,ANI
1,,SING,N,C1,no,N,1,,131477,25592,ANI
2,,SING,N,HN1,no,N,2,,131477,25592,ANI
3,,SING,N,HN2,no,N,3,,131477,25592,ANI
4,,DOUB,C1,C2,yes,N,4,,131477,25592,ANI
5,,SING,C1,C6,yes,N,5,,131477,25592,ANI
6,,SING,C2,C3,yes,N,6,,131477,25592,ANI
7,,SING,C2,H2,no,N,7,,131477,25592,ANI
8,,DOUB,C3,C4,yes,N,8,,131477,25592,ANI
9,,SING,C3,H3,no,N,9,,131477,25592,ANI
10,,SING,C4,C5,yes,N,10,,131477,25592,ANI
11,,SING,C4,C7,no,N,11,,131477,25592,ANI
12,,DOUB,C5,C6,yes,N,12,,131477,25592,ANI
13,,SING,C5,H5,no,N,13,,131477,25592,ANI
14,,SING,C6,H6,no,N,14,,131477,25592,ANI
15,,SING,C7,F1,no,N,15,,131477,25592,ANI
16,,SING,C7,F2,no,N,16,,131477,25592,ANI
17,,SING,C7,F3,no,N,17,,131477,25592,ANI
1,,DOUB,P,OP1,no,N,1,,131527,25596,BGM
2,,SING,P,OP2,no,N,2,,131527,25596,BGM
3,,SING,P,O5',no,N,3,,131527,25596,BGM
4,,SING,P,OP3,no,N,4,,131527,25596,BGM
5,,SING,OP2,HOP2,no,N,5,,131527,25596,BGM
6,,SING,O5',C5',no,N,6,,131527,25596,BGM
7,,SING,C5',C4',no,N,7,,131527,25596,BGM
8,,SING,C5',H5',no,N,8,,131527,25596,BGM
9,,SING,C5',H5'',no,N,9,,131527,25596,BGM
10,,SING,C4',O4',no,N,10,,131527,25596,BGM
11,,SING,C4',C3',no,N,11,,131527,25596,BGM
12,,SING,C4',H4',no,N,12,,131527,25596,BGM
13,,SING,O4',C1',no,N,13,,131527,25596,BGM
14,,SING,C1',N9,no,N,14,,131527,25596,BGM
15,,SING,C1',C2',no,N,15,,131527,25596,BGM
16,,SING,C1',H1',no,N,16,,131527,25596,BGM
17,,SING,N9,C8,yes,N,17,,131527,25596,BGM
18,,SING,N9,C4,yes,N,18,,131527,25596,BGM
19,,DOUB,C8,N7,yes,N,19,,131527,25596,BGM
20,,SING,C8,BR,no,N,20,,131527,25596,BGM
21,,SING,N7,C5,yes,N,21,,131527,25596,BGM
22,,DOUB,C5,C4,yes,N,22,,131527,25596,BGM
23,,SING,C5,C6,no,N,23,,131527,25596,BGM
24,,SING,C4,N3,no,N,24,,131527,25596,BGM
25,,DOUB,N3,C2,no,N,25,,131527,25596,BGM
26,,SING,C2,N2,no,N,26,,131527,25596,BGM
27,,SING,C2,N1,no,N,27,,131527,25596,BGM
28,,SING,N2,H21,no,N,28,,131527,25596,BGM
29,,SING,N2,H22,no,N,29,,131527,25596,BGM
30,,SING,N1,C6,no,N,30,,131527,25596,BGM
31,,SING,N1,H1,no,N,31,,131527,25596,BGM
32,,DOUB,C6,O6,no,N,32,,131527,25596,BGM
33,,SING,C2',C3',no,N,33,,131527,25596,BGM
34,,SING,C2',H2',no,N,34,,131527,25596,BGM
35,,SING,C2',H2'',no,N,35,,131527,25596,BGM
36,,SING,C3',O3',no,N,36,,131527,25596,BGM
37,,SING,C3',H3',no,N,37,,131527,25596,BGM
38,,SING,O3',HO3',no,N,38,,131527,25596,BGM
39,,SING,OP3,HOP3,no,N,39,,131527,25596,BGM
1,,SING,O1,N1,no,N,1,,131629,25601,MTN
2,,SING,N1,C1,no,N,2,,131629,25601,MTN
3,,SING,N1,C5,no,N,3,,131629,25601,MTN
4,,SING,C1,C2,no,N,4,,131629,25601,MTN
5,,SING,C1,C8,no,N,5,,131629,25601,MTN
6,,SING,C1,C9,no,N,6,,131629,25601,MTN
7,,DOUB,C2,C3,no,N,7,,131629,25601,MTN
8,,SING,C2,H2,no,N,8,,131629,25601,MTN
9,,SING,C3,C4,no,N,9,,131629,25601,MTN
10,,SING,C3,C5,no,N,10,,131629,25601,MTN
11,,SING,C4,S1,no,N,11,,131629,25601,MTN
12,,SING,C4,H41,no,N,12,,131629,25601,MTN
13,,SING,C4,H42,no,N,13,,131629,25601,MTN
14,,SING,C5,C6,no,N,14,,131629,25601,MTN
15,,SING,C5,C7,no,N,15,,131629,25601,MTN
16,,SING,C6,H61,no,N,16,,131629,25601,MTN
17,,SING,C6,H62,no,N,17,,131629,25601,MTN
18,,SING,C6,H63,no,N,18,,131629,25601,MTN
19,,SING,C7,H71,no,N,19,,131629,25601,MTN
20,,SING,C7,H72,no,N,20,,131629,25601,MTN
21,,SING,C7,H73,no,N,21,,131629,25601,MTN
22,,SING,C8,H81,no,N,22,,131629,25601,MTN
23,,SING,C8,H82,no,N,23,,131629,25601,MTN
24,,SING,C8,H83,no,N,24,,131629,25601,MTN
25,,SING,C9,H91,no,N,25,,131629,25601,MTN
26,,SING,C9,H92,no,N,26,,131629,25601,MTN
27,,SING,C9,H93,no,N,27,,131629,25601,MTN
28,,SING,S1,S2,no,N,28,,131629,25601,MTN
29,,DOUB,S2,O2,no,N,29,,131629,25601,MTN
30,,DOUB,S2,O3,no,N,30,,131629,25601,MTN
31,,SING,S2,C12,no,N,31,,131629,25601,MTN
32,,SING,C12,H4,no,N,32,,131629,25601,MTN
33,,SING,C12,H1,no,N,33,,131629,25601,MTN
34,,SING,C12,H3,no,N,34,,131629,25601,MTN
1,,SING,N,CA,no,N,1,,131858,25613,NVA
2,,SING,N,H,no,N,2,,131858,25613,NVA
3,,SING,N,H2,no,N,3,,131858,25613,NVA
4,,SING,CA,CB,no,N,4,,131858,25613,NVA
5,,SING,CA,C,no,N,5,,131858,25613,NVA
6,,SING,CA,HA,no,N,6,,131858,25613,NVA
7,,SING,CB,CG,no,N,7,,131858,25613,NVA
8,,SING,CB,HB2,no,N,8,,131858,25613,NVA
9,,SING,CB,HB3,no,N,9,,131858,25613,NVA
10,,SING,CG,CD,no,N,10,,131858,25613,NVA
11,,SING,CG,HG2,no,N,11,,131858,25613,NVA
12,,SING,CG,HG3,no,N,12,,131858,25613,NVA
13,,SING,CD,HD1,no,N,13,,131858,25613,NVA
14,,SING,CD,HD2,no,N,14,,131858,25613,NVA
15,,SING,CD,HD3,no,N,15,,131858,25613,NVA
16,,DOUB,C,O,no,N,16,,131858,25613,NVA
17,,SING,C,OXT,no,N,17,,131858,25613,NVA
18,,SING,OXT,HXT,no,N,18,,131858,25613,NVA
1,,SING,CD2,NE2,yes,N,1,,131859,25613,HIX
2,,DOUB,CD2,CG,yes,N,2,,131859,25613,HIX
3,,DOUB,NE2,NE1,yes,N,3,,131859,25613,HIX
4,,SING,CG,CB,no,N,4,,131859,25613,HIX
5,,SING,CG,ND1,yes,N,5,,131859,25613,HIX
6,,SING,CB,CA,no,N,6,,131859,25613,HIX
7,,SING,NE1,ND1,yes,N,7,,131859,25613,HIX
8,,DOUB,O,C,no,N,8,,131859,25613,HIX
9,,SING,N,CA,no,N,9,,131859,25613,HIX
10,,SING,CA,C,no,N,10,,131859,25613,HIX
11,,SING,N,H,no,N,11,,131859,25613,HIX
12,,SING,N,H1,no,N,12,,131859,25613,HIX
13,,SING,CA,HA,no,N,13,,131859,25613,HIX
14,,SING,CB,HB1,no,N,14,,131859,25613,HIX
15,,SING,CB,HB2,no,N,15,,131859,25613,HIX
16,,SING,CD2,HD2,no,N,16,,131859,25613,HIX
17,,SING,ND1,HD1,no,N,17,,131859,25613,HIX
18,,SING,C,OXT,no,N,18,,131859,25613,HIX
19,,SING,OXT,HXT,no,N,19,,131859,25613,HIX
1,,SING,N,CA,no,N,1,,131875,25614,NVA
2,,SING,N,H,no,N,2,,131875,25614,NVA
3,,SING,N,H2,no,N,3,,131875,25614,NVA
4,,SING,CA,CB,no,N,4,,131875,25614,NVA
5,,SING,CA,C,no,N,5,,131875,25614,NVA
6,,SING,CA,HA,no,N,6,,131875,25614,NVA
7,,SING,CB,CG,no,N,7,,131875,25614,NVA
8,,SING,CB,HB2,no,N,8,,131875,25614,NVA
9,,SING,CB,HB3,no,N,9,,131875,25614,NVA
10,,SING,CG,CD,no,N,10,,131875,25614,NVA
11,,SING,CG,HG2,no,N,11,,131875,25614,NVA
12,,SING,CG,HG3,no,N,12,,131875,25614,NVA
13,,SING,CD,HD1,no,N,13,,131875,25614,NVA
14,,SING,CD,HD2,no,N,14,,131875,25614,NVA
15,,SING,CD,HD3,no,N,15,,131875,25614,NVA
16,,DOUB,C,O,no,N,16,,131875,25614,NVA
17,,SING,C,OXT,no,N,17,,131875,25614,NVA
18,,SING,OXT,HXT,no,N,18,,131875,25614,NVA
1,,SING,CD2,NE2,yes,N,1,,131876,25614,HIX
2,,DOUB,CD2,CG,yes,N,2,,131876,25614,HIX
3,,DOUB,NE2,NE1,yes,N,3,,131876,25614,HIX
4,,SING,CG,CB,no,N,4,,131876,25614,HIX
5,,SING,CG,ND1,yes,N,5,,131876,25614,HIX
6,,SING,CB,CA,no,N,6,,131876,25614,HIX
7,,SING,NE1,ND1,yes,N,7,,131876,25614,HIX
8,,DOUB,O,C,no,N,8,,131876,25614,HIX
9,,SING,N,CA,no,N,9,,131876,25614,HIX
10,,SING,CA,C,no,N,10,,131876,25614,HIX
11,,SING,N,H,no,N,11,,131876,25614,HIX
12,,SING,N,H1,no,N,12,,131876,25614,HIX
13,,SING,CA,HA,no,N,13,,131876,25614,HIX
14,,SING,CB,HB1,no,N,14,,131876,25614,HIX
15,,SING,CB,HB2,no,N,15,,131876,25614,HIX
16,,SING,CD2,HD2,no,N,16,,131876,25614,HIX
17,,SING,ND1,HD1,no,N,17,,131876,25614,HIX
18,,SING,C,OXT,no,N,18,,131876,25614,HIX
19,,SING,OXT,HXT,no,N,19,,131876,25614,HIX
1,,SING,N,CA,no,N,1,,131892,25615,NVA
2,,SING,N,H,no,N,2,,131892,25615,NVA
3,,SING,N,H2,no,N,3,,131892,25615,NVA
4,,SING,CA,CB,no,N,4,,131892,25615,NVA
5,,SING,CA,C,no,N,5,,131892,25615,NVA
6,,SING,CA,HA,no,N,6,,131892,25615,NVA
7,,SING,CB,CG,no,N,7,,131892,25615,NVA
8,,SING,CB,HB2,no,N,8,,131892,25615,NVA
9,,SING,CB,HB3,no,N,9,,131892,25615,NVA
10,,SING,CG,CD,no,N,10,,131892,25615,NVA
11,,SING,CG,HG2,no,N,11,,131892,25615,NVA
12,,SING,CG,HG3,no,N,12,,131892,25615,NVA
13,,SING,CD,HD1,no,N,13,,131892,25615,NVA
14,,SING,CD,HD2,no,N,14,,131892,25615,NVA
15,,SING,CD,HD3,no,N,15,,131892,25615,NVA
16,,DOUB,C,O,no,N,16,,131892,25615,NVA
17,,SING,C,OXT,no,N,17,,131892,25615,NVA
18,,SING,OXT,HXT,no,N,18,,131892,25615,NVA
1,,SING,CD2,NE2,yes,N,1,,131893,25615,HIX
2,,DOUB,CD2,CG,yes,N,2,,131893,25615,HIX
3,,DOUB,NE2,NE1,yes,N,3,,131893,25615,HIX
4,,SING,CG,CB,no,N,4,,131893,25615,HIX
5,,SING,CG,ND1,yes,N,5,,131893,25615,HIX
6,,SING,CB,CA,no,N,6,,131893,25615,HIX
7,,SING,NE1,ND1,yes,N,7,,131893,25615,HIX
8,,DOUB,O,C,no,N,8,,131893,25615,HIX
9,,SING,N,CA,no,N,9,,131893,25615,HIX
10,,SING,CA,C,no,N,10,,131893,25615,HIX
11,,SING,N,H,no,N,11,,131893,25615,HIX
12,,SING,N,H1,no,N,12,,131893,25615,HIX
13,,SING,CA,HA,no,N,13,,131893,25615,HIX
14,,SING,CB,HB1,no,N,14,,131893,25615,HIX
15,,SING,CB,HB2,no,N,15,,131893,25615,HIX
16,,SING,CD2,HD2,no,N,16,,131893,25615,HIX
17,,SING,ND1,HD1,no,N,17,,131893,25615,HIX
18,,SING,C,OXT,no,N,18,,131893,25615,HIX
19,,SING,OXT,HXT,no,N,19,,131893,25615,HIX
1,,DOUB,C,O,no,N,1,,132150,25631,ACE
2,,SING,C,CH3,no,N,2,,132150,25631,ACE
3,,SING,C,H,no,N,3,,132150,25631,ACE
4,,SING,CH3,H1,no,N,4,,132150,25631,ACE
5,,SING,CH3,H2,no,N,5,,132150,25631,ACE
6,,SING,CH3,H3,no,N,6,,132150,25631,ACE
1,,SING,N,HN1,no,N,1,,132151,25631,NH2
2,,SING,N,HN2,no,N,2,,132151,25631,NH2
1,,SING,N1,C1,no,N,1,,132259,25640,HSD
2,,SING,C1,C2,no,N,2,,132259,25640,HSD
3,,DOUB,C2,C3,no,N,3,,132259,25640,HSD
4,,SING,C3,C4,no,N,4,,132259,25640,HSD
5,,SING,C4,O1,no,N,5,,132259,25640,HSD
6,,SING,C3,C5,no,N,6,,132259,25640,HSD
7,,SING,C5,O2,no,N,7,,132259,25640,HSD
8,,SING,C5,C6,no,N,8,,132259,25640,HSD
9,,SING,C6,O3,no,N,9,,132259,25640,HSD
10,,SING,C6,C7,no,N,10,,132259,25640,HSD
11,,SING,C1,C7,no,N,11,,132259,25640,HSD
12,,SING,C7,O4,no,N,12,,132259,25640,HSD
13,,SING,N1,H1,no,N,13,,132259,25640,HSD
14,,SING,N1,H2,no,N,14,,132259,25640,HSD
15,,SING,C1,H3,no,N,15,,132259,25640,HSD
16,,SING,C2,H4,no,N,16,,132259,25640,HSD
17,,SING,C4,H5,no,N,17,,132259,25640,HSD
18,,SING,C4,H6,no,N,18,,132259,25640,HSD
19,,SING,O1,H7,no,N,19,,132259,25640,HSD
20,,SING,C5,H8,no,N,20,,132259,25640,HSD
21,,SING,O2,H9,no,N,21,,132259,25640,HSD
22,,SING,C6,H10,no,N,22,,132259,25640,HSD
23,,SING,O3,H11,no,N,23,,132259,25640,HSD
24,,SING,C7,H12,no,N,24,,132259,25640,HSD
25,,SING,O4,H13,no,N,25,,132259,25640,HSD
1,,SING,FE,NA,no,N,1,,132260,25640,HEC
2,,SING,FE,NB,no,N,2,,132260,25640,HEC
3,,SING,FE,NC,no,N,3,,132260,25640,HEC
4,,SING,FE,ND,no,N,4,,132260,25640,HEC
5,,DOUB,CHA,C1A,no,N,5,,132260,25640,HEC
6,,SING,CHA,C4D,no,N,6,,132260,25640,HEC
7,,SING,CHA,HHA,no,N,7,,132260,25640,HEC
8,,DOUB,CHB,C4A,no,N,8,,132260,25640,HEC
9,,SING,CHB,C1B,no,N,9,,132260,25640,HEC
10,,SING,CHB,HHB,no,N,10,,132260,25640,HEC
11,,DOUB,CHC,C4B,no,N,11,,132260,25640,HEC
12,,SING,CHC,C1C,no,N,12,,132260,25640,HEC
13,,SING,CHC,HHC,no,N,13,,132260,25640,HEC
14,,DOUB,CHD,C4C,no,N,14,,132260,25640,HEC
15,,SING,CHD,C1D,no,N,15,,132260,25640,HEC
16,,SING,CHD,HHD,no,N,16,,132260,25640,HEC
17,,SING,NA,C1A,yes,N,17,,132260,25640,HEC
18,,SING,NA,C4A,yes,N,18,,132260,25640,HEC
19,,SING,C1A,C2A,yes,N,19,,132260,25640,HEC
20,,DOUB,C2A,C3A,yes,N,20,,132260,25640,HEC
21,,SING,C2A,CAA,no,N,21,,132260,25640,HEC
22,,SING,C3A,C4A,yes,N,22,,132260,25640,HEC
23,,SING,C3A,CMA,no,N,23,,132260,25640,HEC
24,,SING,CMA,HMA1,no,N,24,,132260,25640,HEC
25,,SING,CMA,HMA2,no,N,25,,132260,25640,HEC
26,,SING,CMA,HMA3,no,N,26,,132260,25640,HEC
27,,SING,CAA,CBA,no,N,27,,132260,25640,HEC
28,,SING,CAA,HAA1,no,N,28,,132260,25640,HEC
29,,SING,CAA,HAA2,no,N,29,,132260,25640,HEC
30,,SING,CBA,CGA,no,N,30,,132260,25640,HEC
31,,SING,CBA,HBA1,no,N,31,,132260,25640,HEC
32,,SING,CBA,HBA2,no,N,32,,132260,25640,HEC
33,,DOUB,CGA,O1A,no,N,33,,132260,25640,HEC
34,,SING,CGA,O2A,no,N,34,,132260,25640,HEC
35,,SING,O2A,H2A,no,N,35,,132260,25640,HEC
36,,SING,NB,C1B,yes,N,36,,132260,25640,HEC
37,,SING,NB,C4B,yes,N,37,,132260,25640,HEC
38,,DOUB,C1B,C2B,yes,N,38,,132260,25640,HEC
39,,SING,C2B,C3B,yes,N,39,,132260,25640,HEC
40,,SING,C2B,CMB,no,N,40,,132260,25640,HEC
41,,SING,C3B,C4B,yes,N,41,,132260,25640,HEC
42,,DOUB,C3B,CAB,no,E,42,,132260,25640,HEC
43,,SING,CMB,HMB1,no,N,43,,132260,25640,HEC
44,,SING,CMB,HMB2,no,N,44,,132260,25640,HEC
45,,SING,CMB,HMB3,no,N,45,,132260,25640,HEC
46,,SING,CAB,CBB,no,N,46,,132260,25640,HEC
47,,SING,CAB,HAB,no,N,47,,132260,25640,HEC
48,,SING,CBB,HBB1,no,N,48,,132260,25640,HEC
49,,SING,CBB,HBB2,no,N,49,,132260,25640,HEC
50,,SING,CBB,HBB3,no,N,50,,132260,25640,HEC
51,,SING,NC,C1C,yes,N,51,,132260,25640,HEC
52,,SING,NC,C4C,yes,N,52,,132260,25640,HEC
53,,DOUB,C1C,C2C,yes,N,53,,132260,25640,HEC
54,,SING,C2C,C3C,yes,N,54,,132260,25640,HEC
55,,SING,C2C,CMC,no,N,55,,132260,25640,HEC
56,,SING,C3C,C4C,yes,N,56,,132260,25640,HEC
57,,DOUB,C3C,CAC,no,E,57,,132260,25640,HEC
58,,SING,CMC,HMC1,no,N,58,,132260,25640,HEC
59,,SING,CMC,HMC2,no,N,59,,132260,25640,HEC
60,,SING,CMC,HMC3,no,N,60,,132260,25640,HEC
61,,SING,CAC,CBC,no,N,61,,132260,25640,HEC
62,,SING,CAC,HAC,no,N,62,,132260,25640,HEC
63,,SING,CBC,HBC1,no,N,63,,132260,25640,HEC
64,,SING,CBC,HBC2,no,N,64,,132260,25640,HEC
65,,SING,CBC,HBC3,no,N,65,,132260,25640,HEC
66,,SING,ND,C1D,yes,N,66,,132260,25640,HEC
67,,SING,ND,C4D,yes,N,67,,132260,25640,HEC
68,,DOUB,C1D,C2D,yes,N,68,,132260,25640,HEC
69,,SING,C2D,C3D,yes,N,69,,132260,25640,HEC
70,,SING,C2D,CMD,no,N,70,,132260,25640,HEC
71,,DOUB,C3D,C4D,yes,N,71,,132260,25640,HEC
72,,SING,C3D,CAD,no,N,72,,132260,25640,HEC
73,,SING,CMD,HMD1,no,N,73,,132260,25640,HEC
74,,SING,CMD,HMD2,no,N,74,,132260,25640,HEC
75,,SING,CMD,HMD3,no,N,75,,132260,25640,HEC
76,,SING,CAD,CBD,no,N,76,,132260,25640,HEC
77,,SING,CAD,HAD1,no,N,77,,132260,25640,HEC
78,,SING,CAD,HAD2,no,N,78,,132260,25640,HEC
79,,SING,CBD,CGD,no,N,79,,132260,25640,HEC
80,,SING,CBD,HBD1,no,N,80,,132260,25640,HEC
81,,SING,CBD,HBD2,no,N,81,,132260,25640,HEC
82,,DOUB,CGD,O1D,no,N,82,,132260,25640,HEC
83,,SING,CGD,O2D,no,N,83,,132260,25640,HEC
84,,SING,O2D,H2D,no,N,84,,132260,25640,HEC
1,,SING,O,H1,no,N,1,,132261,25640,HOH
2,,SING,O,H2,no,N,2,,132261,25640,HOH
1,,SING,N,CA,no,N,1,,132500,25653,PCA
2,,SING,N,CD,no,N,2,,132500,25653,PCA
3,,SING,N,H,no,N,3,,132500,25653,PCA
4,,SING,CA,CB,no,N,4,,132500,25653,PCA
5,,SING,CA,C,no,N,5,,132500,25653,PCA
6,,SING,CA,HA,no,N,6,,132500,25653,PCA
7,,SING,CB,CG,no,N,7,,132500,25653,PCA
8,,SING,CB,HB2,no,N,8,,132500,25653,PCA
9,,SING,CB,HB3,no,N,9,,132500,25653,PCA
10,,SING,CG,CD,no,N,10,,132500,25653,PCA
11,,SING,CG,HG2,no,N,11,,132500,25653,PCA
12,,SING,CG,HG3,no,N,12,,132500,25653,PCA
13,,DOUB,CD,OE,no,N,13,,132500,25653,PCA
14,,DOUB,C,O,no,N,14,,132500,25653,PCA
15,,SING,C,OXT,no,N,15,,132500,25653,PCA
16,,SING,OXT,HXT,no,N,16,,132500,25653,PCA
1,,SING,O,H1,no,N,1,,132543,25655,HOH
2,,SING,O,H2,no,N,2,,132543,25655,HOH
1,,SING,CHA,C1A,yes,N,1,,132660,25660,HEM
2,,DOUB,CHA,C4D,yes,N,2,,132660,25660,HEM
3,,SING,CHA,HHA,no,N,3,,132660,25660,HEM
4,,SING,CHB,C4A,yes,N,4,,132660,25660,HEM
5,,DOUB,CHB,C1B,yes,N,5,,132660,25660,HEM
6,,SING,CHB,HHB,no,N,6,,132660,25660,HEM
7,,SING,CHC,C4B,yes,N,7,,132660,25660,HEM
8,,DOUB,CHC,C1C,yes,N,8,,132660,25660,HEM
9,,SING,CHC,HHC,no,N,9,,132660,25660,HEM
10,,DOUB,CHD,C4C,yes,N,10,,132660,25660,HEM
11,,SING,CHD,C1D,yes,N,11,,132660,25660,HEM
12,,SING,CHD,HHD,no,N,12,,132660,25660,HEM
13,,DOUB,C1A,C2A,yes,N,13,,132660,25660,HEM
14,,SING,C1A,NA,yes,N,14,,132660,25660,HEM
15,,SING,C2A,C3A,yes,N,15,,132660,25660,HEM
16,,SING,C2A,CAA,no,N,16,,132660,25660,HEM
17,,DOUB,C3A,C4A,yes,N,17,,132660,25660,HEM
18,,SING,C3A,CMA,no,N,18,,132660,25660,HEM
19,,SING,C4A,NA,yes,N,19,,132660,25660,HEM
20,,SING,CMA,HMA,no,N,20,,132660,25660,HEM
21,,SING,CMA,HMAA,no,N,21,,132660,25660,HEM
22,,SING,CMA,HMAB,no,N,22,,132660,25660,HEM
23,,SING,CAA,CBA,no,N,23,,132660,25660,HEM
24,,SING,CAA,HAA,no,N,24,,132660,25660,HEM
25,,SING,CAA,HAAA,no,N,25,,132660,25660,HEM
26,,SING,CBA,CGA,no,N,26,,132660,25660,HEM
27,,SING,CBA,HBA,no,N,27,,132660,25660,HEM
28,,SING,CBA,HBAA,no,N,28,,132660,25660,HEM
29,,DOUB,CGA,O1A,no,N,29,,132660,25660,HEM
30,,SING,CGA,O2A,no,N,30,,132660,25660,HEM
31,,SING,C1B,C2B,no,N,31,,132660,25660,HEM
32,,SING,C1B,NB,yes,N,32,,132660,25660,HEM
33,,DOUB,C2B,C3B,yes,N,33,,132660,25660,HEM
34,,SING,C2B,CMB,yes,N,34,,132660,25660,HEM
35,,SING,C3B,C4B,no,N,35,,132660,25660,HEM
36,,SING,C3B,CAB,yes,N,36,,132660,25660,HEM
37,,DOUB,C4B,NB,no,N,37,,132660,25660,HEM
38,,SING,CMB,HMB,yes,N,38,,132660,25660,HEM
39,,SING,CMB,HMBA,no,N,39,,132660,25660,HEM
40,,SING,CMB,HMBB,no,N,40,,132660,25660,HEM
41,,DOUB,CAB,CBB,no,N,41,,132660,25660,HEM
42,,SING,CAB,HAB,no,N,42,,132660,25660,HEM
43,,SING,CBB,HBB,no,N,43,,132660,25660,HEM
44,,SING,CBB,HBBA,no,N,44,,132660,25660,HEM
45,,SING,C1C,C2C,no,N,45,,132660,25660,HEM
46,,SING,C1C,NC,yes,N,46,,132660,25660,HEM
47,,DOUB,C2C,C3C,yes,N,47,,132660,25660,HEM
48,,SING,C2C,CMC,yes,N,48,,132660,25660,HEM
49,,SING,C3C,C4C,no,N,49,,132660,25660,HEM
50,,SING,C3C,CAC,yes,N,50,,132660,25660,HEM
51,,SING,C4C,NC,no,N,51,,132660,25660,HEM
52,,SING,CMC,HMC,yes,N,52,,132660,25660,HEM
53,,SING,CMC,HMCA,no,N,53,,132660,25660,HEM
54,,SING,CMC,HMCB,no,N,54,,132660,25660,HEM
55,,DOUB,CAC,CBC,no,N,55,,132660,25660,HEM
56,,SING,CAC,HAC,no,N,56,,132660,25660,HEM
57,,SING,CBC,HBC,no,N,57,,132660,25660,HEM
58,,SING,CBC,HBCA,no,N,58,,132660,25660,HEM
59,,SING,C1D,C2D,no,N,59,,132660,25660,HEM
60,,DOUB,C1D,ND,yes,N,60,,132660,25660,HEM
61,,DOUB,C2D,C3D,yes,N,61,,132660,25660,HEM
62,,SING,C2D,CMD,yes,N,62,,132660,25660,HEM
63,,SING,C3D,C4D,no,N,63,,132660,25660,HEM
64,,SING,C3D,CAD,yes,N,64,,132660,25660,HEM
65,,SING,C4D,ND,no,N,65,,132660,25660,HEM
66,,SING,CMD,HMD,yes,N,66,,132660,25660,HEM
67,,SING,CMD,HMDA,no,N,67,,132660,25660,HEM
68,,SING,CMD,HMDB,no,N,68,,132660,25660,HEM
69,,SING,CAD,CBD,no,N,69,,132660,25660,HEM
70,,SING,CAD,HAD,no,N,70,,132660,25660,HEM
71,,SING,CAD,HADA,no,N,71,,132660,25660,HEM
72,,SING,CBD,CGD,no,N,72,,132660,25660,HEM
73,,SING,CBD,HBD,no,N,73,,132660,25660,HEM
74,,SING,CBD,HBDA,no,N,74,,132660,25660,HEM
75,,DOUB,CGD,O1D,no,N,75,,132660,25660,HEM
76,,SING,CGD,O2D,no,N,76,,132660,25660,HEM
77,,SING,O2A,H2A,no,N,77,,132660,25660,HEM
78,,SING,O2D,H2D,no,N,78,,132660,25660,HEM
79,,SING,FE,NA,no,N,79,,132660,25660,HEM
80,,SING,FE,NB,no,N,80,,132660,25660,HEM
81,,SING,FE,NC,no,N,81,,132660,25660,HEM
82,,SING,FE,ND,no,N,82,,132660,25660,HEM
1,,SING,C24,C26,no,N,1,,132661,25660,CMF
2,,SING,C24,N2,no,N,2,,132661,25660,CMF
3,,SING,C24,H241,no,N,3,,132661,25660,CMF
4,,SING,C24,H242,no,N,4,,132661,25660,CMF
5,,SING,C26,O4,no,N,5,,132661,25660,CMF
6,,SING,C26,H261,no,N,6,,132661,25660,CMF
7,,SING,C26,H262,no,N,7,,132661,25660,CMF
8,,SING,O4,C27,no,N,8,,132661,25660,CMF
9,,SING,C27,C25,no,N,9,,132661,25660,CMF
10,,SING,C27,H271,no,N,10,,132661,25660,CMF
11,,SING,C27,H272,no,N,11,,132661,25660,CMF
12,,SING,C25,N2,no,N,12,,132661,25660,CMF
13,,SING,C25,H251,no,N,13,,132661,25660,CMF
14,,SING,C25,H252,no,N,14,,132661,25660,CMF
15,,SING,N2,C23,no,N,15,,132661,25660,CMF
16,,DOUB,C23,O3,no,N,16,,132661,25660,CMF
17,,SING,C23,C22,no,N,17,,132661,25660,CMF
18,,SING,C22,N1,no,N,18,,132661,25660,CMF
19,,SING,C22,H221,no,N,19,,132661,25660,CMF
20,,SING,C22,H222,no,N,20,,132661,25660,CMF
21,,SING,N1,C1,yes,N,21,,132661,25660,CMF
22,,SING,N1,C9,yes,N,22,,132661,25660,CMF
23,,DOUB,C1,C6,yes,N,23,,132661,25660,CMF
24,,SING,C1,C2,yes,N,24,,132661,25660,CMF
25,,SING,C6,C5,yes,N,25,,132661,25660,CMF
26,,SING,C6,H6,no,N,26,,132661,25660,CMF
27,,SING,C5,C8,no,N,27,,132661,25660,CMF
28,,DOUB,C5,C4,yes,N,28,,132661,25660,CMF
29,,DOUB,C8,O2,no,N,29,,132661,25660,CMF
30,,SING,C8,O1,no,N,30,,132661,25660,CMF
31,,SING,O1,H1,no,N,31,,132661,25660,CMF
32,,SING,C4,C3,yes,N,32,,132661,25660,CMF
33,,SING,C4,H4,no,N,33,,132661,25660,CMF
34,,DOUB,C3,C2,yes,N,34,,132661,25660,CMF
35,,SING,C3,H3,no,N,35,,132661,25660,CMF
36,,SING,C2,C7,yes,N,36,,132661,25660,CMF
37,,SING,C7,C16,no,N,37,,132661,25660,CMF
38,,DOUB,C7,C9,yes,N,38,,132661,25660,CMF
39,,SING,C16,C17,no,N,39,,132661,25660,CMF
40,,SING,C16,C18,no,N,40,,132661,25660,CMF
41,,SING,C16,H16,no,N,41,,132661,25660,CMF
42,,SING,C17,C20,no,N,42,,132661,25660,CMF
43,,SING,C17,H171,no,N,43,,132661,25660,CMF
44,,SING,C17,H172,no,N,44,,132661,25660,CMF
45,,SING,C20,C21,no,N,45,,132661,25660,CMF
46,,SING,C20,H201,no,N,46,,132661,25660,CMF
47,,SING,C20,H202,no,N,47,,132661,25660,CMF
48,,SING,C21,C19,no,N,48,,132661,25660,CMF
49,,SING,C21,H211,no,N,49,,132661,25660,CMF
50,,SING,C21,H212,no,N,50,,132661,25660,CMF
51,,SING,C19,C18,no,N,51,,132661,25660,CMF
52,,SING,C19,H191,no,N,52,,132661,25660,CMF
53,,SING,C19,H192,no,N,53,,132661,25660,CMF
54,,SING,C18,H181,no,N,54,,132661,25660,CMF
55,,SING,C18,H182,no,N,55,,132661,25660,CMF
56,,SING,C9,C10,yes,N,56,,132661,25660,CMF
57,,DOUB,C10,C11,yes,N,57,,132661,25660,CMF
58,,SING,C10,C15,yes,N,58,,132661,25660,CMF
59,,SING,C11,C12,yes,N,59,,132661,25660,CMF
60,,SING,C11,H11,no,N,60,,132661,25660,CMF
61,,DOUB,C12,C13,yes,N,61,,132661,25660,CMF
62,,SING,C12,H12,no,N,62,,132661,25660,CMF
63,,SING,C13,C14,yes,N,63,,132661,25660,CMF
64,,SING,C13,H13,no,N,64,,132661,25660,CMF
65,,DOUB,C14,C15,yes,N,65,,132661,25660,CMF
66,,SING,C14,H14,no,N,66,,132661,25660,CMF
67,,SING,C15,H15,no,N,67,,132661,25660,CMF
1,,SING,C1',N9,no,N,1,,132691,25661,AP7
2,,SING,C1',C2',no,N,2,,132691,25661,AP7
3,,SING,C1',O4',no,N,3,,132691,25661,AP7
4,,SING,C1',H1',no,N,4,,132691,25661,AP7
5,,SING,N1,C2,yes,N,5,,132691,25661,AP7
6,,DOUB,N1,C6,yes,N,6,,132691,25661,AP7
7,,SING,N1,H1,no,N,7,,132691,25661,AP7
8,,DOUB,C2,N3,yes,N,8,,132691,25661,AP7
9,,SING,C2,H2,no,N,9,,132691,25661,AP7
10,,SING,N3,C4,yes,N,10,,132691,25661,AP7
11,,DOUB,C4,C5,yes,N,11,,132691,25661,AP7
12,,SING,C4,N9,yes,N,12,,132691,25661,AP7
13,,SING,C5,C6,yes,N,13,,132691,25661,AP7
14,,SING,C5,N7,yes,N,14,,132691,25661,AP7
15,,SING,C6,N6,no,N,15,,132691,25661,AP7
16,,SING,N6,H61,no,N,16,,132691,25661,AP7
17,,SING,N6,H62,no,N,17,,132691,25661,AP7
18,,DOUB,N7,C8,yes,N,18,,132691,25661,AP7
19,,SING,C8,N9,yes,N,19,,132691,25661,AP7
20,,SING,C8,H8,no,N,20,,132691,25661,AP7
21,,SING,C2',O2',no,N,21,,132691,25661,AP7
22,,SING,C2',C3',no,N,22,,132691,25661,AP7
23,,SING,C2',H2',no,N,23,,132691,25661,AP7
24,,SING,O2',HO2',no,N,24,,132691,25661,AP7
25,,SING,C3',O3',no,N,25,,132691,25661,AP7
26,,SING,C3',C4',no,N,26,,132691,25661,AP7
27,,SING,C3',H3',no,N,27,,132691,25661,AP7
28,,SING,O3',HO3',no,N,28,,132691,25661,AP7
29,,SING,C4',O4',no,N,29,,132691,25661,AP7
30,,SING,C4',C5',no,N,30,,132691,25661,AP7
31,,SING,C4',H4',no,N,31,,132691,25661,AP7
32,,SING,C5',O5',no,N,32,,132691,25661,AP7
33,,SING,C5',H5'',no,N,33,,132691,25661,AP7
34,,SING,C5',H5',no,N,34,,132691,25661,AP7
35,,SING,O5',P,no,N,35,,132691,25661,AP7
36,,DOUB,OP1,P,no,N,36,,132691,25661,AP7
37,,SING,OP2,P,no,N,37,,132691,25661,AP7
38,,SING,OP2,HOP2,no,N,38,,132691,25661,AP7
39,,SING,P,OP3,no,N,39,,132691,25661,AP7
40,,SING,OP3,HOP3,no,N,40,,132691,25661,AP7
1,,DOUB,PG,O1G,no,N,1,,132692,25661,GTP
2,,SING,PG,O2G,no,N,2,,132692,25661,GTP
3,,SING,PG,O3G,no,N,3,,132692,25661,GTP
4,,SING,PG,O3B,no,N,4,,132692,25661,GTP
5,,SING,O2G,HOG2,no,N,5,,132692,25661,GTP
6,,SING,O3G,HOG3,no,N,6,,132692,25661,GTP
7,,SING,O3B,PB,no,N,7,,132692,25661,GTP
8,,DOUB,PB,O1B,no,N,8,,132692,25661,GTP
9,,SING,PB,O2B,no,N,9,,132692,25661,GTP
10,,SING,PB,O3A,no,N,10,,132692,25661,GTP
11,,SING,O2B,HOB2,no,N,11,,132692,25661,GTP
12,,SING,O3A,PA,no,N,12,,132692,25661,GTP
13,,DOUB,PA,O1A,no,N,13,,132692,25661,GTP
14,,SING,PA,O2A,no,N,14,,132692,25661,GTP
15,,SING,PA,O5',no,N,15,,132692,25661,GTP
16,,SING,O2A,HOA2,no,N,16,,132692,25661,GTP
17,,SING,O5',C5',no,N,17,,132692,25661,GTP
18,,SING,C5',C4',no,N,18,,132692,25661,GTP
19,,SING,C5',H5',no,N,19,,132692,25661,GTP
20,,SING,C5',H5'',no,N,20,,132692,25661,GTP
21,,SING,C4',O4',no,N,21,,132692,25661,GTP
22,,SING,C4',C3',no,N,22,,132692,25661,GTP
23,,SING,C4',H4',no,N,23,,132692,25661,GTP
24,,SING,O4',C1',no,N,24,,132692,25661,GTP
25,,SING,C3',O3',no,N,25,,132692,25661,GTP
26,,SING,C3',C2',no,N,26,,132692,25661,GTP
27,,SING,C3',H3',no,N,27,,132692,25661,GTP
28,,SING,O3',HO3',no,N,28,,132692,25661,GTP
29,,SING,C2',O2',no,N,29,,132692,25661,GTP
30,,SING,C2',C1',no,N,30,,132692,25661,GTP
31,,SING,C2',H2',no,N,31,,132692,25661,GTP
32,,SING,O2',HO2',no,N,32,,132692,25661,GTP
33,,SING,C1',N9,no,N,33,,132692,25661,GTP
34,,SING,C1',H1',no,N,34,,132692,25661,GTP
35,,SING,N9,C8,yes,N,35,,132692,25661,GTP
36,,SING,N9,C4,yes,N,36,,132692,25661,GTP
37,,DOUB,C8,N7,yes,N,37,,132692,25661,GTP
38,,SING,C8,H8,no,N,38,,132692,25661,GTP
39,,SING,N7,C5,yes,N,39,,132692,25661,GTP
40,,SING,C5,C6,no,N,40,,132692,25661,GTP
41,,DOUB,C5,C4,yes,N,41,,132692,25661,GTP
42,,DOUB,C6,O6,no,N,42,,132692,25661,GTP
43,,SING,C6,N1,no,N,43,,132692,25661,GTP
44,,SING,N1,C2,no,N,44,,132692,25661,GTP
45,,SING,N1,HN1,no,N,45,,132692,25661,GTP
46,,SING,C2,N2,no,N,46,,132692,25661,GTP
47,,DOUB,C2,N3,no,N,47,,132692,25661,GTP
48,,SING,N2,HN21,no,N,48,,132692,25661,GTP
49,,SING,N2,HN22,no,N,49,,132692,25661,GTP
50,,SING,N3,C4,no,N,50,,132692,25661,GTP
1,,SING,N2,C2,no,N,1,,132896,25669,8XG
2,,DOUB,C2,N3,no,N,2,,132896,25669,8XG
3,,SING,C2,N1,no,N,3,,132896,25669,8XG
4,,SING,N3,C4,no,N,4,,132896,25669,8XG
5,,SING,N1,C6,no,N,5,,132896,25669,8XG
6,,SING,O2',C2',no,N,6,,132896,25669,8XG
7,,DOUB,C4,C5,yes,N,7,,132896,25669,8XG
8,,SING,C4,N9,yes,N,8,,132896,25669,8XG
9,,DOUB,C6,O6,no,N,9,,132896,25669,8XG
10,,SING,C6,C5,no,N,10,,132896,25669,8XG
11,,SING,C1',C2',no,N,11,,132896,25669,8XG
12,,SING,C1',N9,no,N,12,,132896,25669,8XG
13,,SING,C1',O4',no,N,13,,132896,25669,8XG
14,,SING,C2',C3',no,N,14,,132896,25669,8XG
15,,SING,C5,N7,yes,N,15,,132896,25669,8XG
16,,SING,N9,C8,yes,N,16,,132896,25669,8XG
17,,SING,O4',C4',no,N,17,,132896,25669,8XG
18,,SING,C3',C4',no,N,18,,132896,25669,8XG
19,,SING,C3',O3',no,N,19,,132896,25669,8XG
20,,SING,C4',C5',no,N,20,,132896,25669,8XG
21,,DOUB,C8,N7,yes,N,21,,132896,25669,8XG
22,,SING,C5',O5',no,N,22,,132896,25669,8XG
23,,SING,O5',HO5',no,N,23,,132896,25669,8XG
24,,SING,C5',H5'',no,N,24,,132896,25669,8XG
25,,SING,C5',H5',no,N,25,,132896,25669,8XG
26,,SING,C4',H4',no,N,26,,132896,25669,8XG
27,,SING,C1',H1',no,N,27,,132896,25669,8XG
28,,SING,N2,H22,no,N,28,,132896,25669,8XG
29,,SING,N2,H21,no,N,29,,132896,25669,8XG
30,,SING,N1,H1,no,N,30,,132896,25669,8XG
31,,SING,C8,H8,no,N,31,,132896,25669,8XG
32,,SING,C2',H2',no,N,32,,132896,25669,8XG
33,,SING,O2',HO2',no,N,33,,132896,25669,8XG
34,,SING,C3',H3',no,N,34,,132896,25669,8XG
35,,SING,O3',H2,no,N,35,,132896,25669,8XG
1,,SING,O2',C2',no,N,1,,132897,25669,8XU
2,,DOUB,O2,C2,no,N,2,,132897,25669,8XU
3,,SING,C2',C1',no,N,3,,132897,25669,8XU
4,,SING,C2',C3',no,N,4,,132897,25669,8XU
5,,SING,C1',N1,no,N,5,,132897,25669,8XU
6,,SING,C1',O4',no,N,6,,132897,25669,8XU
7,,SING,C2,N1,no,N,7,,132897,25669,8XU
8,,SING,C2,N3,no,N,8,,132897,25669,8XU
9,,SING,N1,C6,no,N,9,,132897,25669,8XU
10,,SING,C3',C4',no,N,10,,132897,25669,8XU
11,,SING,C3',O3',no,N,11,,132897,25669,8XU
12,,SING,N3,C4,no,N,12,,132897,25669,8XU
13,,SING,O4',C4',no,N,13,,132897,25669,8XU
14,,SING,C4',C5',no,N,14,,132897,25669,8XU
15,,DOUB,C6,C5,no,N,15,,132897,25669,8XU
16,,DOUB,C4,O4,no,N,16,,132897,25669,8XU
17,,SING,C4,C5,no,N,17,,132897,25669,8XU
18,,SING,C5',O5',no,N,18,,132897,25669,8XU
19,,SING,O5',P,no,N,19,,132897,25669,8XU
20,,DOUB,P,OP1,no,N,20,,132897,25669,8XU
21,,SING,P,OP2,no,N,21,,132897,25669,8XU
22,,SING,P,O1,no,N,22,,132897,25669,8XU
23,,SING,OP2,H1,no,N,23,,132897,25669,8XU
24,,SING,C5',H5'',no,N,24,,132897,25669,8XU
25,,SING,C5',H5',no,N,25,,132897,25669,8XU
26,,SING,C4',H4',no,N,26,,132897,25669,8XU
27,,SING,C1',H1',no,N,27,,132897,25669,8XU
28,,SING,C6,H6,no,N,28,,132897,25669,8XU
29,,SING,N3,H3,no,N,29,,132897,25669,8XU
30,,SING,C5,H5,no,N,30,,132897,25669,8XU
31,,SING,C2',H2',no,N,31,,132897,25669,8XU
32,,SING,O2',HO2',no,N,32,,132897,25669,8XU
33,,SING,C3',H3',no,N,33,,132897,25669,8XU
34,,SING,O3',H2,no,N,34,,132897,25669,8XU
35,,SING,O1,H4,no,N,35,,132897,25669,8XU
1,,DOUB,OP1,P,no,N,1,,132898,25669,8XA
2,,SING,P,O5',no,N,2,,132898,25669,8XA
3,,SING,P,OP2,no,N,3,,132898,25669,8XA
4,,SING,O5',C5',no,N,4,,132898,25669,8XA
5,,SING,O2',C2',no,N,5,,132898,25669,8XA
6,,SING,C4',C3',no,N,6,,132898,25669,8XA
7,,SING,C4',C5',no,N,7,,132898,25669,8XA
8,,SING,C4',O4',no,N,8,,132898,25669,8XA
9,,SING,C3',C2',no,N,9,,132898,25669,8XA
10,,SING,C3',O3',no,N,10,,132898,25669,8XA
11,,SING,C2',C1',no,N,11,,132898,25669,8XA
12,,SING,O4',C1',no,N,12,,132898,25669,8XA
13,,SING,C1',N9,no,N,13,,132898,25669,8XA
14,,SING,N9,C8,yes,N,14,,132898,25669,8XA
15,,SING,N9,C4,yes,N,15,,132898,25669,8XA
16,,DOUB,N3,C4,yes,N,16,,132898,25669,8XA
17,,SING,N3,C2,yes,N,17,,132898,25669,8XA
18,,DOUB,C8,N7,yes,N,18,,132898,25669,8XA
19,,SING,C4,C5,yes,N,19,,132898,25669,8XA
20,,DOUB,C2,N1,yes,N,20,,132898,25669,8XA
21,,SING,N7,C5,yes,N,21,,132898,25669,8XA
22,,DOUB,C5,C6,yes,N,22,,132898,25669,8XA
23,,SING,N1,C6,yes,N,23,,132898,25669,8XA
24,,SING,C6,N6,no,N,24,,132898,25669,8XA
25,,SING,P,O1,no,N,25,,132898,25669,8XA
26,,SING,OP2,H1,no,N,26,,132898,25669,8XA
27,,SING,C5',H5',no,N,27,,132898,25669,8XA
28,,SING,C5',H5'',no,N,28,,132898,25669,8XA
29,,SING,C4',H4',no,N,29,,132898,25669,8XA
30,,SING,C1',H1',no,N,30,,132898,25669,8XA
31,,SING,C2,H2,no,N,31,,132898,25669,8XA
32,,SING,N6,H61,no,N,32,,132898,25669,8XA
33,,SING,N6,H62,no,N,33,,132898,25669,8XA
34,,SING,C8,H8,no,N,34,,132898,25669,8XA
35,,SING,C2',H2',no,N,35,,132898,25669,8XA
36,,SING,O2',HO2',no,N,36,,132898,25669,8XA
37,,SING,C3',H3',no,N,37,,132898,25669,8XA
38,,SING,O3',H3,no,N,38,,132898,25669,8XA
39,,SING,O1,H4,no,N,39,,132898,25669,8XA
1,,DOUB,OP1,P,no,N,1,,132899,25669,8XC
2,,SING,P,O5',no,N,2,,132899,25669,8XC
3,,SING,P,OP2,no,N,3,,132899,25669,8XC
4,,SING,O5',C5',no,N,4,,132899,25669,8XC
5,,SING,O2',C2',no,N,5,,132899,25669,8XC
6,,SING,C4',C3',no,N,6,,132899,25669,8XC
7,,SING,C4',C5',no,N,7,,132899,25669,8XC
8,,SING,C4',O4',no,N,8,,132899,25669,8XC
9,,SING,C3',C2',no,N,9,,132899,25669,8XC
10,,SING,C3',O3',no,N,10,,132899,25669,8XC
11,,SING,C2',C1',no,N,11,,132899,25669,8XC
12,,SING,O4',C1',no,N,12,,132899,25669,8XC
13,,SING,C1',N1,no,N,13,,132899,25669,8XC
14,,SING,N1,C6,no,N,14,,132899,25669,8XC
15,,SING,N1,C2,no,N,15,,132899,25669,8XC
16,,DOUB,O2,C2,no,N,16,,132899,25669,8XC
17,,DOUB,C6,C5,no,N,17,,132899,25669,8XC
18,,SING,C2,N3,no,N,18,,132899,25669,8XC
19,,SING,C5,C4,no,N,19,,132899,25669,8XC
20,,DOUB,N3,C4,no,N,20,,132899,25669,8XC
21,,SING,C4,N4,no,N,21,,132899,25669,8XC
22,,SING,P,O1,no,N,22,,132899,25669,8XC
23,,SING,OP2,H1,no,N,23,,132899,25669,8XC
24,,SING,C5',H5'',no,N,24,,132899,25669,8XC
25,,SING,C5',H5',no,N,25,,132899,25669,8XC
26,,SING,C4',H4',no,N,26,,132899,25669,8XC
27,,SING,C1',H1',no,N,27,,132899,25669,8XC
28,,SING,C6,H6,no,N,28,,132899,25669,8XC
29,,SING,N4,H41,no,N,29,,132899,25669,8XC
30,,SING,N4,H42,no,N,30,,132899,25669,8XC
31,,SING,C5,H5,no,N,31,,132899,25669,8XC
32,,SING,C2',H2',no,N,32,,132899,25669,8XC
33,,SING,O2',HO2',no,N,33,,132899,25669,8XC
34,,SING,C3',H3',no,N,34,,132899,25669,8XC
35,,SING,O3',HO3',no,N,35,,132899,25669,8XC
36,,SING,O1,H2,no,N,36,,132899,25669,8XC
1,,SING,O5',C5',no,N,1,,132955,25672,4E9
2,,SING,O5',P,no,N,2,,132955,25672,4E9
3,,SING,C5',C4',no,N,3,,132955,25672,4E9
4,,SING,C4',O4',no,N,4,,132955,25672,4E9
5,,SING,C4',C3',no,N,5,,132955,25672,4E9
6,,SING,O4',C1',no,N,6,,132955,25672,4E9
7,,SING,C1',N9,no,N,7,,132955,25672,4E9
8,,SING,C1',C2',no,N,8,,132955,25672,4E9
9,,SING,N9,C4,yes,N,9,,132955,25672,4E9
10,,SING,N9,C8,yes,N,10,,132955,25672,4E9
11,,SING,C4,N3,no,N,11,,132955,25672,4E9
12,,DOUB,C4,C5,yes,N,12,,132955,25672,4E9
13,,DOUB,N3,C2,no,N,13,,132955,25672,4E9
14,,SING,C2,N1,no,N,14,,132955,25672,4E9
15,,SING,C2,N24,no,N,15,,132955,25672,4E9
16,,SING,N1,C6,no,N,16,,132955,25672,4E9
17,,SING,C6,C5,no,N,17,,132955,25672,4E9
18,,DOUB,C6,O6,no,N,18,,132955,25672,4E9
19,,SING,C5,N7,yes,N,19,,132955,25672,4E9
20,,DOUB,N7,C8,yes,N,20,,132955,25672,4E9
21,,SING,C8,N8,no,N,21,,132955,25672,4E9
22,,SING,C2',C3',no,N,22,,132955,25672,4E9
23,,SING,C3',O3',no,N,23,,132955,25672,4E9
24,,SING,P,OP1,no,N,24,,132955,25672,4E9
25,,SING,P,OP2,no,N,25,,132955,25672,4E9
26,,SING,N8,C10,no,N,26,,132955,25672,4E9
27,,DOUB,C10,C11,yes,N,27,,132955,25672,4E9
28,,SING,C10,C25,yes,N,28,,132955,25672,4E9
29,,SING,C11,C12,yes,N,29,,132955,25672,4E9
30,,SING,C11,C26,yes,N,30,,132955,25672,4E9
31,,DOUB,C12,C13,yes,N,31,,132955,25672,4E9
32,,SING,C13,C14,yes,N,32,,132955,25672,4E9
33,,DOUB,C14,C15,yes,N,33,,132955,25672,4E9
34,,SING,C15,C16,no,N,34,,132955,25672,4E9
35,,SING,C15,C26,yes,N,35,,132955,25672,4E9
36,,DOUB,C16,O27,no,N,36,,132955,25672,4E9
37,,SING,C16,C17,no,N,37,,132955,25672,4E9
38,,DOUB,C17,C18,yes,N,38,,132955,25672,4E9
39,,SING,C17,C22,yes,N,39,,132955,25672,4E9
40,,SING,C18,C19,yes,N,40,,132955,25672,4E9
41,,DOUB,C19,C20,yes,N,41,,132955,25672,4E9
42,,SING,C20,C21,yes,N,42,,132955,25672,4E9
43,,DOUB,C21,C22,yes,N,43,,132955,25672,4E9
44,,SING,C22,C23,no,N,44,,132955,25672,4E9
45,,SING,C23,C24,yes,N,45,,132955,25672,4E9
46,,DOUB,C23,C26,yes,N,46,,132955,25672,4E9
47,,DOUB,C24,C25,yes,N,47,,132955,25672,4E9
48,,SING,C5',H5',no,N,48,,132955,25672,4E9
49,,SING,C5',H5'',no,N,49,,132955,25672,4E9
50,,SING,C4',H4',no,N,50,,132955,25672,4E9
51,,SING,C1',H1',no,N,51,,132955,25672,4E9
52,,SING,N1,H1,no,N,52,,132955,25672,4E9
53,,SING,C2',H2',no,N,53,,132955,25672,4E9
54,,SING,C2',H2'',no,N,54,,132955,25672,4E9
55,,SING,C3',H3',no,N,55,,132955,25672,4E9
56,,SING,O3',H2,no,N,56,,132955,25672,4E9
57,,SING,OP1,H3,no,N,57,,132955,25672,4E9
58,,SING,OP2,H4,no,N,58,,132955,25672,4E9
59,,SING,N24,H21,no,N,59,,132955,25672,4E9
60,,SING,N24,H22,no,N,60,,132955,25672,4E9
61,,SING,N8,H10,no,N,61,,132955,25672,4E9
62,,SING,C12,H12,no,N,62,,132955,25672,4E9
63,,SING,C13,H13,no,N,63,,132955,25672,4E9
64,,SING,C14,H14,no,N,64,,132955,25672,4E9
65,,SING,C18,H18,no,N,65,,132955,25672,4E9
66,,SING,C19,H19,no,N,66,,132955,25672,4E9
67,,SING,C20,H20,no,N,67,,132955,25672,4E9
68,,SING,C21,H23,no,N,68,,132955,25672,4E9
69,,SING,C24,H24,no,N,69,,132955,25672,4E9
70,,SING,C25,H25,no,N,70,,132955,25672,4E9
71,,DOUB,P,OP3,no,N,71,,132955,25672,4E9
1,,DOUB,C,O,no,N,1,,132976,25673,ACE
2,,SING,C,CH3,no,N,2,,132976,25673,ACE
3,,SING,C,H,no,N,3,,132976,25673,ACE
4,,SING,CH3,H1,no,N,4,,132976,25673,ACE
5,,SING,CH3,H2,no,N,5,,132976,25673,ACE
6,,SING,CH3,H3,no,N,6,,132976,25673,ACE
1,,SING,NAC,CAE,no,N,1,,132977,25673,4G6
2,,SING,CAE,CAF,no,N,2,,132977,25673,4G6
3,,SING,NAD,CAF,no,N,3,,132977,25673,4G6
4,,SING,CAF,CAA,no,N,4,,132977,25673,4G6
5,,SING,CAF,CAB,no,N,5,,132977,25673,4G6
6,,SING,CAA,HAC,no,N,6,,132977,25673,4G6
7,,SING,CAA,HAB,no,N,7,,132977,25673,4G6
8,,SING,CAA,HAA,no,N,8,,132977,25673,4G6
9,,SING,CAB,HAF,no,N,9,,132977,25673,4G6
10,,SING,CAB,HAD,no,N,10,,132977,25673,4G6
11,,SING,CAB,HAE,no,N,11,,132977,25673,4G6
12,,SING,NAD,HAL,no,N,12,,132977,25673,4G6
13,,SING,NAD,H1,no,N,13,,132977,25673,4G6
14,,SING,CAE,HAH,no,N,14,,132977,25673,4G6
15,,SING,CAE,HAG,no,N,15,,132977,25673,4G6
16,,SING,NAC,HAI,no,N,16,,132977,25673,4G6
17,,SING,NAC,H3,no,N,17,,132977,25673,4G6
1,,SING,N,CA,no,N,1,,132978,25673,DPR
2,,SING,N,CD,no,N,2,,132978,25673,DPR
3,,SING,N,H,no,N,3,,132978,25673,DPR
4,,SING,CA,CB,no,N,4,,132978,25673,DPR
5,,SING,CA,C,no,N,5,,132978,25673,DPR
6,,SING,CA,HA,no,N,6,,132978,25673,DPR
7,,SING,CB,CG,no,N,7,,132978,25673,DPR
8,,SING,CB,HB2,no,N,8,,132978,25673,DPR
9,,SING,CB,HB3,no,N,9,,132978,25673,DPR
10,,SING,CG,CD,no,N,10,,132978,25673,DPR
11,,SING,CG,HG2,no,N,11,,132978,25673,DPR
12,,SING,CG,HG3,no,N,12,,132978,25673,DPR
13,,SING,CD,HD2,no,N,13,,132978,25673,DPR
14,,SING,CD,HD3,no,N,14,,132978,25673,DPR
15,,DOUB,C,O,no,N,15,,132978,25673,DPR
16,,SING,C,OXT,no,N,16,,132978,25673,DPR
17,,SING,OXT,HXT,no,N,17,,132978,25673,DPR
1,,SING,C11,C9,no,N,1,,132979,25673,4FU
2,,SING,C11,C12,no,N,2,,132979,25673,4FU
3,,SING,C9,C8,no,N,3,,132979,25673,4FU
4,,SING,C12,C13,no,N,4,,132979,25673,4FU
5,,DOUB,OAB,C15,no,N,5,,132979,25673,4FU
6,,SING,C8,C7,no,N,6,,132979,25673,4FU
7,,SING,C8,C14,no,N,7,,132979,25673,4FU
8,,DOUB,C7,O7,no,N,8,,132979,25673,4FU
9,,SING,C15,C14,no,N,9,,132979,25673,4FU
10,,SING,C13,C14,no,N,10,,132979,25673,4FU
11,,SING,C7,O1,no,N,11,,132979,25673,4FU
12,,SING,C8,H8,no,N,12,,132979,25673,4FU
13,,SING,C9,H9,no,N,13,,132979,25673,4FU
14,,SING,C9,HAI,no,N,14,,132979,25673,4FU
15,,SING,C11,H112,no,N,15,,132979,25673,4FU
16,,SING,C11,H111,no,N,16,,132979,25673,4FU
17,,SING,C12,HAG,no,N,17,,132979,25673,4FU
18,,SING,C12,H12,no,N,18,,132979,25673,4FU
19,,SING,C13,HAL,no,N,19,,132979,25673,4FU
20,,SING,C13,HAK,no,N,20,,132979,25673,4FU
21,,SING,C14,H14,no,N,21,,132979,25673,4FU
22,,SING,C15,O2,no,N,22,,132979,25673,4FU
23,,SING,O1,H1,no,N,23,,132979,25673,4FU
24,,SING,O2,H2,no,N,24,,132979,25673,4FU
1,,SING,N,HN1,no,N,1,,132980,25673,NH2
2,,SING,N,HN2,no,N,2,,132980,25673,NH2
1,,SING,O23,P24,no,N,1,,133728,25716,PNS
2,,SING,O23,HOP1,no,N,2,,133728,25716,PNS
3,,SING,P24,O25,no,N,3,,133728,25716,PNS
4,,DOUB,P24,O26,no,N,4,,133728,25716,PNS
5,,SING,P24,O27,no,N,5,,133728,25716,PNS
6,,SING,O25,HOP2,no,N,6,,133728,25716,PNS
7,,SING,O27,C28,no,N,7,,133728,25716,PNS
8,,SING,C28,C29,no,N,8,,133728,25716,PNS
9,,SING,C28,H282,no,N,9,,133728,25716,PNS
10,,SING,C28,H281,no,N,10,,133728,25716,PNS
11,,SING,C29,C30,no,N,11,,133728,25716,PNS
12,,SING,C29,C31,no,N,12,,133728,25716,PNS
13,,SING,C29,C32,no,N,13,,133728,25716,PNS
14,,SING,C30,H303,no,N,14,,133728,25716,PNS
15,,SING,C30,H302,no,N,15,,133728,25716,PNS
16,,SING,C30,H301,no,N,16,,133728,25716,PNS
17,,SING,C31,H313,no,N,17,,133728,25716,PNS
18,,SING,C31,H312,no,N,18,,133728,25716,PNS
19,,SING,C31,H311,no,N,19,,133728,25716,PNS
20,,SING,C32,O33,no,N,20,,133728,25716,PNS
21,,SING,C32,C34,no,N,21,,133728,25716,PNS
22,,SING,C32,H32,no,N,22,,133728,25716,PNS
23,,SING,O33,H33,no,N,23,,133728,25716,PNS
24,,DOUB,C34,O35,no,N,24,,133728,25716,PNS
25,,SING,C34,N36,no,N,25,,133728,25716,PNS
26,,SING,N36,C37,no,N,26,,133728,25716,PNS
27,,SING,N36,H36,no,N,27,,133728,25716,PNS
28,,SING,C37,C38,no,N,28,,133728,25716,PNS
29,,SING,C37,H372,no,N,29,,133728,25716,PNS
30,,SING,C37,H371,no,N,30,,133728,25716,PNS
31,,SING,C38,C39,no,N,31,,133728,25716,PNS
32,,SING,C38,H382,no,N,32,,133728,25716,PNS
33,,SING,C38,H381,no,N,33,,133728,25716,PNS
34,,DOUB,C39,O40,no,N,34,,133728,25716,PNS
35,,SING,C39,N41,no,N,35,,133728,25716,PNS
36,,SING,N41,C42,no,N,36,,133728,25716,PNS
37,,SING,N41,H41,no,N,37,,133728,25716,PNS
38,,SING,C42,C43,no,N,38,,133728,25716,PNS
39,,SING,C42,H422,no,N,39,,133728,25716,PNS
40,,SING,C42,H421,no,N,40,,133728,25716,PNS
41,,SING,C43,S44,no,N,41,,133728,25716,PNS
42,,SING,C43,H431,no,N,42,,133728,25716,PNS
43,,SING,C43,H432,no,N,43,,133728,25716,PNS
44,,SING,S44,H44,no,N,44,,133728,25716,PNS
1,,SING,C50,N48,yes,N,1,,133747,25717,4EM
2,,DOUB,C50,C51,yes,N,2,,133747,25717,4EM
3,,SING,N48,C47,yes,N,3,,133747,25717,4EM
4,,SING,C51,C49,yes,N,4,,133747,25717,4EM
5,,DOUB,C47,C49,yes,N,5,,133747,25717,4EM
6,,SING,C47,C45,no,N,6,,133747,25717,4EM
7,,DOUB,O25,P24,no,N,7,,133747,25717,4EM
8,,SING,C45,N44,no,N,8,,133747,25717,4EM
9,,DOUB,C45,O46,no,N,9,,133747,25717,4EM
10,,SING,N44,C43,no,N,10,,133747,25717,4EM
11,,SING,P24,O27,no,N,11,,133747,25717,4EM
12,,SING,P24,O26,no,N,12,,133747,25717,4EM
13,,SING,C43,C42,no,N,13,,133747,25717,4EM
14,,SING,O27,C28,no,N,14,,133747,25717,4EM
15,,SING,C30,C29,no,N,15,,133747,25717,4EM
16,,DOUB,O35,C34,no,N,16,,133747,25717,4EM
17,,SING,C28,C29,no,N,17,,133747,25717,4EM
18,,SING,C42,N41,no,N,18,,133747,25717,4EM
19,,SING,C29,C32,no,N,19,,133747,25717,4EM
20,,SING,C29,C31,no,N,20,,133747,25717,4EM
21,,SING,C32,C34,no,N,21,,133747,25717,4EM
22,,SING,C32,O33,no,N,22,,133747,25717,4EM
23,,SING,N41,C39,no,N,23,,133747,25717,4EM
24,,SING,C34,N36,no,N,24,,133747,25717,4EM
25,,SING,N36,C37,no,N,25,,133747,25717,4EM
26,,SING,C39,C38,no,N,26,,133747,25717,4EM
27,,DOUB,C39,O40,no,N,27,,133747,25717,4EM
28,,SING,C37,C38,no,N,28,,133747,25717,4EM
29,,SING,O26,H26,no,N,29,,133747,25717,4EM
30,,SING,C28,H281,no,N,30,,133747,25717,4EM
31,,SING,C28,H283,no,N,31,,133747,25717,4EM
32,,SING,C30,H303,no,N,32,,133747,25717,4EM
33,,SING,C30,H301,no,N,33,,133747,25717,4EM
34,,SING,C30,H302,no,N,34,,133747,25717,4EM
35,,SING,C31,H312,no,N,35,,133747,25717,4EM
36,,SING,C31,H313,no,N,36,,133747,25717,4EM
37,,SING,C31,H311,no,N,37,,133747,25717,4EM
38,,SING,C32,H32,no,N,38,,133747,25717,4EM
39,,SING,O33,H33,no,N,39,,133747,25717,4EM
40,,SING,N36,H36,no,N,40,,133747,25717,4EM
41,,SING,C37,H373,no,N,41,,133747,25717,4EM
42,,SING,C37,H372,no,N,42,,133747,25717,4EM
43,,SING,C38,H382,no,N,43,,133747,25717,4EM
44,,SING,C38,H383,no,N,44,,133747,25717,4EM
45,,SING,N41,H41,no,N,45,,133747,25717,4EM
46,,SING,C42,H423,no,N,46,,133747,25717,4EM
47,,SING,C42,H422,no,N,47,,133747,25717,4EM
48,,SING,C43,H433,no,N,48,,133747,25717,4EM
49,,SING,C43,H432,no,N,49,,133747,25717,4EM
50,,SING,N44,H44,no,N,50,,133747,25717,4EM
51,,SING,C49,H49,no,N,51,,133747,25717,4EM
52,,SING,C51,H51,no,N,52,,133747,25717,4EM
53,,SING,C50,H50,no,N,53,,133747,25717,4EM
54,,SING,N48,H48,no,N,54,,133747,25717,4EM
55,,SING,P24,O24,no,N,55,,133747,25717,4EM
56,,SING,O24,H24,no,N,56,,133747,25717,4EM
1,,DOUB,O1P,P,no,N,1,,133856,25723,4EN
2,,SING,P,O2P,no,N,2,,133856,25723,4EN
3,,SING,P,O5',no,N,3,,133856,25723,4EN
4,,SING,C5',O5',no,N,4,,133856,25723,4EN
5,,SING,C5',C4',no,N,5,,133856,25723,4EN
6,,SING,C4',O4',no,N,6,,133856,25723,4EN
7,,SING,C4',C3',no,N,7,,133856,25723,4EN
8,,SING,O4',C1',no,N,8,,133856,25723,4EN
9,,SING,C3',O3',no,N,9,,133856,25723,4EN
10,,SING,C3',C2',no,N,10,,133856,25723,4EN
11,,SING,C2',C1',no,N,11,,133856,25723,4EN
12,,SING,C1',N8,no,N,12,,133856,25723,4EN
13,,SING,N9,N8,yes,N,13,,133856,25723,4EN
14,,DOUB,N9,C4,yes,N,14,,133856,25723,4EN
15,,SING,N8,C7,yes,N,15,,133856,25723,4EN
16,,SING,N3,C4,yes,N,16,,133856,25723,4EN
17,,DOUB,N3,C2,yes,N,17,,133856,25723,4EN
18,,SING,C4,C5,yes,N,18,,133856,25723,4EN
19,,DOUB,C7,C5,yes,N,19,,133856,25723,4EN
20,,SING,C5,C6,yes,N,20,,133856,25723,4EN
21,,SING,C2,N1,yes,N,21,,133856,25723,4EN
22,,DOUB,N1,C6,yes,N,22,,133856,25723,4EN
23,,SING,C6,N6,no,N,23,,133856,25723,4EN
24,,SING,O2P,HOP2,no,N,24,,133856,25723,4EN
25,,SING,C5',H5'2,no,N,25,,133856,25723,4EN
26,,SING,C5',H5'1,no,N,26,,133856,25723,4EN
27,,SING,C4',H4',no,N,27,,133856,25723,4EN
28,,SING,C3',H3',no,N,28,,133856,25723,4EN
29,,SING,C2',H2'1,no,N,29,,133856,25723,4EN
30,,SING,C2',H2'2,no,N,30,,133856,25723,4EN
31,,SING,O3',HO3',no,N,31,,133856,25723,4EN
32,,SING,C1',H1',no,N,32,,133856,25723,4EN
33,,SING,C7,H7,no,N,33,,133856,25723,4EN
34,,SING,N6,H61,no,N,34,,133856,25723,4EN
35,,SING,N6,H62,no,N,35,,133856,25723,4EN
36,,SING,C2,H2,no,N,36,,133856,25723,4EN
37,,SING,P,OP3,no,N,37,,133856,25723,4EN
38,,SING,OP3,HOP3,no,N,38,,133856,25723,4EN
1,,SING,N,CA,no,N,1,,133934,25727,HSM
2,,SING,N,H1,no,N,2,,133934,25727,HSM
3,,SING,N,H2,no,N,3,,133934,25727,HSM
4,,SING,CA,CB,no,N,4,,133934,25727,HSM
5,,SING,CA,HA1,no,N,5,,133934,25727,HSM
6,,SING,CA,HA2,no,N,6,,133934,25727,HSM
7,,SING,CB,CG,no,N,7,,133934,25727,HSM
8,,SING,CB,HB1,no,N,8,,133934,25727,HSM
9,,SING,CB,HB2,no,N,9,,133934,25727,HSM
10,,SING,CG,ND1,yes,N,10,,133934,25727,HSM
11,,DOUB,CG,CD2,yes,N,11,,133934,25727,HSM
12,,DOUB,ND1,CE1,yes,N,12,,133934,25727,HSM
13,,SING,CD2,NE2,yes,N,13,,133934,25727,HSM
14,,SING,CD2,HD2,no,N,14,,133934,25727,HSM
15,,SING,CE1,NE2,yes,N,15,,133934,25727,HSM
16,,SING,CE1,HE1,no,N,16,,133934,25727,HSM
17,,SING,NE2,HE2,no,N,17,,133934,25727,HSM
1,,SING,N,CA,no,N,1,,134109,25737,DVA
2,,SING,N,H,no,N,2,,134109,25737,DVA
3,,SING,N,H2,no,N,3,,134109,25737,DVA
4,,SING,CA,CB,no,N,4,,134109,25737,DVA
5,,SING,CA,C,no,N,5,,134109,25737,DVA
6,,SING,CA,HA,no,N,6,,134109,25737,DVA
7,,SING,CB,CG1,no,N,7,,134109,25737,DVA
8,,SING,CB,CG2,no,N,8,,134109,25737,DVA
9,,SING,CB,HB,no,N,9,,134109,25737,DVA
10,,SING,CG1,HG11,no,N,10,,134109,25737,DVA
11,,SING,CG1,HG12,no,N,11,,134109,25737,DVA
12,,SING,CG1,HG13,no,N,12,,134109,25737,DVA
13,,SING,CG2,HG21,no,N,13,,134109,25737,DVA
14,,SING,CG2,HG22,no,N,14,,134109,25737,DVA
15,,SING,CG2,HG23,no,N,15,,134109,25737,DVA
16,,DOUB,C,O,no,N,16,,134109,25737,DVA
17,,SING,C,OXT,no,N,17,,134109,25737,DVA
18,,SING,OXT,HXT,no,N,18,,134109,25737,DVA
1,,SING,CG,NZ,no,N,1,,134110,25737,4FO
2,,SING,CG,CB,no,N,2,,134110,25737,4FO
3,,SING,N,CA,no,N,3,,134110,25737,4FO
4,,SING,CA,CB,no,N,4,,134110,25737,4FO
5,,SING,CA,C,no,N,5,,134110,25737,4FO
6,,DOUB,C,O,no,N,6,,134110,25737,4FO
7,,SING,C,OXT,no,N,7,,134110,25737,4FO
8,,SING,N,H,no,N,8,,134110,25737,4FO
9,,SING,N,H1,no,N,9,,134110,25737,4FO
10,,SING,CA,HA,no,N,10,,134110,25737,4FO
11,,SING,CB,HB2,no,N,11,,134110,25737,4FO
12,,SING,CB,HB3,no,N,12,,134110,25737,4FO
13,,SING,CG,HG3,no,N,13,,134110,25737,4FO
14,,SING,CG,HG2,no,N,14,,134110,25737,4FO
15,,SING,NZ,HZ3,no,N,15,,134110,25737,4FO
16,,SING,NZ,HZ2,no,N,16,,134110,25737,4FO
17,,SING,OXT,HXT,no,N,17,,134110,25737,4FO
1,,SING,N,CA,no,N,1,,134111,25737,DSN
2,,SING,N,H,no,N,2,,134111,25737,DSN
3,,SING,N,H2,no,N,3,,134111,25737,DSN
4,,SING,CA,C,no,N,4,,134111,25737,DSN
5,,SING,CA,CB,no,N,5,,134111,25737,DSN
6,,SING,CA,HA,no,N,6,,134111,25737,DSN
7,,DOUB,C,O,no,N,7,,134111,25737,DSN
8,,SING,C,OXT,no,N,8,,134111,25737,DSN
9,,SING,OXT,HXT,no,N,9,,134111,25737,DSN
10,,SING,CB,OG,no,N,10,,134111,25737,DSN
11,,SING,CB,HB2,no,N,11,,134111,25737,DSN
12,,SING,CB,HB3,no,N,12,,134111,25737,DSN
13,,SING,OG,HG,no,N,13,,134111,25737,DSN
1,,SING,N,CA,no,N,1,,134112,25737,DTR
2,,SING,N,H,no,N,2,,134112,25737,DTR
3,,SING,N,HN2,no,N,3,,134112,25737,DTR
4,,SING,CA,CB,no,N,4,,134112,25737,DTR
5,,SING,CA,C,no,N,5,,134112,25737,DTR
6,,SING,CA,HA,no,N,6,,134112,25737,DTR
7,,SING,CB,CG,no,N,7,,134112,25737,DTR
8,,SING,CB,HB2,no,N,8,,134112,25737,DTR
9,,SING,CB,HB3,no,N,9,,134112,25737,DTR
10,,DOUB,CG,CD1,yes,N,10,,134112,25737,DTR
11,,SING,CG,CD2,yes,N,11,,134112,25737,DTR
12,,SING,CD1,NE1,yes,N,12,,134112,25737,DTR
13,,SING,CD1,HD1,no,N,13,,134112,25737,DTR
14,,SING,NE1,CE2,yes,N,14,,134112,25737,DTR
15,,SING,NE1,HE1,no,N,15,,134112,25737,DTR
16,,DOUB,CE2,CZ2,yes,N,16,,134112,25737,DTR
17,,SING,CE2,CD2,yes,N,17,,134112,25737,DTR
18,,SING,CZ2,CH2,yes,N,18,,134112,25737,DTR
19,,SING,CZ2,HZ2,no,N,19,,134112,25737,DTR
20,,DOUB,CH2,CZ3,yes,N,20,,134112,25737,DTR
21,,SING,CH2,HH2,no,N,21,,134112,25737,DTR
22,,SING,CZ3,CE3,yes,N,22,,134112,25737,DTR
23,,SING,CZ3,HZ3,no,N,23,,134112,25737,DTR
24,,DOUB,CE3,CD2,yes,N,24,,134112,25737,DTR
25,,SING,CE3,HE3,no,N,25,,134112,25737,DTR
26,,DOUB,C,O,no,N,26,,134112,25737,DTR
27,,SING,C,OXT,no,N,27,,134112,25737,DTR
28,,SING,OXT,HXT,no,N,28,,134112,25737,DTR
1,,SING,N,CA,no,N,1,,134113,25737,DAB
2,,SING,N,H,no,N,2,,134113,25737,DAB
3,,SING,N,H2,no,N,3,,134113,25737,DAB
4,,SING,CA,C,no,N,4,,134113,25737,DAB
5,,SING,CA,CB,no,N,5,,134113,25737,DAB
6,,SING,CA,HA,no,N,6,,134113,25737,DAB
7,,DOUB,C,O,no,N,7,,134113,25737,DAB
8,,SING,C,OXT,no,N,8,,134113,25737,DAB
9,,SING,CB,CG,no,N,9,,134113,25737,DAB
10,,SING,CB,HB2,no,N,10,,134113,25737,DAB
11,,SING,CB,HB3,no,N,11,,134113,25737,DAB
12,,SING,CG,ND,no,N,12,,134113,25737,DAB
13,,SING,CG,HG2,no,N,13,,134113,25737,DAB
14,,SING,CG,HG3,no,N,14,,134113,25737,DAB
15,,SING,ND,HD1,no,N,15,,134113,25737,DAB
16,,SING,ND,HD2,no,N,16,,134113,25737,DAB
17,,SING,OXT,HXT,no,N,17,,134113,25737,DAB
1,,SING,CG2,CB,no,N,1,,134114,25737,28J
2,,SING,CB,CG1,no,N,2,,134114,25737,28J
3,,SING,CB,CA,no,N,3,,134114,25737,28J
4,,SING,CG1,CD1,no,N,4,,134114,25737,28J
5,,SING,CA,N,no,N,5,,134114,25737,28J
6,,SING,CA,C,no,N,6,,134114,25737,28J
7,,DOUB,C,O,no,N,7,,134114,25737,28J
8,,SING,N,H20,no,N,8,,134114,25737,28J
9,,SING,CA,H21,no,N,9,,134114,25737,28J
10,,SING,CB,H22,no,N,10,,134114,25737,28J
11,,SING,CG2,H23,no,N,11,,134114,25737,28J
12,,SING,CG2,H24,no,N,12,,134114,25737,28J
13,,SING,CG2,H25,no,N,13,,134114,25737,28J
14,,SING,CG1,H26,no,N,14,,134114,25737,28J
15,,SING,CG1,H27,no,N,15,,134114,25737,28J
16,,SING,CD1,H28,no,N,16,,134114,25737,28J
17,,SING,CD1,H29,no,N,17,,134114,25737,28J
18,,SING,CD1,H30,no,N,18,,134114,25737,28J
19,,SING,N,H2,no,N,19,,134114,25737,28J
20,,SING,C,OXT,no,N,20,,134114,25737,28J
21,,SING,OXT,HXT,no,N,21,,134114,25737,28J
1,,DOUB,RE,O12,no,N,1,,134130,25738,REO
2,,DOUB,RE,O13,no,N,2,,134130,25738,REO
3,,DOUB,RE,O14,no,N,3,,134130,25738,REO
4,,SING,RE,O15,no,N,4,,134130,25738,REO
1,,DOUB,RE,O12,no,N,1,,134148,25739,REO
2,,DOUB,RE,O13,no,N,2,,134148,25739,REO
3,,DOUB,RE,O14,no,N,3,,134148,25739,REO
4,,SING,RE,O15,no,N,4,,134148,25739,REO
1,,SING,N,CA,no,N,1,,134197,25741,DVA
2,,SING,N,H,no,N,2,,134197,25741,DVA
3,,SING,N,H2,no,N,3,,134197,25741,DVA
4,,SING,CA,CB,no,N,4,,134197,25741,DVA
5,,SING,CA,C,no,N,5,,134197,25741,DVA
6,,SING,CA,HA,no,N,6,,134197,25741,DVA
7,,SING,CB,CG1,no,N,7,,134197,25741,DVA
8,,SING,CB,CG2,no,N,8,,134197,25741,DVA
9,,SING,CB,HB,no,N,9,,134197,25741,DVA
10,,SING,CG1,HG11,no,N,10,,134197,25741,DVA
11,,SING,CG1,HG12,no,N,11,,134197,25741,DVA
12,,SING,CG1,HG13,no,N,12,,134197,25741,DVA
13,,SING,CG2,HG21,no,N,13,,134197,25741,DVA
14,,SING,CG2,HG22,no,N,14,,134197,25741,DVA
15,,SING,CG2,HG23,no,N,15,,134197,25741,DVA
16,,DOUB,C,O,no,N,16,,134197,25741,DVA
17,,SING,C,OXT,no,N,17,,134197,25741,DVA
18,,SING,OXT,HXT,no,N,18,,134197,25741,DVA
1,,SING,CG,NZ,no,N,1,,134198,25741,4FO
2,,SING,CG,CB,no,N,2,,134198,25741,4FO
3,,SING,N,CA,no,N,3,,134198,25741,4FO
4,,SING,CA,CB,no,N,4,,134198,25741,4FO
5,,SING,CA,C,no,N,5,,134198,25741,4FO
6,,DOUB,C,O,no,N,6,,134198,25741,4FO
7,,SING,C,OXT,no,N,7,,134198,25741,4FO
8,,SING,N,H,no,N,8,,134198,25741,4FO
9,,SING,N,H1,no,N,9,,134198,25741,4FO
10,,SING,CA,HA,no,N,10,,134198,25741,4FO
11,,SING,CB,HB2,no,N,11,,134198,25741,4FO
12,,SING,CB,HB3,no,N,12,,134198,25741,4FO
13,,SING,CG,HG3,no,N,13,,134198,25741,4FO
14,,SING,CG,HG2,no,N,14,,134198,25741,4FO
15,,SING,NZ,HZ3,no,N,15,,134198,25741,4FO
16,,SING,NZ,HZ2,no,N,16,,134198,25741,4FO
17,,SING,OXT,HXT,no,N,17,,134198,25741,4FO
1,,SING,N,CA,no,N,1,,134199,25741,DSN
2,,SING,N,H,no,N,2,,134199,25741,DSN
3,,SING,N,H2,no,N,3,,134199,25741,DSN
4,,SING,CA,C,no,N,4,,134199,25741,DSN
5,,SING,CA,CB,no,N,5,,134199,25741,DSN
6,,SING,CA,HA,no,N,6,,134199,25741,DSN
7,,DOUB,C,O,no,N,7,,134199,25741,DSN
8,,SING,C,OXT,no,N,8,,134199,25741,DSN
9,,SING,OXT,HXT,no,N,9,,134199,25741,DSN
10,,SING,CB,OG,no,N,10,,134199,25741,DSN
11,,SING,CB,HB2,no,N,11,,134199,25741,DSN
12,,SING,CB,HB3,no,N,12,,134199,25741,DSN
13,,SING,OG,HG,no,N,13,,134199,25741,DSN
1,,SING,N,CA,no,N,1,,134200,25741,DTR
2,,SING,N,H,no,N,2,,134200,25741,DTR
3,,SING,N,HN2,no,N,3,,134200,25741,DTR
4,,SING,CA,CB,no,N,4,,134200,25741,DTR
5,,SING,CA,C,no,N,5,,134200,25741,DTR
6,,SING,CA,HA,no,N,6,,134200,25741,DTR
7,,SING,CB,CG,no,N,7,,134200,25741,DTR
8,,SING,CB,HB2,no,N,8,,134200,25741,DTR
9,,SING,CB,HB3,no,N,9,,134200,25741,DTR
10,,DOUB,CG,CD1,yes,N,10,,134200,25741,DTR
11,,SING,CG,CD2,yes,N,11,,134200,25741,DTR
12,,SING,CD1,NE1,yes,N,12,,134200,25741,DTR
13,,SING,CD1,HD1,no,N,13,,134200,25741,DTR
14,,SING,NE1,CE2,yes,N,14,,134200,25741,DTR
15,,SING,NE1,HE1,no,N,15,,134200,25741,DTR
16,,DOUB,CE2,CZ2,yes,N,16,,134200,25741,DTR
17,,SING,CE2,CD2,yes,N,17,,134200,25741,DTR
18,,SING,CZ2,CH2,yes,N,18,,134200,25741,DTR
19,,SING,CZ2,HZ2,no,N,19,,134200,25741,DTR
20,,DOUB,CH2,CZ3,yes,N,20,,134200,25741,DTR
21,,SING,CH2,HH2,no,N,21,,134200,25741,DTR
22,,SING,CZ3,CE3,yes,N,22,,134200,25741,DTR
23,,SING,CZ3,HZ3,no,N,23,,134200,25741,DTR
24,,DOUB,CE3,CD2,yes,N,24,,134200,25741,DTR
25,,SING,CE3,HE3,no,N,25,,134200,25741,DTR
26,,DOUB,C,O,no,N,26,,134200,25741,DTR
27,,SING,C,OXT,no,N,27,,134200,25741,DTR
28,,SING,OXT,HXT,no,N,28,,134200,25741,DTR
1,,SING,N,CA,no,N,1,,134201,25741,DAB
2,,SING,N,H,no,N,2,,134201,25741,DAB
3,,SING,N,H2,no,N,3,,134201,25741,DAB
4,,SING,CA,C,no,N,4,,134201,25741,DAB
5,,SING,CA,CB,no,N,5,,134201,25741,DAB
6,,SING,CA,HA,no,N,6,,134201,25741,DAB
7,,DOUB,C,O,no,N,7,,134201,25741,DAB
8,,SING,C,OXT,no,N,8,,134201,25741,DAB
9,,SING,CB,CG,no,N,9,,134201,25741,DAB
10,,SING,CB,HB2,no,N,10,,134201,25741,DAB
11,,SING,CB,HB3,no,N,11,,134201,25741,DAB
12,,SING,CG,ND,no,N,12,,134201,25741,DAB
13,,SING,CG,HG2,no,N,13,,134201,25741,DAB
14,,SING,CG,HG3,no,N,14,,134201,25741,DAB
15,,SING,ND,HD1,no,N,15,,134201,25741,DAB
16,,SING,ND,HD2,no,N,16,,134201,25741,DAB
17,,SING,OXT,HXT,no,N,17,,134201,25741,DAB
1,,SING,CG2,CB,no,N,1,,134202,25741,28J
2,,SING,CB,CG1,no,N,2,,134202,25741,28J
3,,SING,CB,CA,no,N,3,,134202,25741,28J
4,,SING,CG1,CD1,no,N,4,,134202,25741,28J
5,,SING,CA,N,no,N,5,,134202,25741,28J
6,,SING,CA,C,no,N,6,,134202,25741,28J
7,,DOUB,C,O,no,N,7,,134202,25741,28J
8,,SING,N,H20,no,N,8,,134202,25741,28J
9,,SING,CA,H21,no,N,9,,134202,25741,28J
10,,SING,CB,H22,no,N,10,,134202,25741,28J
11,,SING,CG2,H23,no,N,11,,134202,25741,28J
12,,SING,CG2,H24,no,N,12,,134202,25741,28J
13,,SING,CG2,H25,no,N,13,,134202,25741,28J
14,,SING,CG1,H26,no,N,14,,134202,25741,28J
15,,SING,CG1,H27,no,N,15,,134202,25741,28J
16,,SING,CD1,H28,no,N,16,,134202,25741,28J
17,,SING,CD1,H29,no,N,17,,134202,25741,28J
18,,SING,CD1,H30,no,N,18,,134202,25741,28J
19,,SING,N,H2,no,N,19,,134202,25741,28J
20,,SING,C,OXT,no,N,20,,134202,25741,28J
21,,SING,OXT,HXT,no,N,21,,134202,25741,28J
1,,DOUB,C1,O1,no,N,1,,134320,25749,PTL
2,,SING,C1,C2,no,N,2,,134320,25749,PTL
3,,SING,C1,H1,no,N,3,,134320,25749,PTL
4,,SING,C2,C3,no,N,4,,134320,25749,PTL
5,,SING,C2,H21,no,N,5,,134320,25749,PTL
6,,SING,C2,H22,no,N,6,,134320,25749,PTL
7,,SING,C3,C4,no,N,7,,134320,25749,PTL
8,,SING,C3,H31,no,N,8,,134320,25749,PTL
9,,SING,C3,H32,no,N,9,,134320,25749,PTL
10,,SING,C4,C5,no,N,10,,134320,25749,PTL
11,,SING,C4,H41,no,N,11,,134320,25749,PTL
12,,SING,C4,H42,no,N,12,,134320,25749,PTL
13,,SING,C5,H51,no,N,13,,134320,25749,PTL
14,,SING,C5,H52,no,N,14,,134320,25749,PTL
15,,SING,C5,H53,no,N,15,,134320,25749,PTL
1,,SING,OP3,P,no,N,1,,134512,25759,DN
2,,SING,OP3,HOP3,no,N,2,,134512,25759,DN
3,,DOUB,P,OP1,no,N,3,,134512,25759,DN
4,,SING,P,OP2,no,N,4,,134512,25759,DN
5,,SING,P,O5',no,N,5,,134512,25759,DN
6,,SING,OP2,HOP2,no,N,6,,134512,25759,DN
7,,SING,O5',C5',no,N,7,,134512,25759,DN
8,,SING,C5',C4',no,N,8,,134512,25759,DN
9,,SING,C5',H5',no,N,9,,134512,25759,DN
10,,SING,C5',H5'',no,N,10,,134512,25759,DN
11,,SING,C4',O4',no,N,11,,134512,25759,DN
12,,SING,C4',C3',no,N,12,,134512,25759,DN
13,,SING,C4',H4',no,N,13,,134512,25759,DN
14,,SING,O4',C1',no,N,14,,134512,25759,DN
15,,SING,C3',O3',no,N,15,,134512,25759,DN
16,,SING,C3',C2',no,N,16,,134512,25759,DN
17,,SING,C3',H3',no,N,17,,134512,25759,DN
18,,SING,O3',HO3',no,N,18,,134512,25759,DN
19,,SING,C2',H2'2,no,N,19,,134512,25759,DN
20,,SING,C2',C1',no,N,20,,134512,25759,DN
21,,SING,C2',H2',no,N,21,,134512,25759,DN
22,,SING,C1',H1',no,N,22,,134512,25759,DN
23,,SING,C1',H1'2,no,N,23,,134512,25759,DN
1,,DOUB,C1,C2,yes,N,1,,134513,25759,QUE
2,,SING,C1,C6,yes,N,2,,134513,25759,QUE
3,,SING,C1,H1,no,N,3,,134513,25759,QUE
4,,SING,C2,C3,yes,N,4,,134513,25759,QUE
5,,SING,C2,O30,no,N,5,,134513,25759,QUE
6,,DOUB,C3,C4,yes,N,6,,134513,25759,QUE
7,,SING,C3,C9,yes,N,7,,134513,25759,QUE
8,,SING,C4,C5,yes,N,8,,134513,25759,QUE
9,,SING,C4,O12,yes,N,9,,134513,25759,QUE
10,,DOUB,C5,C6,yes,N,10,,134513,25759,QUE
11,,SING,C5,H5,no,N,11,,134513,25759,QUE
12,,SING,C6,O29,no,N,12,,134513,25759,QUE
13,,SING,C9,C10,yes,N,13,,134513,25759,QUE
14,,DOUB,C9,O13,no,N,14,,134513,25759,QUE
15,,DOUB,C10,C11,yes,N,15,,134513,25759,QUE
16,,SING,C10,O27,no,N,16,,134513,25759,QUE
17,,SING,C11,C14,yes,N,17,,134513,25759,QUE
18,,SING,C11,O12,yes,N,18,,134513,25759,QUE
19,,DOUB,C14,C15,yes,N,19,,134513,25759,QUE
20,,SING,C14,C19,yes,N,20,,134513,25759,QUE
21,,SING,C15,C16,yes,N,21,,134513,25759,QUE
22,,SING,C15,H15,no,N,22,,134513,25759,QUE
23,,DOUB,C16,C17,yes,N,23,,134513,25759,QUE
24,,SING,C16,H16,no,N,24,,134513,25759,QUE
25,,SING,C17,C18,yes,N,25,,134513,25759,QUE
26,,SING,C17,O24,no,N,26,,134513,25759,QUE
27,,DOUB,C18,C19,yes,N,27,,134513,25759,QUE
28,,SING,C18,O23,no,N,28,,134513,25759,QUE
29,,SING,C19,H19,no,N,29,,134513,25759,QUE
30,,SING,O23,HO3,no,N,30,,134513,25759,QUE
31,,SING,O24,HO4,no,N,31,,134513,25759,QUE
32,,SING,O27,HO7,no,N,32,,134513,25759,QUE
33,,SING,O29,HO9,no,N,33,,134513,25759,QUE
34,,SING,O30,HO0,no,N,34,,134513,25759,QUE
1,,DOUB,C,O,no,N,1,,134597,25764,ACE
2,,SING,C,CH3,no,N,2,,134597,25764,ACE
3,,SING,C,H,no,N,3,,134597,25764,ACE
4,,SING,CH3,H1,no,N,4,,134597,25764,ACE
5,,SING,CH3,H2,no,N,5,,134597,25764,ACE
6,,SING,CH3,H3,no,N,6,,134597,25764,ACE
1,,SING,N,CA,no,N,1,,134598,25764,DPR
2,,SING,N,CD,no,N,2,,134598,25764,DPR
3,,SING,N,H,no,N,3,,134598,25764,DPR
4,,SING,CA,CB,no,N,4,,134598,25764,DPR
5,,SING,CA,C,no,N,5,,134598,25764,DPR
6,,SING,CA,HA,no,N,6,,134598,25764,DPR
7,,SING,CB,CG,no,N,7,,134598,25764,DPR
8,,SING,CB,HB2,no,N,8,,134598,25764,DPR
9,,SING,CB,HB3,no,N,9,,134598,25764,DPR
10,,SING,CG,CD,no,N,10,,134598,25764,DPR
11,,SING,CG,HG2,no,N,11,,134598,25764,DPR
12,,SING,CG,HG3,no,N,12,,134598,25764,DPR
13,,SING,CD,HD2,no,N,13,,134598,25764,DPR
14,,SING,CD,HD3,no,N,14,,134598,25764,DPR
15,,DOUB,C,O,no,N,15,,134598,25764,DPR
16,,SING,C,OXT,no,N,16,,134598,25764,DPR
17,,SING,OXT,HXT,no,N,17,,134598,25764,DPR
1,,SING,NAC,CAE,no,N,1,,134599,25764,4G6
2,,SING,CAE,CAF,no,N,2,,134599,25764,4G6
3,,SING,NAD,CAF,no,N,3,,134599,25764,4G6
4,,SING,CAF,CAA,no,N,4,,134599,25764,4G6
5,,SING,CAF,CAB,no,N,5,,134599,25764,4G6
6,,SING,CAA,HAC,no,N,6,,134599,25764,4G6
7,,SING,CAA,HAB,no,N,7,,134599,25764,4G6
8,,SING,CAA,HAA,no,N,8,,134599,25764,4G6
9,,SING,CAB,HAF,no,N,9,,134599,25764,4G6
10,,SING,CAB,HAD,no,N,10,,134599,25764,4G6
11,,SING,CAB,HAE,no,N,11,,134599,25764,4G6
12,,SING,NAD,HAL,no,N,12,,134599,25764,4G6
13,,SING,NAD,H1,no,N,13,,134599,25764,4G6
14,,SING,CAE,HAH,no,N,14,,134599,25764,4G6
15,,SING,CAE,HAG,no,N,15,,134599,25764,4G6
16,,SING,NAC,HAI,no,N,16,,134599,25764,4G6
17,,SING,NAC,H3,no,N,17,,134599,25764,4G6
1,,SING,N,HN1,no,N,1,,134614,25765,NH2
2,,SING,N,HN2,no,N,2,,134614,25765,NH2
1,,SING,C11,C9,no,N,1,,134615,25765,4FU
2,,SING,C11,C12,no,N,2,,134615,25765,4FU
3,,SING,C9,C8,no,N,3,,134615,25765,4FU
4,,SING,C12,C13,no,N,4,,134615,25765,4FU
5,,DOUB,OAB,C15,no,N,5,,134615,25765,4FU
6,,SING,C8,C7,no,N,6,,134615,25765,4FU
7,,SING,C8,C14,no,N,7,,134615,25765,4FU
8,,DOUB,C7,O7,no,N,8,,134615,25765,4FU
9,,SING,C15,C14,no,N,9,,134615,25765,4FU
10,,SING,C13,C14,no,N,10,,134615,25765,4FU
11,,SING,C7,O1,no,N,11,,134615,25765,4FU
12,,SING,C8,H8,no,N,12,,134615,25765,4FU
13,,SING,C9,H9,no,N,13,,134615,25765,4FU
14,,SING,C9,HAI,no,N,14,,134615,25765,4FU
15,,SING,C11,H112,no,N,15,,134615,25765,4FU
16,,SING,C11,H111,no,N,16,,134615,25765,4FU
17,,SING,C12,HAG,no,N,17,,134615,25765,4FU
18,,SING,C12,H12,no,N,18,,134615,25765,4FU
19,,SING,C13,HAL,no,N,19,,134615,25765,4FU
20,,SING,C13,HAK,no,N,20,,134615,25765,4FU
21,,SING,C14,H14,no,N,21,,134615,25765,4FU
22,,SING,C15,O2,no,N,22,,134615,25765,4FU
23,,SING,O1,H1,no,N,23,,134615,25765,4FU
24,,SING,O2,H2,no,N,24,,134615,25765,4FU
1,,SING,O,H1,no,N,1,,134633,25766,HOH
2,,SING,O,H2,no,N,2,,134633,25766,HOH
1,,SING,O5',C5',no,N,1,,134832,25777,ADN
2,,SING,O5',HO5',no,N,2,,134832,25777,ADN
3,,SING,C5',C4',no,N,3,,134832,25777,ADN
4,,SING,C5',H5'1,no,N,4,,134832,25777,ADN
5,,SING,C5',H5'2,no,N,5,,134832,25777,ADN
6,,SING,C4',O4',no,N,6,,134832,25777,ADN
7,,SING,C4',C3',no,N,7,,134832,25777,ADN
8,,SING,C4',H4',no,N,8,,134832,25777,ADN
9,,SING,O4',C1',no,N,9,,134832,25777,ADN
10,,SING,C3',O3',no,N,10,,134832,25777,ADN
11,,SING,C3',C2',no,N,11,,134832,25777,ADN
12,,SING,C3',H3',no,N,12,,134832,25777,ADN
13,,SING,O3',HO3',no,N,13,,134832,25777,ADN
14,,SING,C2',O2',no,N,14,,134832,25777,ADN
15,,SING,C2',C1',no,N,15,,134832,25777,ADN
16,,SING,C2',H2',no,N,16,,134832,25777,ADN
17,,SING,O2',HO2',no,N,17,,134832,25777,ADN
18,,SING,C1',N9,no,N,18,,134832,25777,ADN
19,,SING,C1',H1',no,N,19,,134832,25777,ADN
20,,SING,N9,C8,yes,N,20,,134832,25777,ADN
21,,SING,N9,C4,yes,N,21,,134832,25777,ADN
22,,DOUB,C8,N7,yes,N,22,,134832,25777,ADN
23,,SING,C8,H8,no,N,23,,134832,25777,ADN
24,,SING,N7,C5,yes,N,24,,134832,25777,ADN
25,,SING,C5,C6,yes,N,25,,134832,25777,ADN
26,,DOUB,C5,C4,yes,N,26,,134832,25777,ADN
27,,SING,C6,N6,no,N,27,,134832,25777,ADN
28,,DOUB,C6,N1,yes,N,28,,134832,25777,ADN
29,,SING,N6,HN61,no,N,29,,134832,25777,ADN
30,,SING,N6,HN62,no,N,30,,134832,25777,ADN
31,,SING,N1,C2,yes,N,31,,134832,25777,ADN
32,,DOUB,C2,N3,yes,N,32,,134832,25777,ADN
33,,SING,C2,H2,no,N,33,,134832,25777,ADN
34,,SING,N3,C4,yes,N,34,,134832,25777,ADN
1,,SING,SU,CT,no,N,1,,134996,25786,4HH
2,,SING,CB,CA,no,N,2,,134996,25786,4HH
3,,SING,CB,OG,no,N,3,,134996,25786,4HH
4,,SING,CL1,CK,no,N,4,,134996,25786,4HH
5,,SING,CT,CS,no,N,5,,134996,25786,4HH
6,,SING,CA,N,no,N,6,,134996,25786,4HH
7,,SING,CA,C,no,N,7,,134996,25786,4HH
8,,DOUB,O2P,P,no,N,8,,134996,25786,4HH
9,,DOUB,O,C,no,N,9,,134996,25786,4HH
10,,SING,CS,NR,no,N,10,,134996,25786,4HH
11,,SING,O3P,P,no,N,11,,134996,25786,4HH
12,,SING,O3P,CJ,no,N,12,,134996,25786,4HH
13,,SING,OG,P,no,N,13,,134996,25786,4HH
14,,SING,P,O1P,no,N,14,,134996,25786,4HH
15,,SING,CK,CL2,no,N,15,,134996,25786,4HH
16,,SING,CK,CJ,no,N,16,,134996,25786,4HH
17,,SING,CK,CM,no,N,17,,134996,25786,4HH
18,,SING,CP,CQ,no,N,18,,134996,25786,4HH
19,,SING,CP,CO,no,N,19,,134996,25786,4HH
20,,SING,NN,CL3,no,N,20,,134996,25786,4HH
21,,SING,NN,CO,no,N,21,,134996,25786,4HH
22,,SING,NR,CQ,no,N,22,,134996,25786,4HH
23,,SING,CL3,CM,no,N,23,,134996,25786,4HH
24,,DOUB,CL3,ON,no,N,24,,134996,25786,4HH
25,,DOUB,CQ,OR,no,N,25,,134996,25786,4HH
26,,SING,CM,OM,no,N,26,,134996,25786,4HH
27,,SING,CA,HA,no,N,27,,134996,25786,4HH
28,,SING,N,H,no,N,28,,134996,25786,4HH
29,,SING,N,H2,no,N,29,,134996,25786,4HH
30,,SING,CB,HB3,no,N,30,,134996,25786,4HH
31,,SING,CB,HB2,no,N,31,,134996,25786,4HH
32,,SING,CJ,HJ3,no,N,32,,134996,25786,4HH
33,,SING,CJ,HJ2,no,N,33,,134996,25786,4HH
34,,SING,CL1,HL13,no,N,34,,134996,25786,4HH
35,,SING,CL1,HL12,no,N,35,,134996,25786,4HH
36,,SING,CL1,HL11,no,N,36,,134996,25786,4HH
37,,SING,CL2,HL21,no,N,37,,134996,25786,4HH
38,,SING,CL2,HL23,no,N,38,,134996,25786,4HH
39,,SING,CL2,HL22,no,N,39,,134996,25786,4HH
40,,SING,CM,HL3,no,N,40,,134996,25786,4HH
41,,SING,OM,HM,no,N,41,,134996,25786,4HH
42,,SING,NN,HN,no,N,42,,134996,25786,4HH
43,,SING,O1P,H4,no,N,43,,134996,25786,4HH
44,,SING,CO,HO2,no,N,44,,134996,25786,4HH
45,,SING,CO,HO3,no,N,45,,134996,25786,4HH
46,,SING,CP,HP3,no,N,46,,134996,25786,4HH
47,,SING,CP,HP2,no,N,47,,134996,25786,4HH
48,,SING,CS,HS2,no,N,48,,134996,25786,4HH
49,,SING,CS,HS3,no,N,49,,134996,25786,4HH
50,,SING,CT,HT3,no,N,50,,134996,25786,4HH
51,,SING,CT,HT2,no,N,51,,134996,25786,4HH
52,,SING,NR,HR,no,N,52,,134996,25786,4HH
53,,SING,SU,HU,no,N,53,,134996,25786,4HH
54,,SING,C,OXT,no,N,54,,134996,25786,4HH
55,,SING,OXT,HXT,no,N,55,,134996,25786,4HH
1,,DOUB,O1P,P,no,N,1,,135015,25787,4HJ
2,,DOUB,ON,CM,no,N,2,,135015,25787,4HJ
3,,SING,NN,CM,no,N,3,,135015,25787,4HJ
4,,SING,NN,CO,no,N,4,,135015,25787,4HJ
5,,SING,CM,CL3,no,N,5,,135015,25787,4HJ
6,,DOUB,C,O,no,N,6,,135015,25787,4HJ
7,,SING,C,CA,no,N,7,,135015,25787,4HJ
8,,SING,CP,CO,no,N,8,,135015,25787,4HJ
9,,SING,CP,CQ,no,N,9,,135015,25787,4HJ
10,,SING,OG,P,no,N,10,,135015,25787,4HJ
11,,SING,OG,CB,no,N,11,,135015,25787,4HJ
12,,SING,P,O2P,no,N,12,,135015,25787,4HJ
13,,SING,P,O3P,no,N,13,,135015,25787,4HJ
14,,SING,CJ,O3P,no,N,14,,135015,25787,4HJ
15,,SING,CJ,CK,no,N,15,,135015,25787,4HJ
16,,DOUB,OR,CQ,no,N,16,,135015,25787,4HJ
17,,SING,CL3,OM,no,N,17,,135015,25787,4HJ
18,,SING,CL3,CK,no,N,18,,135015,25787,4HJ
19,,SING,N,CA,no,N,19,,135015,25787,4HJ
20,,SING,CQ,NR,no,N,20,,135015,25787,4HJ
21,,SING,CA,CB,no,N,21,,135015,25787,4HJ
22,,SING,CK,CL2,no,N,22,,135015,25787,4HJ
23,,SING,CK,CL1,no,N,23,,135015,25787,4HJ
24,,SING,NR,CS,no,N,24,,135015,25787,4HJ
25,,SING,CS,CT,no,N,25,,135015,25787,4HJ
26,,SING,CT,SU,no,N,26,,135015,25787,4HJ
27,,DOUB,CAA,CZ2,yes,N,27,,135015,25787,4HJ
28,,SING,CAA,CZ1,yes,N,28,,135015,25787,4HJ
29,,SING,CZ2,CY2,yes,N,29,,135015,25787,4HJ
30,,DOUB,CZ1,CY1,yes,N,30,,135015,25787,4HJ
31,,DOUB,CY2,CX,yes,N,31,,135015,25787,4HJ
32,,SING,CY1,CX,yes,N,32,,135015,25787,4HJ
33,,SING,CY1,OZ,no,N,33,,135015,25787,4HJ
34,,SING,CX,CV,no,N,34,,135015,25787,4HJ
35,,SING,SU,CV,no,N,35,,135015,25787,4HJ
36,,DOUB,CV,OW,no,N,36,,135015,25787,4HJ
37,,SING,N,H,no,N,37,,135015,25787,4HJ
38,,SING,N,H1,no,N,38,,135015,25787,4HJ
39,,SING,CA,HA,no,N,39,,135015,25787,4HJ
40,,SING,CAA,HAA,no,N,40,,135015,25787,4HJ
41,,SING,CB,HB3,no,N,41,,135015,25787,4HJ
42,,SING,CB,HB2,no,N,42,,135015,25787,4HJ
43,,SING,CZ1,HZ1,no,N,43,,135015,25787,4HJ
44,,SING,CZ2,HZ2,no,N,44,,135015,25787,4HJ
45,,SING,OZ,HZ,no,N,45,,135015,25787,4HJ
46,,SING,CJ,HJ2,no,N,46,,135015,25787,4HJ
47,,SING,CJ,HJ3,no,N,47,,135015,25787,4HJ
48,,SING,CL1,HL12,no,N,48,,135015,25787,4HJ
49,,SING,CL1,HL11,no,N,49,,135015,25787,4HJ
50,,SING,CL1,HL13,no,N,50,,135015,25787,4HJ
51,,SING,CL2,HL22,no,N,51,,135015,25787,4HJ
52,,SING,CL2,HL21,no,N,52,,135015,25787,4HJ
53,,SING,CL2,HL23,no,N,53,,135015,25787,4HJ
54,,SING,OM,HM,no,N,54,,135015,25787,4HJ
55,,SING,NN,HN,no,N,55,,135015,25787,4HJ
56,,SING,O2P,H4,no,N,56,,135015,25787,4HJ
57,,SING,CL3,HL3,no,N,57,,135015,25787,4HJ
58,,SING,CO,HO2,no,N,58,,135015,25787,4HJ
59,,SING,CO,HO3,no,N,59,,135015,25787,4HJ
60,,SING,CP,HP2,no,N,60,,135015,25787,4HJ
61,,SING,CP,HP3,no,N,61,,135015,25787,4HJ
62,,SING,CS,HS2,no,N,62,,135015,25787,4HJ
63,,SING,CS,HS3,no,N,63,,135015,25787,4HJ
64,,SING,CT,HT3,no,N,64,,135015,25787,4HJ
65,,SING,CT,HT2,no,N,65,,135015,25787,4HJ
66,,SING,CY2,HY2,no,N,66,,135015,25787,4HJ
67,,SING,NR,HR,no,N,67,,135015,25787,4HJ
68,,SING,C,OXT,no,N,68,,135015,25787,4HJ
69,,SING,OXT,HXT,no,N,69,,135015,25787,4HJ
1,,SING,N3,CA3,no,N,1,,135247,25799,0D8
2,,SING,N3,H3,no,N,2,,135247,25799,0D8
3,,SING,CA3,C7,no,N,3,,135247,25799,0D8
4,,SING,CA3,HA21,no,N,4,,135247,25799,0D8
5,,SING,CA3,HA3,no,N,5,,135247,25799,0D8
6,,SING,C8,H14,no,N,6,,135247,25799,0D8
7,,SING,C8,H24,no,N,7,,135247,25799,0D8
8,,SING,C7,C8,no,N,8,,135247,25799,0D8
9,,SING,C7,H89,no,N,9,,135247,25799,0D8
10,,SING,C7,H99,no,N,10,,135247,25799,0D8
11,,SING,OH,C8,no,N,11,,135247,25799,0D8
12,,SING,OH,H2,no,N,12,,135247,25799,0D8
13,,SING,N3,H1,no,N,13,,135247,25799,0D8
1,,SING,C1,C2,no,N,1,,135248,25799,NAG
2,,SING,C1,O1,no,N,2,,135248,25799,NAG
3,,SING,C1,O5,no,N,3,,135248,25799,NAG
4,,SING,C1,H1,no,N,4,,135248,25799,NAG
5,,SING,C2,C3,no,N,5,,135248,25799,NAG
6,,SING,C2,N2,no,N,6,,135248,25799,NAG
7,,SING,C2,H2,no,N,7,,135248,25799,NAG
8,,SING,C3,C4,no,N,8,,135248,25799,NAG
9,,SING,C3,O3,no,N,9,,135248,25799,NAG
10,,SING,C3,H3,no,N,10,,135248,25799,NAG
11,,SING,C4,C5,no,N,11,,135248,25799,NAG
12,,SING,C4,O4,no,N,12,,135248,25799,NAG
13,,SING,C4,H4,no,N,13,,135248,25799,NAG
14,,SING,C5,C6,no,N,14,,135248,25799,NAG
15,,SING,C5,O5,no,N,15,,135248,25799,NAG
16,,SING,C5,H5,no,N,16,,135248,25799,NAG
17,,SING,C6,O6,no,N,17,,135248,25799,NAG
18,,SING,C6,H61,no,N,18,,135248,25799,NAG
19,,SING,C6,H62,no,N,19,,135248,25799,NAG
20,,SING,C7,C8,no,N,20,,135248,25799,NAG
21,,SING,C7,N2,no,N,21,,135248,25799,NAG
22,,DOUB,C7,O7,no,N,22,,135248,25799,NAG
23,,SING,C8,H81,no,N,23,,135248,25799,NAG
24,,SING,C8,H82,no,N,24,,135248,25799,NAG
25,,SING,C8,H83,no,N,25,,135248,25799,NAG
26,,SING,N2,HN2,no,N,26,,135248,25799,NAG
27,,SING,O1,HO1,no,N,27,,135248,25799,NAG
28,,SING,O3,HO3,no,N,28,,135248,25799,NAG
29,,SING,O4,HO4,no,N,29,,135248,25799,NAG
30,,SING,O6,HO6,no,N,30,,135248,25799,NAG
1,,SING,C1,C2,no,N,1,,135249,25799,FUC
2,,SING,C1,O1,no,N,2,,135249,25799,FUC
3,,SING,C1,O5,no,N,3,,135249,25799,FUC
4,,SING,C1,H1,no,N,4,,135249,25799,FUC
5,,SING,C2,C3,no,N,5,,135249,25799,FUC
6,,SING,C2,O2,no,N,6,,135249,25799,FUC
7,,SING,C2,H2,no,N,7,,135249,25799,FUC
8,,SING,C3,C4,no,N,8,,135249,25799,FUC
9,,SING,C3,O3,no,N,9,,135249,25799,FUC
10,,SING,C3,H3,no,N,10,,135249,25799,FUC
11,,SING,C4,C5,no,N,11,,135249,25799,FUC
12,,SING,C4,O4,no,N,12,,135249,25799,FUC
13,,SING,C4,H4,no,N,13,,135249,25799,FUC
14,,SING,C5,C6,no,N,14,,135249,25799,FUC
15,,SING,C5,O5,no,N,15,,135249,25799,FUC
16,,SING,C5,H5,no,N,16,,135249,25799,FUC
17,,SING,C6,H61,no,N,17,,135249,25799,FUC
18,,SING,C6,H62,no,N,18,,135249,25799,FUC
19,,SING,C6,H63,no,N,19,,135249,25799,FUC
20,,SING,O1,HO1,no,N,20,,135249,25799,FUC
21,,SING,O2,HO2,no,N,21,,135249,25799,FUC
22,,SING,O3,HO3,no,N,22,,135249,25799,FUC
23,,SING,O4,HO4,no,N,23,,135249,25799,FUC
1,,SING,C1,C2,no,N,1,,135250,25799,G6S
2,,SING,C1,O1,no,N,2,,135250,25799,G6S
3,,SING,C1,O5,no,N,3,,135250,25799,G6S
4,,SING,C2,C3,no,N,4,,135250,25799,G6S
5,,SING,C2,O2,no,N,5,,135250,25799,G6S
6,,SING,C3,C4,no,N,6,,135250,25799,G6S
7,,SING,C3,O3,no,N,7,,135250,25799,G6S
8,,SING,C4,C5,no,N,8,,135250,25799,G6S
9,,SING,C4,O4,no,N,9,,135250,25799,G6S
10,,SING,C5,C6,no,N,10,,135250,25799,G6S
11,,SING,C5,O5,no,N,11,,135250,25799,G6S
12,,SING,C6,O6,no,N,12,,135250,25799,G6S
13,,SING,O6,S,no,N,13,,135250,25799,G6S
14,,DOUB,S,O7,no,N,14,,135250,25799,G6S
15,,DOUB,S,O8,no,N,15,,135250,25799,G6S
16,,SING,S,O9,no,N,16,,135250,25799,G6S
17,,SING,C1,H1,no,N,17,,135250,25799,G6S
18,,SING,C2,H2,no,N,18,,135250,25799,G6S
19,,SING,C3,H3,no,N,19,,135250,25799,G6S
20,,SING,C4,H4,no,N,20,,135250,25799,G6S
21,,SING,C5,H5,no,N,21,,135250,25799,G6S
22,,SING,C6,H6,no,N,22,,135250,25799,G6S
23,,SING,C6,H6A,no,N,23,,135250,25799,G6S
24,,SING,O2,HO2,no,N,24,,135250,25799,G6S
25,,SING,O4,HO4,no,N,25,,135250,25799,G6S
26,,SING,O3,HO3,no,N,26,,135250,25799,G6S
27,,SING,O1,HO1,no,N,27,,135250,25799,G6S
28,,SING,O9,HO9,no,N,28,,135250,25799,G6S
1,,SING,C1,C2,no,N,1,,135251,25799,SIA
2,,DOUB,C1,O1A,no,N,2,,135251,25799,SIA
3,,SING,C1,O1B,no,N,3,,135251,25799,SIA
4,,SING,C2,C3,no,N,4,,135251,25799,SIA
5,,SING,C2,O2,no,N,5,,135251,25799,SIA
6,,SING,C2,O6,no,N,6,,135251,25799,SIA
7,,SING,C3,C4,no,N,7,,135251,25799,SIA
8,,SING,C3,H31,no,N,8,,135251,25799,SIA
9,,SING,C3,H32,no,N,9,,135251,25799,SIA
10,,SING,C4,C5,no,N,10,,135251,25799,SIA
11,,SING,C4,O4,no,N,11,,135251,25799,SIA
12,,SING,C4,H4,no,N,12,,135251,25799,SIA
13,,SING,C5,C6,no,N,13,,135251,25799,SIA
14,,SING,C5,N5,no,N,14,,135251,25799,SIA
15,,SING,C5,H5,no,N,15,,135251,25799,SIA
16,,SING,C6,C7,no,N,16,,135251,25799,SIA
17,,SING,C6,O6,no,N,17,,135251,25799,SIA
18,,SING,C6,H6,no,N,18,,135251,25799,SIA
19,,SING,C7,C8,no,N,19,,135251,25799,SIA
20,,SING,C7,O7,no,N,20,,135251,25799,SIA
21,,SING,C7,H7,no,N,21,,135251,25799,SIA
22,,SING,C8,C9,no,N,22,,135251,25799,SIA
23,,SING,C8,O8,no,N,23,,135251,25799,SIA
24,,SING,C8,H8,no,N,24,,135251,25799,SIA
25,,SING,C9,O9,no,N,25,,135251,25799,SIA
26,,SING,C9,H91,no,N,26,,135251,25799,SIA
27,,SING,C9,H92,no,N,27,,135251,25799,SIA
28,,SING,C10,C11,no,N,28,,135251,25799,SIA
29,,SING,C10,N5,no,N,29,,135251,25799,SIA
30,,DOUB,C10,O10,no,N,30,,135251,25799,SIA
31,,SING,C11,H111,no,N,31,,135251,25799,SIA
32,,SING,C11,H112,no,N,32,,135251,25799,SIA
33,,SING,C11,H113,no,N,33,,135251,25799,SIA
34,,SING,N5,HN5,no,N,34,,135251,25799,SIA
35,,SING,O1B,HOB1,no,N,35,,135251,25799,SIA
36,,SING,O2,HO2,no,N,36,,135251,25799,SIA
37,,SING,O4,HO4,no,N,37,,135251,25799,SIA
38,,SING,O7,HO7,no,N,38,,135251,25799,SIA
39,,SING,O8,HO8,no,N,39,,135251,25799,SIA
40,,SING,O9,HO9,no,N,40,,135251,25799,SIA
1,,SING,N,CA,no,N,1,,135492,25810,4J4
2,,SING,CA,C,no,N,2,,135492,25810,4J4
3,,SING,CA,CB,no,N,3,,135492,25810,4J4
4,,DOUB,C,O,no,N,4,,135492,25810,4J4
5,,SING,CB,SG,no,N,5,,135492,25810,4J4
6,,SING,CAP,CAQ,no,N,6,,135492,25810,4J4
7,,SING,CAP,NAO,no,N,7,,135492,25810,4J4
8,,DOUB,CAQ,CAR,yes,N,8,,135492,25810,4J4
9,,SING,CAQ,CAG,yes,N,9,,135492,25810,4J4
10,,SING,CAS,CAR,yes,N,10,,135492,25810,4J4
11,,DOUB,CAS,CAI,yes,N,11,,135492,25810,4J4
12,,SING,CAM,CAN,no,N,12,,135492,25810,4J4
13,,SING,CAM,SG,no,N,13,,135492,25810,4J4
14,,DOUB,CAL,CAD,yes,N,14,,135492,25810,4J4
15,,SING,CAL,CAK,yes,N,15,,135492,25810,4J4
16,,DOUB,CAN,OAF,no,N,16,,135492,25810,4J4
17,,SING,CAN,NAO,no,N,17,,135492,25810,4J4
18,,DOUB,CAG,CAH,yes,N,18,,135492,25810,4J4
19,,SING,CAH,CAI,yes,N,19,,135492,25810,4J4
20,,SING,CAI,CAJ,no,N,20,,135492,25810,4J4
21,,SING,CAJ,CAB,yes,N,21,,135492,25810,4J4
22,,DOUB,CAJ,CAK,yes,N,22,,135492,25810,4J4
23,,SING,CAB,FAA,no,N,23,,135492,25810,4J4
24,,DOUB,CAB,CAC,yes,N,24,,135492,25810,4J4
25,,SING,CAC,CAD,yes,N,25,,135492,25810,4J4
26,,SING,CAD,FAE,no,N,26,,135492,25810,4J4
27,,SING,N,H,no,N,27,,135492,25810,4J4
28,,SING,N,H1,no,N,28,,135492,25810,4J4
29,,SING,CA,HA,no,N,29,,135492,25810,4J4
30,,SING,CB,HB1,no,N,30,,135492,25810,4J4
31,,SING,CB,HB2,no,N,31,,135492,25810,4J4
32,,SING,CAP,HAP,no,N,32,,135492,25810,4J4
33,,SING,CAP,HAQ,no,N,33,,135492,25810,4J4
34,,SING,CAS,HAS,no,N,34,,135492,25810,4J4
35,,SING,CAR,HAR,no,N,35,,135492,25810,4J4
36,,SING,CAM,HAM,no,N,36,,135492,25810,4J4
37,,SING,CAM,HAN,no,N,37,,135492,25810,4J4
38,,SING,CAL,HAL,no,N,38,,135492,25810,4J4
39,,SING,NAO,HAO,no,N,39,,135492,25810,4J4
40,,SING,CAG,HAG,no,N,40,,135492,25810,4J4
41,,SING,CAH,HAH,no,N,41,,135492,25810,4J4
42,,SING,CAC,HAC,no,N,42,,135492,25810,4J4
43,,SING,CAK,HAK,no,N,43,,135492,25810,4J4
44,,SING,C,OXT,no,N,44,,135492,25810,4J4
45,,SING,OXT,HXT,no,N,45,,135492,25810,4J4
1,,SING,N,CA,no,N,1,,135539,25813,NLE
2,,SING,N,H,no,N,2,,135539,25813,NLE
3,,SING,N,HN2,no,N,3,,135539,25813,NLE
4,,SING,CA,C,no,N,4,,135539,25813,NLE
5,,SING,CA,CB,no,N,5,,135539,25813,NLE
6,,SING,CA,HA,no,N,6,,135539,25813,NLE
7,,DOUB,C,O,no,N,7,,135539,25813,NLE
8,,SING,C,OXT,no,N,8,,135539,25813,NLE
9,,SING,OXT,HXT,no,N,9,,135539,25813,NLE
10,,SING,CB,CG,no,N,10,,135539,25813,NLE
11,,SING,CB,HB2,no,N,11,,135539,25813,NLE
12,,SING,CB,HB3,no,N,12,,135539,25813,NLE
13,,SING,CG,CD,no,N,13,,135539,25813,NLE
14,,SING,CG,HG2,no,N,14,,135539,25813,NLE
15,,SING,CG,HG3,no,N,15,,135539,25813,NLE
16,,SING,CD,CE,no,N,16,,135539,25813,NLE
17,,SING,CD,HD2,no,N,17,,135539,25813,NLE
18,,SING,CD,HD3,no,N,18,,135539,25813,NLE
19,,SING,CE,HE1,no,N,19,,135539,25813,NLE
20,,SING,CE,HE2,no,N,20,,135539,25813,NLE
21,,SING,CE,HE3,no,N,21,,135539,25813,NLE
1,,SING,N,HN1,no,N,1,,135540,25813,NH2
2,,SING,N,HN2,no,N,2,,135540,25813,NH2
1,,DOUB,C,O,no,N,1,,135541,25813,ACE
2,,SING,C,CH3,no,N,2,,135541,25813,ACE
3,,SING,C,H,no,N,3,,135541,25813,ACE
4,,SING,CH3,H1,no,N,4,,135541,25813,ACE
5,,SING,CH3,H2,no,N,5,,135541,25813,ACE
6,,SING,CH3,H3,no,N,6,,135541,25813,ACE
1,,SING,N,CA,no,N,1,,135556,25814,NLE
2,,SING,N,H,no,N,2,,135556,25814,NLE
3,,SING,N,HN2,no,N,3,,135556,25814,NLE
4,,SING,CA,C,no,N,4,,135556,25814,NLE
5,,SING,CA,CB,no,N,5,,135556,25814,NLE
6,,SING,CA,HA,no,N,6,,135556,25814,NLE
7,,DOUB,C,O,no,N,7,,135556,25814,NLE
8,,SING,C,OXT,no,N,8,,135556,25814,NLE
9,,SING,OXT,HXT,no,N,9,,135556,25814,NLE
10,,SING,CB,CG,no,N,10,,135556,25814,NLE
11,,SING,CB,HB2,no,N,11,,135556,25814,NLE
12,,SING,CB,HB3,no,N,12,,135556,25814,NLE
13,,SING,CG,CD,no,N,13,,135556,25814,NLE
14,,SING,CG,HG2,no,N,14,,135556,25814,NLE
15,,SING,CG,HG3,no,N,15,,135556,25814,NLE
16,,SING,CD,CE,no,N,16,,135556,25814,NLE
17,,SING,CD,HD2,no,N,17,,135556,25814,NLE
18,,SING,CD,HD3,no,N,18,,135556,25814,NLE
19,,SING,CE,HE1,no,N,19,,135556,25814,NLE
20,,SING,CE,HE2,no,N,20,,135556,25814,NLE
21,,SING,CE,HE3,no,N,21,,135556,25814,NLE
1,,SING,N,CA,no,N,1,,135557,25814,4J2
2,,SING,CA,CB,no,N,2,,135557,25814,4J2
3,,SING,CA,C,no,N,3,,135557,25814,4J2
4,,SING,CB,CG,no,N,4,,135557,25814,4J2
5,,DOUB,CG,CD1,yes,N,5,,135557,25814,4J2
6,,SING,CG,CD2,yes,N,6,,135557,25814,4J2
7,,SING,CD1,CE1,yes,N,7,,135557,25814,4J2
8,,DOUB,CD2,CE2,yes,N,8,,135557,25814,4J2
9,,DOUB,CE1,CZ1,yes,N,9,,135557,25814,4J2
10,,SING,CE1,HE1,no,N,10,,135557,25814,4J2
11,,SING,CZ1,CZ2,yes,N,11,,135557,25814,4J2
12,,SING,CZ1,CE2,yes,N,12,,135557,25814,4J2
13,,DOUB,CZ2,CZ3,yes,N,13,,135557,25814,4J2
14,,SING,CZ3,CE4,yes,N,14,,135557,25814,4J2
15,,SING,CE2,CE3,yes,N,15,,135557,25814,4J2
16,,DOUB,CE3,CE4,yes,N,16,,135557,25814,4J2
17,,SING,CE3,HE3,no,N,17,,135557,25814,4J2
18,,SING,CE4,HE4,no,N,18,,135557,25814,4J2
19,,DOUB,C,O,no,N,19,,135557,25814,4J2
20,,SING,N,H,no,N,20,,135557,25814,4J2
21,,SING,N,H1,no,N,21,,135557,25814,4J2
22,,SING,CA,HA,no,N,22,,135557,25814,4J2
23,,SING,CB,HB2,no,N,23,,135557,25814,4J2
24,,SING,CB,HB1,no,N,24,,135557,25814,4J2
25,,SING,CD1,HD1,no,N,25,,135557,25814,4J2
26,,SING,CD2,HD2,no,N,26,,135557,25814,4J2
27,,SING,CZ2,HZ2,no,N,27,,135557,25814,4J2
28,,SING,CZ3,HZ23,no,N,28,,135557,25814,4J2
29,,SING,C,OXT,no,N,29,,135557,25814,4J2
30,,SING,OXT,HXT,no,N,30,,135557,25814,4J2
1,,SING,N,HN1,no,N,1,,135558,25814,NH2
2,,SING,N,HN2,no,N,2,,135558,25814,NH2
1,,DOUB,C,O,no,N,1,,135559,25814,ACE
2,,SING,C,CH3,no,N,2,,135559,25814,ACE
3,,SING,C,H,no,N,3,,135559,25814,ACE
4,,SING,CH3,H1,no,N,4,,135559,25814,ACE
5,,SING,CH3,H2,no,N,5,,135559,25814,ACE
6,,SING,CH3,H3,no,N,6,,135559,25814,ACE
1,,SING,N,CA,no,N,1,,135631,25820,NLE
2,,SING,N,H,no,N,2,,135631,25820,NLE
3,,SING,N,HN2,no,N,3,,135631,25820,NLE
4,,SING,CA,C,no,N,4,,135631,25820,NLE
5,,SING,CA,CB,no,N,5,,135631,25820,NLE
6,,SING,CA,HA,no,N,6,,135631,25820,NLE
7,,DOUB,C,O,no,N,7,,135631,25820,NLE
8,,SING,C,OXT,no,N,8,,135631,25820,NLE
9,,SING,OXT,HXT,no,N,9,,135631,25820,NLE
10,,SING,CB,CG,no,N,10,,135631,25820,NLE
11,,SING,CB,HB2,no,N,11,,135631,25820,NLE
12,,SING,CB,HB3,no,N,12,,135631,25820,NLE
13,,SING,CG,CD,no,N,13,,135631,25820,NLE
14,,SING,CG,HG2,no,N,14,,135631,25820,NLE
15,,SING,CG,HG3,no,N,15,,135631,25820,NLE
16,,SING,CD,CE,no,N,16,,135631,25820,NLE
17,,SING,CD,HD2,no,N,17,,135631,25820,NLE
18,,SING,CD,HD3,no,N,18,,135631,25820,NLE
19,,SING,CE,HE1,no,N,19,,135631,25820,NLE
20,,SING,CE,HE2,no,N,20,,135631,25820,NLE
21,,SING,CE,HE3,no,N,21,,135631,25820,NLE
1,,SING,N,CA,no,N,1,,135632,25820,4J2
2,,SING,CA,CB,no,N,2,,135632,25820,4J2
3,,SING,CA,C,no,N,3,,135632,25820,4J2
4,,SING,CB,CG,no,N,4,,135632,25820,4J2
5,,DOUB,CG,CD1,yes,N,5,,135632,25820,4J2
6,,SING,CG,CD2,yes,N,6,,135632,25820,4J2
7,,SING,CD1,CE1,yes,N,7,,135632,25820,4J2
8,,DOUB,CD2,CE2,yes,N,8,,135632,25820,4J2
9,,DOUB,CE1,CZ1,yes,N,9,,135632,25820,4J2
10,,SING,CE1,HE1,no,N,10,,135632,25820,4J2
11,,SING,CZ1,CZ2,yes,N,11,,135632,25820,4J2
12,,SING,CZ1,CE2,yes,N,12,,135632,25820,4J2
13,,DOUB,CZ2,CZ3,yes,N,13,,135632,25820,4J2
14,,SING,CZ3,CE4,yes,N,14,,135632,25820,4J2
15,,SING,CE2,CE3,yes,N,15,,135632,25820,4J2
16,,DOUB,CE3,CE4,yes,N,16,,135632,25820,4J2
17,,SING,CE3,HE3,no,N,17,,135632,25820,4J2
18,,SING,CE4,HE4,no,N,18,,135632,25820,4J2
19,,DOUB,C,O,no,N,19,,135632,25820,4J2
20,,SING,N,H,no,N,20,,135632,25820,4J2
21,,SING,N,H1,no,N,21,,135632,25820,4J2
22,,SING,CA,HA,no,N,22,,135632,25820,4J2
23,,SING,CB,HB2,no,N,23,,135632,25820,4J2
24,,SING,CB,HB1,no,N,24,,135632,25820,4J2
25,,SING,CD1,HD1,no,N,25,,135632,25820,4J2
26,,SING,CD2,HD2,no,N,26,,135632,25820,4J2
27,,SING,CZ2,HZ2,no,N,27,,135632,25820,4J2
28,,SING,CZ3,HZ23,no,N,28,,135632,25820,4J2
29,,SING,C,OXT,no,N,29,,135632,25820,4J2
30,,SING,OXT,HXT,no,N,30,,135632,25820,4J2
1,,SING,N,HN1,no,N,1,,135633,25820,NH2
2,,SING,N,HN2,no,N,2,,135633,25820,NH2
1,,DOUB,C,O,no,N,1,,135634,25820,ACE
2,,SING,C,CH3,no,N,2,,135634,25820,ACE
3,,SING,C,H,no,N,3,,135634,25820,ACE
4,,SING,CH3,H1,no,N,4,,135634,25820,ACE
5,,SING,CH3,H2,no,N,5,,135634,25820,ACE
6,,SING,CH3,H3,no,N,6,,135634,25820,ACE
1,,SING,O3P,P,no,N,1,,135972,25840,CFL
2,,SING,O3P,HO3P,no,N,2,,135972,25840,CFL
3,,SING,P,O1P,no,N,3,,135972,25840,CFL
4,,DOUB,P,O2P,no,N,4,,135972,25840,CFL
5,,SING,P,O5',no,N,5,,135972,25840,CFL
6,,SING,O1P,HO1P,no,N,6,,135972,25840,CFL
7,,SING,O5',C5',no,N,7,,135972,25840,CFL
8,,SING,C5',C4',no,N,8,,135972,25840,CFL
9,,SING,C5',H5'1,no,N,9,,135972,25840,CFL
10,,SING,C5',H5'2,no,N,10,,135972,25840,CFL
11,,SING,C4',O4',no,N,11,,135972,25840,CFL
12,,SING,C4',C3',no,N,12,,135972,25840,CFL
13,,SING,C4',H4',no,N,13,,135972,25840,CFL
14,,SING,O4',C1',no,N,14,,135972,25840,CFL
15,,SING,C3',O3',no,N,15,,135972,25840,CFL
16,,SING,C3',C2',no,N,16,,135972,25840,CFL
17,,SING,C3',H3',no,N,17,,135972,25840,CFL
18,,SING,O3',HO3',no,N,18,,135972,25840,CFL
19,,SING,C2',C1',no,N,19,,135972,25840,CFL
20,,SING,C2',F,no,N,20,,135972,25840,CFL
21,,SING,C2',H2',no,N,21,,135972,25840,CFL
22,,SING,C1',N1,no,N,22,,135972,25840,CFL
23,,SING,C1',H1',no,N,23,,135972,25840,CFL
24,,SING,N1,C2,no,N,24,,135972,25840,CFL
25,,SING,N1,C6,no,N,25,,135972,25840,CFL
26,,DOUB,C2,O2,no,N,26,,135972,25840,CFL
27,,SING,C2,N3,no,N,27,,135972,25840,CFL
28,,DOUB,N3,C4,no,N,28,,135972,25840,CFL
29,,SING,C4,N4,no,N,29,,135972,25840,CFL
30,,SING,C4,C5,no,N,30,,135972,25840,CFL
31,,SING,N4,HN41,no,N,31,,135972,25840,CFL
32,,SING,N4,HN42,no,N,32,,135972,25840,CFL
33,,DOUB,C5,C6,no,N,33,,135972,25840,CFL
34,,SING,C5,H5,no,N,34,,135972,25840,CFL
35,,SING,C6,H6,no,N,35,,135972,25840,CFL
1,,DOUB,O,C,no,N,1,,136011,25845,4LT
2,,SING,C,CA,no,N,2,,136011,25845,4LT
3,,SING,F,CA,no,N,3,,136011,25845,4LT
4,,SING,CA,CB,no,N,4,,136011,25845,4LT
5,,SING,C,O1,no,N,5,,136011,25845,4LT
6,,SING,CA,HA,no,N,6,,136011,25845,4LT
7,,SING,CB,HB3,no,N,7,,136011,25845,4LT
8,,SING,CB,HB2,no,N,8,,136011,25845,4LT
9,,SING,CB,HB1,no,N,9,,136011,25845,4LT
10,,SING,O1,H1,no,N,10,,136011,25845,4LT
1,,SING,N,HN1,no,N,1,,136030,25846,NH2
2,,SING,N,HN2,no,N,2,,136030,25846,NH2
1,,SING,N,CA,no,N,1,,136048,25847,HYP
2,,SING,N,CD,no,N,2,,136048,25847,HYP
3,,SING,N,H,no,N,3,,136048,25847,HYP
4,,SING,CA,C,no,N,4,,136048,25847,HYP
5,,SING,CA,CB,no,N,5,,136048,25847,HYP
6,,SING,CA,HA,no,N,6,,136048,25847,HYP
7,,DOUB,C,O,no,N,7,,136048,25847,HYP
8,,SING,C,OXT,no,N,8,,136048,25847,HYP
9,,SING,CB,CG,no,N,9,,136048,25847,HYP
10,,SING,CB,HB2,no,N,10,,136048,25847,HYP
11,,SING,CB,HB3,no,N,11,,136048,25847,HYP
12,,SING,CG,CD,no,N,12,,136048,25847,HYP
13,,SING,CG,OD1,no,N,13,,136048,25847,HYP
14,,SING,CG,HG,no,N,14,,136048,25847,HYP
15,,SING,CD,HD22,no,N,15,,136048,25847,HYP
16,,SING,CD,HD23,no,N,16,,136048,25847,HYP
17,,SING,OD1,HD1,no,N,17,,136048,25847,HYP
18,,SING,OXT,HXT,no,N,18,,136048,25847,HYP
1,,SING,N,CA,no,N,1,,136276,25859,HYP
2,,SING,N,CD,no,N,2,,136276,25859,HYP
3,,SING,N,H,no,N,3,,136276,25859,HYP
4,,SING,CA,C,no,N,4,,136276,25859,HYP
5,,SING,CA,CB,no,N,5,,136276,25859,HYP
6,,SING,CA,HA,no,N,6,,136276,25859,HYP
7,,DOUB,C,O,no,N,7,,136276,25859,HYP
8,,SING,C,OXT,no,N,8,,136276,25859,HYP
9,,SING,CB,CG,no,N,9,,136276,25859,HYP
10,,SING,CB,HB2,no,N,10,,136276,25859,HYP
11,,SING,CB,HB3,no,N,11,,136276,25859,HYP
12,,SING,CG,CD,no,N,12,,136276,25859,HYP
13,,SING,CG,OD1,no,N,13,,136276,25859,HYP
14,,SING,CG,HG,no,N,14,,136276,25859,HYP
15,,SING,CD,HD22,no,N,15,,136276,25859,HYP
16,,SING,CD,HD23,no,N,16,,136276,25859,HYP
17,,SING,OD1,HD1,no,N,17,,136276,25859,HYP
18,,SING,OXT,HXT,no,N,18,,136276,25859,HYP
1,,SING,O,H1,no,N,1,,136279,25859,HOH
2,,SING,O,H2,no,N,2,,136279,25859,HOH
1,,DOUB,PA,O1A,no,N,1,,136302,25860,NDP
2,,SING,PA,O2A,no,N,2,,136302,25860,NDP
3,,SING,PA,O5B,no,N,3,,136302,25860,NDP
4,,SING,PA,O3,no,N,4,,136302,25860,NDP
5,,SING,O2A,HOA2,no,N,5,,136302,25860,NDP
6,,SING,O5B,C5B,no,N,6,,136302,25860,NDP
7,,SING,C5B,C4B,no,N,7,,136302,25860,NDP
8,,SING,C5B,H51A,no,N,8,,136302,25860,NDP
9,,SING,C5B,H52A,no,N,9,,136302,25860,NDP
10,,SING,C4B,O4B,no,N,10,,136302,25860,NDP
11,,SING,C4B,C3B,no,N,11,,136302,25860,NDP
12,,SING,C4B,H4B,no,N,12,,136302,25860,NDP
13,,SING,O4B,C1B,no,N,13,,136302,25860,NDP
14,,SING,C3B,O3B,no,N,14,,136302,25860,NDP
15,,SING,C3B,C2B,no,N,15,,136302,25860,NDP
16,,SING,C3B,H3B,no,N,16,,136302,25860,NDP
17,,SING,O3B,HO3A,no,N,17,,136302,25860,NDP
18,,SING,C2B,O2B,no,N,18,,136302,25860,NDP
19,,SING,C2B,C1B,no,N,19,,136302,25860,NDP
20,,SING,C2B,H2B,no,N,20,,136302,25860,NDP
21,,SING,O2B,P2B,no,N,21,,136302,25860,NDP
22,,SING,C1B,N9A,no,N,22,,136302,25860,NDP
23,,SING,C1B,H1B,no,N,23,,136302,25860,NDP
24,,SING,N9A,C8A,yes,N,24,,136302,25860,NDP
25,,SING,N9A,C4A,yes,N,25,,136302,25860,NDP
26,,DOUB,C8A,N7A,yes,N,26,,136302,25860,NDP
27,,SING,C8A,H8A,no,N,27,,136302,25860,NDP
28,,SING,N7A,C5A,yes,N,28,,136302,25860,NDP
29,,SING,C5A,C6A,yes,N,29,,136302,25860,NDP
30,,DOUB,C5A,C4A,yes,N,30,,136302,25860,NDP
31,,SING,C6A,N6A,no,N,31,,136302,25860,NDP
32,,DOUB,C6A,N1A,yes,N,32,,136302,25860,NDP
33,,SING,N6A,H61A,no,N,33,,136302,25860,NDP
34,,SING,N6A,H62A,no,N,34,,136302,25860,NDP
35,,SING,N1A,C2A,yes,N,35,,136302,25860,NDP
36,,DOUB,C2A,N3A,yes,N,36,,136302,25860,NDP
37,,SING,C2A,H2A,no,N,37,,136302,25860,NDP
38,,SING,N3A,C4A,yes,N,38,,136302,25860,NDP
39,,SING,O3,PN,no,N,39,,136302,25860,NDP
40,,DOUB,PN,O1N,no,N,40,,136302,25860,NDP
41,,SING,PN,O2N,no,N,41,,136302,25860,NDP
42,,SING,PN,O5D,no,N,42,,136302,25860,NDP
43,,SING,O2N,H21N,no,N,43,,136302,25860,NDP
44,,SING,O5D,C5D,no,N,44,,136302,25860,NDP
45,,SING,C5D,C4D,no,N,45,,136302,25860,NDP
46,,SING,C5D,H51N,no,N,46,,136302,25860,NDP
47,,SING,C5D,H52N,no,N,47,,136302,25860,NDP
48,,SING,C4D,O4D,no,N,48,,136302,25860,NDP
49,,SING,C4D,C3D,no,N,49,,136302,25860,NDP
50,,SING,C4D,H4D,no,N,50,,136302,25860,NDP
51,,SING,O4D,C1D,no,N,51,,136302,25860,NDP
52,,SING,C3D,O3D,no,N,52,,136302,25860,NDP
53,,SING,C3D,C2D,no,N,53,,136302,25860,NDP
54,,SING,C3D,H3D,no,N,54,,136302,25860,NDP
55,,SING,O3D,HO3N,no,N,55,,136302,25860,NDP
56,,SING,C2D,O2D,no,N,56,,136302,25860,NDP
57,,SING,C2D,C1D,no,N,57,,136302,25860,NDP
58,,SING,C2D,H2D,no,N,58,,136302,25860,NDP
59,,SING,O2D,HO2N,no,N,59,,136302,25860,NDP
60,,SING,C1D,N1N,no,N,60,,136302,25860,NDP
61,,SING,C1D,H1D,no,N,61,,136302,25860,NDP
62,,SING,N1N,C2N,no,N,62,,136302,25860,NDP
63,,SING,N1N,C6N,no,N,63,,136302,25860,NDP
64,,DOUB,C2N,C3N,no,N,64,,136302,25860,NDP
65,,SING,C2N,H2N,no,N,65,,136302,25860,NDP
66,,SING,C3N,C7N,no,N,66,,136302,25860,NDP
67,,SING,C3N,C4N,no,N,67,,136302,25860,NDP
68,,DOUB,C7N,O7N,no,N,68,,136302,25860,NDP
69,,SING,C7N,N7N,no,N,69,,136302,25860,NDP
70,,SING,N7N,H71N,no,N,70,,136302,25860,NDP
71,,SING,N7N,H72N,no,N,71,,136302,25860,NDP
72,,SING,C4N,C5N,no,N,72,,136302,25860,NDP
73,,SING,C4N,H41N,no,N,73,,136302,25860,NDP
74,,SING,C4N,H42N,no,N,74,,136302,25860,NDP
75,,DOUB,C5N,C6N,no,N,75,,136302,25860,NDP
76,,SING,C5N,H5N,no,N,76,,136302,25860,NDP
77,,SING,C6N,H6N,no,N,77,,136302,25860,NDP
78,,DOUB,P2B,O1X,no,N,78,,136302,25860,NDP
79,,SING,P2B,O2X,no,N,79,,136302,25860,NDP
80,,SING,P2B,O3X,no,N,80,,136302,25860,NDP
81,,SING,O2X,HOP2,no,N,81,,136302,25860,NDP
82,,SING,O3X,HOP3,no,N,82,,136302,25860,NDP
1,,DOUB,C1,N2,yes,N,1,,136303,25860,TOP
2,,SING,C1,C8,yes,N,2,,136303,25860,TOP
3,,SING,C1,H1,no,N,3,,136303,25860,TOP
4,,SING,N2,C3,yes,N,4,,136303,25860,TOP
5,,SING,C3,N4,no,N,5,,136303,25860,TOP
6,,DOUB,C3,N5,yes,N,6,,136303,25860,TOP
7,,SING,N4,HN41,no,N,7,,136303,25860,TOP
8,,SING,N4,HN42,no,N,8,,136303,25860,TOP
9,,SING,N5,C6,yes,N,9,,136303,25860,TOP
10,,SING,C6,N7,no,N,10,,136303,25860,TOP
11,,DOUB,C6,C8,yes,N,11,,136303,25860,TOP
12,,SING,N7,HN71,no,N,12,,136303,25860,TOP
13,,SING,N7,HN72,no,N,13,,136303,25860,TOP
14,,SING,C8,C9,no,N,14,,136303,25860,TOP
15,,SING,C9,C10,no,N,15,,136303,25860,TOP
16,,SING,C9,H91,no,N,16,,136303,25860,TOP
17,,SING,C9,H92,no,N,17,,136303,25860,TOP
18,,DOUB,C10,C11,yes,N,18,,136303,25860,TOP
19,,SING,C10,C21,yes,N,19,,136303,25860,TOP
20,,SING,C11,C12,yes,N,20,,136303,25860,TOP
21,,SING,C11,H11,no,N,21,,136303,25860,TOP
22,,SING,C12,O13,no,N,22,,136303,25860,TOP
23,,DOUB,C12,C15,yes,N,23,,136303,25860,TOP
24,,SING,O13,C14,no,N,24,,136303,25860,TOP
25,,SING,C14,H141,no,N,25,,136303,25860,TOP
26,,SING,C14,H142,no,N,26,,136303,25860,TOP
27,,SING,C14,H143,no,N,27,,136303,25860,TOP
28,,SING,C15,O16,no,N,28,,136303,25860,TOP
29,,SING,C15,C18,yes,N,29,,136303,25860,TOP
30,,SING,O16,C17,no,N,30,,136303,25860,TOP
31,,SING,C17,H171,no,N,31,,136303,25860,TOP
32,,SING,C17,H172,no,N,32,,136303,25860,TOP
33,,SING,C17,H173,no,N,33,,136303,25860,TOP
34,,SING,C18,O19,no,N,34,,136303,25860,TOP
35,,DOUB,C18,C21,yes,N,35,,136303,25860,TOP
36,,SING,O19,C20,no,N,36,,136303,25860,TOP
37,,SING,C20,H201,no,N,37,,136303,25860,TOP
38,,SING,C20,H202,no,N,38,,136303,25860,TOP
39,,SING,C20,H203,no,N,39,,136303,25860,TOP
40,,SING,C21,H21,no,N,40,,136303,25860,TOP
1,,DOUB,PA,O1A,no,N,1,,136322,25861,NDP
2,,SING,PA,O2A,no,N,2,,136322,25861,NDP
3,,SING,PA,O5B,no,N,3,,136322,25861,NDP
4,,SING,PA,O3,no,N,4,,136322,25861,NDP
5,,SING,O2A,HOA2,no,N,5,,136322,25861,NDP
6,,SING,O5B,C5B,no,N,6,,136322,25861,NDP
7,,SING,C5B,C4B,no,N,7,,136322,25861,NDP
8,,SING,C5B,H51A,no,N,8,,136322,25861,NDP
9,,SING,C5B,H52A,no,N,9,,136322,25861,NDP
10,,SING,C4B,O4B,no,N,10,,136322,25861,NDP
11,,SING,C4B,C3B,no,N,11,,136322,25861,NDP
12,,SING,C4B,H4B,no,N,12,,136322,25861,NDP
13,,SING,O4B,C1B,no,N,13,,136322,25861,NDP
14,,SING,C3B,O3B,no,N,14,,136322,25861,NDP
15,,SING,C3B,C2B,no,N,15,,136322,25861,NDP
16,,SING,C3B,H3B,no,N,16,,136322,25861,NDP
17,,SING,O3B,HO3A,no,N,17,,136322,25861,NDP
18,,SING,C2B,O2B,no,N,18,,136322,25861,NDP
19,,SING,C2B,C1B,no,N,19,,136322,25861,NDP
20,,SING,C2B,H2B,no,N,20,,136322,25861,NDP
21,,SING,O2B,P2B,no,N,21,,136322,25861,NDP
22,,SING,C1B,N9A,no,N,22,,136322,25861,NDP
23,,SING,C1B,H1B,no,N,23,,136322,25861,NDP
24,,SING,N9A,C8A,yes,N,24,,136322,25861,NDP
25,,SING,N9A,C4A,yes,N,25,,136322,25861,NDP
26,,DOUB,C8A,N7A,yes,N,26,,136322,25861,NDP
27,,SING,C8A,H8A,no,N,27,,136322,25861,NDP
28,,SING,N7A,C5A,yes,N,28,,136322,25861,NDP
29,,SING,C5A,C6A,yes,N,29,,136322,25861,NDP
30,,DOUB,C5A,C4A,yes,N,30,,136322,25861,NDP
31,,SING,C6A,N6A,no,N,31,,136322,25861,NDP
32,,DOUB,C6A,N1A,yes,N,32,,136322,25861,NDP
33,,SING,N6A,H61A,no,N,33,,136322,25861,NDP
34,,SING,N6A,H62A,no,N,34,,136322,25861,NDP
35,,SING,N1A,C2A,yes,N,35,,136322,25861,NDP
36,,DOUB,C2A,N3A,yes,N,36,,136322,25861,NDP
37,,SING,C2A,H2A,no,N,37,,136322,25861,NDP
38,,SING,N3A,C4A,yes,N,38,,136322,25861,NDP
39,,SING,O3,PN,no,N,39,,136322,25861,NDP
40,,DOUB,PN,O1N,no,N,40,,136322,25861,NDP
41,,SING,PN,O2N,no,N,41,,136322,25861,NDP
42,,SING,PN,O5D,no,N,42,,136322,25861,NDP
43,,SING,O2N,H21N,no,N,43,,136322,25861,NDP
44,,SING,O5D,C5D,no,N,44,,136322,25861,NDP
45,,SING,C5D,C4D,no,N,45,,136322,25861,NDP
46,,SING,C5D,H51N,no,N,46,,136322,25861,NDP
7,,SING,CB,HB3,,,,,240395,6146,ABA_2
47,,SING,C5D,H52N,no,N,47,,136322,25861,NDP
48,,SING,C4D,O4D,no,N,48,,136322,25861,NDP
49,,SING,C4D,C3D,no,N,49,,136322,25861,NDP
50,,SING,C4D,H4D,no,N,50,,136322,25861,NDP
51,,SING,O4D,C1D,no,N,51,,136322,25861,NDP
52,,SING,C3D,O3D,no,N,52,,136322,25861,NDP
53,,SING,C3D,C2D,no,N,53,,136322,25861,NDP
54,,SING,C3D,H3D,no,N,54,,136322,25861,NDP
55,,SING,O3D,HO3N,no,N,55,,136322,25861,NDP
56,,SING,C2D,O2D,no,N,56,,136322,25861,NDP
57,,SING,C2D,C1D,no,N,57,,136322,25861,NDP
58,,SING,C2D,H2D,no,N,58,,136322,25861,NDP
59,,SING,O2D,HO2N,no,N,59,,136322,25861,NDP
60,,SING,C1D,N1N,no,N,60,,136322,25861,NDP
61,,SING,C1D,H1D,no,N,61,,136322,25861,NDP
62,,SING,N1N,C2N,no,N,62,,136322,25861,NDP
63,,SING,N1N,C6N,no,N,63,,136322,25861,NDP
64,,DOUB,C2N,C3N,no,N,64,,136322,25861,NDP
65,,SING,C2N,H2N,no,N,65,,136322,25861,NDP
66,,SING,C3N,C7N,no,N,66,,136322,25861,NDP
67,,SING,C3N,C4N,no,N,67,,136322,25861,NDP
68,,DOUB,C7N,O7N,no,N,68,,136322,25861,NDP
69,,SING,C7N,N7N,no,N,69,,136322,25861,NDP
70,,SING,N7N,H71N,no,N,70,,136322,25861,NDP
71,,SING,N7N,H72N,no,N,71,,136322,25861,NDP
72,,SING,C4N,C5N,no,N,72,,136322,25861,NDP
73,,SING,C4N,H41N,no,N,73,,136322,25861,NDP
74,,SING,C4N,H42N,no,N,74,,136322,25861,NDP
75,,DOUB,C5N,C6N,no,N,75,,136322,25861,NDP
76,,SING,C5N,H5N,no,N,76,,136322,25861,NDP
77,,SING,C6N,H6N,no,N,77,,136322,25861,NDP
78,,DOUB,P2B,O1X,no,N,78,,136322,25861,NDP
79,,SING,P2B,O2X,no,N,79,,136322,25861,NDP
80,,SING,P2B,O3X,no,N,80,,136322,25861,NDP
81,,SING,O2X,HOP2,no,N,81,,136322,25861,NDP
82,,SING,O3X,HOP3,no,N,82,,136322,25861,NDP
1,,SING,N,CA,no,N,1,,136376,25865,SEP
2,,SING,N,H,no,N,2,,136376,25865,SEP
3,,SING,N,H2,no,N,3,,136376,25865,SEP
4,,SING,CA,CB,no,N,4,,136376,25865,SEP
5,,SING,CA,C,no,N,5,,136376,25865,SEP
6,,SING,CA,HA,no,N,6,,136376,25865,SEP
7,,SING,CB,OG,no,N,7,,136376,25865,SEP
8,,SING,CB,HB2,no,N,8,,136376,25865,SEP
9,,SING,CB,HB3,no,N,9,,136376,25865,SEP
10,,SING,OG,P,no,N,10,,136376,25865,SEP
11,,DOUB,C,O,no,N,11,,136376,25865,SEP
12,,SING,C,OXT,no,N,12,,136376,25865,SEP
13,,SING,OXT,HXT,no,N,13,,136376,25865,SEP
14,,DOUB,P,O1P,no,N,14,,136376,25865,SEP
15,,SING,P,O2P,no,N,15,,136376,25865,SEP
16,,SING,P,O3P,no,N,16,,136376,25865,SEP
17,,SING,O2P,HOP2,no,N,17,,136376,25865,SEP
18,,SING,O3P,HOP3,no,N,18,,136376,25865,SEP
1,,SING,CHA,C1A,yes,N,1,,136547,25874,HEM
2,,DOUB,CHA,C4D,yes,N,2,,136547,25874,HEM
3,,SING,CHA,HHA,no,N,3,,136547,25874,HEM
4,,SING,CHB,C4A,yes,N,4,,136547,25874,HEM
5,,DOUB,CHB,C1B,yes,N,5,,136547,25874,HEM
6,,SING,CHB,HHB,no,N,6,,136547,25874,HEM
7,,SING,CHC,C4B,yes,N,7,,136547,25874,HEM
8,,DOUB,CHC,C1C,yes,N,8,,136547,25874,HEM
9,,SING,CHC,HHC,no,N,9,,136547,25874,HEM
10,,DOUB,CHD,C4C,yes,N,10,,136547,25874,HEM
11,,SING,CHD,C1D,yes,N,11,,136547,25874,HEM
12,,SING,CHD,HHD,no,N,12,,136547,25874,HEM
13,,DOUB,C1A,C2A,yes,N,13,,136547,25874,HEM
14,,SING,C1A,NA,yes,N,14,,136547,25874,HEM
15,,SING,C2A,C3A,yes,N,15,,136547,25874,HEM
16,,SING,C2A,CAA,no,N,16,,136547,25874,HEM
17,,DOUB,C3A,C4A,yes,N,17,,136547,25874,HEM
18,,SING,C3A,CMA,no,N,18,,136547,25874,HEM
19,,SING,C4A,NA,yes,N,19,,136547,25874,HEM
20,,SING,CMA,HMA,no,N,20,,136547,25874,HEM
21,,SING,CMA,HMAA,no,N,21,,136547,25874,HEM
22,,SING,CMA,HMAB,no,N,22,,136547,25874,HEM
23,,SING,CAA,CBA,no,N,23,,136547,25874,HEM
24,,SING,CAA,HAA,no,N,24,,136547,25874,HEM
25,,SING,CAA,HAAA,no,N,25,,136547,25874,HEM
26,,SING,CBA,CGA,no,N,26,,136547,25874,HEM
27,,SING,CBA,HBA,no,N,27,,136547,25874,HEM
28,,SING,CBA,HBAA,no,N,28,,136547,25874,HEM
29,,DOUB,CGA,O1A,no,N,29,,136547,25874,HEM
30,,SING,CGA,O2A,no,N,30,,136547,25874,HEM
31,,SING,C1B,C2B,no,N,31,,136547,25874,HEM
32,,SING,C1B,NB,yes,N,32,,136547,25874,HEM
33,,DOUB,C2B,C3B,yes,N,33,,136547,25874,HEM
34,,SING,C2B,CMB,yes,N,34,,136547,25874,HEM
35,,SING,C3B,C4B,no,N,35,,136547,25874,HEM
36,,SING,C3B,CAB,yes,N,36,,136547,25874,HEM
37,,DOUB,C4B,NB,no,N,37,,136547,25874,HEM
38,,SING,CMB,HMB,yes,N,38,,136547,25874,HEM
39,,SING,CMB,HMBA,no,N,39,,136547,25874,HEM
40,,SING,CMB,HMBB,no,N,40,,136547,25874,HEM
41,,DOUB,CAB,CBB,no,N,41,,136547,25874,HEM
42,,SING,CAB,HAB,no,N,42,,136547,25874,HEM
43,,SING,CBB,HBB,no,N,43,,136547,25874,HEM
44,,SING,CBB,HBBA,no,N,44,,136547,25874,HEM
45,,SING,C1C,C2C,no,N,45,,136547,25874,HEM
46,,SING,C1C,NC,yes,N,46,,136547,25874,HEM
47,,DOUB,C2C,C3C,yes,N,47,,136547,25874,HEM
48,,SING,C2C,CMC,yes,N,48,,136547,25874,HEM
49,,SING,C3C,C4C,no,N,49,,136547,25874,HEM
50,,SING,C3C,CAC,yes,N,50,,136547,25874,HEM
51,,SING,C4C,NC,no,N,51,,136547,25874,HEM
52,,SING,CMC,HMC,yes,N,52,,136547,25874,HEM
53,,SING,CMC,HMCA,no,N,53,,136547,25874,HEM
54,,SING,CMC,HMCB,no,N,54,,136547,25874,HEM
55,,DOUB,CAC,CBC,no,N,55,,136547,25874,HEM
56,,SING,CAC,HAC,no,N,56,,136547,25874,HEM
57,,SING,CBC,HBC,no,N,57,,136547,25874,HEM
58,,SING,CBC,HBCA,no,N,58,,136547,25874,HEM
59,,SING,C1D,C2D,no,N,59,,136547,25874,HEM
60,,DOUB,C1D,ND,yes,N,60,,136547,25874,HEM
61,,DOUB,C2D,C3D,yes,N,61,,136547,25874,HEM
62,,SING,C2D,CMD,yes,N,62,,136547,25874,HEM
63,,SING,C3D,C4D,no,N,63,,136547,25874,HEM
64,,SING,C3D,CAD,yes,N,64,,136547,25874,HEM
65,,SING,C4D,ND,no,N,65,,136547,25874,HEM
66,,SING,CMD,HMD,yes,N,66,,136547,25874,HEM
67,,SING,CMD,HMDA,no,N,67,,136547,25874,HEM
68,,SING,CMD,HMDB,no,N,68,,136547,25874,HEM
69,,SING,CAD,CBD,no,N,69,,136547,25874,HEM
70,,SING,CAD,HAD,no,N,70,,136547,25874,HEM
71,,SING,CAD,HADA,no,N,71,,136547,25874,HEM
72,,SING,CBD,CGD,no,N,72,,136547,25874,HEM
73,,SING,CBD,HBD,no,N,73,,136547,25874,HEM
74,,SING,CBD,HBDA,no,N,74,,136547,25874,HEM
75,,DOUB,CGD,O1D,no,N,75,,136547,25874,HEM
76,,SING,CGD,O2D,no,N,76,,136547,25874,HEM
77,,SING,O2A,H2A,no,N,77,,136547,25874,HEM
78,,SING,O2D,H2D,no,N,78,,136547,25874,HEM
79,,SING,FE,NA,no,N,79,,136547,25874,HEM
80,,SING,FE,NB,no,N,80,,136547,25874,HEM
81,,SING,FE,NC,no,N,81,,136547,25874,HEM
82,,SING,FE,ND,no,N,82,,136547,25874,HEM
1,,SING,O73,C68,no,N,1,,136669,25882,4JF
2,,SING,C3C,N8B,no,N,2,,136669,25882,4JF
3,,SING,C68,C63,no,N,3,,136669,25882,4JF
4,,DOUB,C68,C67,no,N,4,,136669,25882,4JF
5,,DOUB,O61,C59,no,N,5,,136669,25882,4JF
6,,SING,C63,C64,no,N,6,,136669,25882,4JF
7,,SING,N76,N75,no,N,7,,136669,25882,4JF
8,,SING,O15,C5,no,N,8,,136669,25882,4JF
9,,SING,C59,C67,no,N,9,,136669,25882,4JF
10,,SING,C59,C57,no,N,10,,136669,25882,4JF
11,,SING,N8B,C7A,no,N,11,,136669,25882,4JF
12,,SING,N8B,C9B,no,N,12,,136669,25882,4JF
13,,SING,C7C,C8A,no,N,13,,136669,25882,4JF
14,,SING,C67,C66,no,N,14,,136669,25882,4JF
15,,DOUB,C6,C5,yes,N,15,,136669,25882,4JF
16,,SING,C6,C1,yes,N,16,,136669,25882,4JF
17,,DOUB,C64,C65,no,N,17,,136669,25882,4JF
18,,SING,N75,C56,no,N,18,,136669,25882,4JF
19,,SING,C7A,C8A,no,N,19,,136669,25882,4JF
20,,SING,C7A,C6A,no,N,20,,136669,25882,4JF
21,,SING,C5,C4,yes,N,21,,136669,25882,4JF
22,,DOUB,C1,C2,yes,N,22,,136669,25882,4JF
23,,SING,O6B,C6A,no,N,23,,136669,25882,4JF
24,,SING,C8A,O5B,no,N,24,,136669,25882,4JF
25,,SING,C57,C56,no,N,25,,136669,25882,4JF
26,,SING,C57,C58,no,N,26,,136669,25882,4JF
27,,DOUB,C56,C45,no,N,27,,136669,25882,4JF
28,,SING,C66,C65,no,N,28,,136669,25882,4JF
29,,SING,C66,C60,no,N,29,,136669,25882,4JF
30,,SING,C65,O71,no,N,30,,136669,25882,4JF
31,,SING,C6A,C5A,no,N,31,,136669,25882,4JF
32,,SING,O5B,C4A,no,N,32,,136669,25882,4JF
33,,SING,C5A,C4A,no,N,33,,136669,25882,4JF
34,,DOUB,O13,C9,no,N,34,,136669,25882,4JF
35,,SING,C4,C9,no,N,35,,136669,25882,4JF
36,,DOUB,C4,C3,yes,N,36,,136669,25882,4JF
37,,SING,C2,C3,yes,N,37,,136669,25882,4JF
38,,SING,C2,O17,no,N,38,,136669,25882,4JF
39,,SING,C58,C60,no,N,39,,136669,25882,4JF
40,,DOUB,C58,C44,no,N,40,,136669,25882,4JF
41,,SING,C4A,O55,no,N,41,,136669,25882,4JF
42,,DOUB,C60,O62,no,N,42,,136669,25882,4JF
43,,SING,C9,C11,no,N,43,,136669,25882,4JF
44,,SING,C45,C46,no,N,44,,136669,25882,4JF
45,,SING,C45,C44,no,N,45,,136669,25882,4JF
46,,SING,C3,C10,no,N,46,,136669,25882,4JF
47,,SING,O55,C46,no,N,47,,136669,25882,4JF
48,,SING,C46,C42,no,N,48,,136669,25882,4JF
49,,SING,C44,C41,no,N,49,,136669,25882,4JF
50,,DOUB,O38,C22,no,N,50,,136669,25882,4JF
51,,SING,C11,C12,no,N,51,,136669,25882,4JF
52,,DOUB,C11,C19,no,N,52,,136669,25882,4JF
53,,SING,C51,C48,no,N,53,,136669,25882,4JF
54,,SING,C10,C12,no,N,54,,136669,25882,4JF
55,,DOUB,C10,O14,no,N,55,,136669,25882,4JF
56,,SING,C22,C19,no,N,56,,136669,25882,4JF
57,,SING,C22,C26,no,N,57,,136669,25882,4JF
58,,DOUB,C41,O43,no,N,58,,136669,25882,4JF
59,,SING,C41,C39,no,N,59,,136669,25882,4JF
60,,DOUB,C12,C21,no,N,60,,136669,25882,4JF
61,,SING,C42,C48,no,N,61,,136669,25882,4JF
62,,SING,C42,C39,no,N,62,,136669,25882,4JF
63,,SING,C42,O1D,no,N,63,,136669,25882,4JF
64,,SING,C19,C20,no,N,64,,136669,25882,4JF
65,,SING,C6F,O1D,no,N,65,,136669,25882,4JF
66,,SING,C6F,C7F,no,N,66,,136669,25882,4JF
67,,SING,C6F,O7G,no,N,67,,136669,25882,4JF
68,,SING,C39,C26,no,N,68,,136669,25882,4JF
69,,SING,C26,C28,no,N,69,,136669,25882,4JF
70,,SING,C7F,C9F,no,N,70,,136669,25882,4JF
71,,SING,O7G,C2G,no,N,71,,136669,25882,4JF
72,,SING,C21,C20,no,N,72,,136669,25882,4JF
73,,SING,C21,N23,no,N,73,,136669,25882,4JF
74,,SING,C20,C29,no,N,74,,136669,25882,4JF
75,,SING,C28,C31,no,N,75,,136669,25882,4JF
76,,SING,C28,C29,no,N,76,,136669,25882,4JF
77,,SING,C28,O2D,no,N,77,,136669,25882,4JF
78,,SING,N23,N24,no,N,78,,136669,25882,4JF
79,,SING,C31,C34,no,N,79,,136669,25882,4JF
80,,SING,C9F,O0H,no,N,80,,136669,25882,4JF
81,,SING,C9F,C3G,no,N,81,,136669,25882,4JF
82,,SING,C29,O25,no,N,82,,136669,25882,4JF
83,,SING,C2G,C3G,no,N,83,,136669,25882,4JF
84,,SING,C2G,C5H,no,N,84,,136669,25882,4JF
85,,SING,O25,C78,no,N,85,,136669,25882,4JF
86,,SING,C1H,O0H,no,N,86,,136669,25882,4JF
87,,SING,C3G,O8G,no,N,87,,136669,25882,4JF
88,,SING,O2D,C3D,no,N,88,,136669,25882,4JF
89,,SING,C79,C78,no,N,89,,136669,25882,4JF
90,,SING,C79,C80,no,N,90,,136669,25882,4JF
91,,SING,C78,O88,no,N,91,,136669,25882,4JF
92,,SING,C3D,O4E,no,N,92,,136669,25882,4JF
93,,SING,C3D,C4D,no,N,93,,136669,25882,4JF
94,,SING,C9D,C5E,no,N,94,,136669,25882,4JF
95,,SING,C9D,O4E,no,N,95,,136669,25882,4JF
96,,SING,C9D,C0E,no,N,96,,136669,25882,4JF
97,,SING,O88,C77,no,N,97,,136669,25882,4JF
98,,SING,O94,C80,no,N,98,,136669,25882,4JF
99,,SING,C80,C81,no,N,99,,136669,25882,4JF
100,,SING,C4D,C6D,no,N,100,,136669,25882,4JF
101,,SING,O9E,C0E,no,N,101,,136669,25882,4JF
102,,SING,C6D,C0E,no,N,102,,136669,25882,4JF
103,,SING,C6D,O1F,no,N,103,,136669,25882,4JF
104,,SING,C77,C81,no,N,104,,136669,25882,4JF
105,,SING,C77,C89,no,N,105,,136669,25882,4JF
106,,SING,C81,N93,no,N,106,,136669,25882,4JF
107,,SING,C2F,O1F,no,N,107,,136669,25882,4JF
108,,SING,N93,C96,no,N,108,,136669,25882,4JF
109,,SING,N93,C0A,no,N,109,,136669,25882,4JF
110,,SING,C1,H7,no,N,110,,136669,25882,4JF
111,,SING,C6,H8,no,N,111,,136669,25882,4JF
112,,SING,O15,H16,no,N,112,,136669,25882,4JF
113,,SING,O17,H18,no,N,113,,136669,25882,4JF
114,,SING,C20,H1,no,N,114,,136669,25882,4JF
115,,SING,N23,H2,no,N,115,,136669,25882,4JF
116,,SING,N24,H3,no,N,116,,136669,25882,4JF
117,,SING,N24,H4,no,N,117,,136669,25882,4JF
118,,SING,C26,H27,no,N,118,,136669,25882,4JF
119,,SING,C29,H30,no,N,119,,136669,25882,4JF
120,,SING,C31,H33,no,N,120,,136669,25882,4JF
121,,SING,C31,H32,no,N,121,,136669,25882,4JF
122,,SING,C34,H37,no,N,122,,136669,25882,4JF
123,,SING,C34,H35,no,N,123,,136669,25882,4JF
124,,SING,C34,H36,no,N,124,,136669,25882,4JF
125,,SING,C39,H40,no,N,125,,136669,25882,4JF
126,,SING,C46,H47,no,N,126,,136669,25882,4JF
127,,SING,C48,H50,no,N,127,,136669,25882,4JF
128,,SING,C48,H49,no,N,128,,136669,25882,4JF
129,,SING,C51,H53,no,N,129,,136669,25882,4JF
130,,SING,C51,H52,no,N,130,,136669,25882,4JF
131,,SING,C51,H54,no,N,131,,136669,25882,4JF
132,,SING,C57,H5,no,N,132,,136669,25882,4JF
133,,SING,C63,H69,no,N,133,,136669,25882,4JF
134,,SING,C63,H6,no,N,134,,136669,25882,4JF
135,,SING,C64,H70,no,N,135,,136669,25882,4JF
136,,SING,C66,H9,no,N,136,,136669,25882,4JF
137,,SING,O71,H72,no,N,137,,136669,25882,4JF
138,,SING,O73,H74,no,N,138,,136669,25882,4JF
139,,SING,N75,H10,no,N,139,,136669,25882,4JF
140,,SING,N76,H11,no,N,140,,136669,25882,4JF
141,,SING,N76,H12,no,N,141,,136669,25882,4JF
142,,SING,C77,H82,no,N,142,,136669,25882,4JF
143,,SING,C78,H87,no,N,143,,136669,25882,4JF
144,,SING,C79,H84,no,N,144,,136669,25882,4JF
145,,SING,C79,H83,no,N,145,,136669,25882,4JF
146,,SING,C80,H85,no,N,146,,136669,25882,4JF
147,,SING,C81,H86,no,N,147,,136669,25882,4JF
148,,SING,C89,H92,no,N,148,,136669,25882,4JF
149,,SING,C89,H91,no,N,149,,136669,25882,4JF
150,,SING,C89,H90,no,N,150,,136669,25882,4JF
151,,SING,O94,H95,no,N,151,,136669,25882,4JF
152,,SING,C96,H97,no,N,152,,136669,25882,4JF
153,,SING,C96,H98,no,N,153,,136669,25882,4JF
154,,SING,C96,H99,no,N,154,,136669,25882,4JF
155,,SING,C0A,H2A,no,N,155,,136669,25882,4JF
156,,SING,C0A,H1A,no,N,156,,136669,25882,4JF
157,,SING,C0A,H3A,no,N,157,,136669,25882,4JF
158,,SING,C4A,H1B,no,N,158,,136669,25882,4JF
159,,SING,C5A,H0B,no,N,159,,136669,25882,4JF
160,,SING,C5A,H9A,no,N,160,,136669,25882,4JF
161,,SING,C6A,H4B,no,N,161,,136669,25882,4JF
162,,SING,C7A,H2B,no,N,162,,136669,25882,4JF
163,,SING,C8A,H3B,no,N,163,,136669,25882,4JF
164,,SING,O6B,H7B,no,N,164,,136669,25882,4JF
165,,SING,C9B,H0C,no,N,165,,136669,25882,4JF
166,,SING,C9B,H2C,no,N,166,,136669,25882,4JF
167,,SING,C9B,H1C,no,N,167,,136669,25882,4JF
168,,SING,C3C,H5C,no,N,168,,136669,25882,4JF
169,,SING,C3C,H6C,no,N,169,,136669,25882,4JF
170,,SING,C3C,H4C,no,N,170,,136669,25882,4JF
171,,SING,C7C,H9C,no,N,171,,136669,25882,4JF
172,,SING,C7C,H0D,no,N,172,,136669,25882,4JF
173,,SING,C7C,H8C,no,N,173,,136669,25882,4JF
174,,SING,C3D,H5D,no,N,174,,136669,25882,4JF
175,,SING,C4D,H7D,no,N,175,,136669,25882,4JF
176,,SING,C4D,H8D,no,N,176,,136669,25882,4JF
177,,SING,C6D,H1E,no,N,177,,136669,25882,4JF
178,,SING,C9D,H2E,no,N,178,,136669,25882,4JF
179,,SING,C0E,H3E,no,N,179,,136669,25882,4JF
180,,SING,C5E,H7E,no,N,180,,136669,25882,4JF
181,,SING,C5E,H8E,no,N,181,,136669,25882,4JF
182,,SING,C5E,H6E,no,N,182,,136669,25882,4JF
183,,SING,O9E,H0F,no,N,183,,136669,25882,4JF
184,,SING,C2F,H4F,no,N,184,,136669,25882,4JF
185,,SING,C2F,H3F,no,N,185,,136669,25882,4JF
186,,SING,C2F,H5F,no,N,186,,136669,25882,4JF
187,,SING,C6F,H8F,no,N,187,,136669,25882,4JF
188,,SING,C7F,H1G,no,N,188,,136669,25882,4JF
189,,SING,C7F,H0G,no,N,189,,136669,25882,4JF
190,,SING,C9F,H4G,no,N,190,,136669,25882,4JF
191,,SING,C2G,H5G,no,N,191,,136669,25882,4JF
192,,SING,C3G,H6G,no,N,192,,136669,25882,4JF
193,,SING,O8G,H9G,no,N,193,,136669,25882,4JF
194,,SING,C1H,H3H,no,N,194,,136669,25882,4JF
195,,SING,C1H,H2H,no,N,195,,136669,25882,4JF
196,,SING,C1H,H4H,no,N,196,,136669,25882,4JF
197,,SING,C5H,H6H,no,N,197,,136669,25882,4JF
198,,SING,C5H,H7H,no,N,198,,136669,25882,4JF
199,,SING,C5H,H8H,no,N,199,,136669,25882,4JF
1,,SING,N,HN1,no,N,1,,137009,25898,NH2
2,,SING,N,HN2,no,N,2,,137009,25898,NH2
1,,DOUB,C,O,no,N,1,,137087,25901,ACE
2,,SING,C,CH3,no,N,2,,137087,25901,ACE
3,,SING,C,H,no,N,3,,137087,25901,ACE
4,,SING,CH3,H1,no,N,4,,137087,25901,ACE
5,,SING,CH3,H2,no,N,5,,137087,25901,ACE
6,,SING,CH3,H3,no,N,6,,137087,25901,ACE
1,,SING,N,CA,no,N,1,,137088,25901,SEP
2,,SING,N,H,no,N,2,,137088,25901,SEP
3,,SING,N,H2,no,N,3,,137088,25901,SEP
4,,SING,CA,CB,no,N,4,,137088,25901,SEP
5,,SING,CA,C,no,N,5,,137088,25901,SEP
6,,SING,CA,HA,no,N,6,,137088,25901,SEP
7,,SING,CB,OG,no,N,7,,137088,25901,SEP
8,,SING,CB,HB2,no,N,8,,137088,25901,SEP
9,,SING,CB,HB3,no,N,9,,137088,25901,SEP
10,,SING,OG,P,no,N,10,,137088,25901,SEP
11,,DOUB,C,O,no,N,11,,137088,25901,SEP
12,,SING,C,OXT,no,N,12,,137088,25901,SEP
13,,SING,OXT,HXT,no,N,13,,137088,25901,SEP
14,,DOUB,P,O1P,no,N,14,,137088,25901,SEP
15,,SING,P,O2P,no,N,15,,137088,25901,SEP
16,,SING,P,O3P,no,N,16,,137088,25901,SEP
17,,SING,O2P,HOP2,no,N,17,,137088,25901,SEP
18,,SING,O3P,HOP3,no,N,18,,137088,25901,SEP
1,,SING,N,HN1,no,N,1,,137089,25901,NH2
2,,SING,N,HN2,no,N,2,,137089,25901,NH2
1,,SING,OP2,P,no,N,1,,137128,25903,4JA
2,,SING,C6,C5,no,N,2,,137128,25903,4JA
3,,SING,P,O5',no,N,3,,137128,25903,4JA
4,,DOUB,P,OP1,no,N,4,,137128,25903,4JA
5,,SING,O5',C5',no,N,5,,137128,25903,4JA
6,,SING,C5,O5,no,N,6,,137128,25903,4JA
7,,SING,C5,C4,no,N,7,,137128,25903,4JA
8,,SING,O5,C1,no,N,8,,137128,25903,4JA
9,,SING,C5',C3',no,N,9,,137128,25903,4JA
10,,SING,C3',C2',no,N,10,,137128,25903,4JA
11,,SING,C3',O3',no,N,11,,137128,25903,4JA
12,,SING,C2',O1,no,N,12,,137128,25903,4JA
13,,SING,O4,C4,no,N,13,,137128,25903,4JA
14,,SING,C4,C3,no,N,14,,137128,25903,4JA
15,,SING,C1,O1,no,N,15,,137128,25903,4JA
16,,SING,C1,C2,no,N,16,,137128,25903,4JA
17,,SING,C3,C2,no,N,17,,137128,25903,4JA
18,,SING,C3,O3,no,N,18,,137128,25903,4JA
19,,SING,C2,O2,no,N,19,,137128,25903,4JA
20,,SING,O2,HO2,no,N,20,,137128,25903,4JA
21,,SING,O3,HO3,no,N,21,,137128,25903,4JA
22,,SING,O4,HO4,no,N,22,,137128,25903,4JA
23,,SING,C1,H1,no,N,23,,137128,25903,4JA
24,,SING,C2,H2,no,N,24,,137128,25903,4JA
25,,SING,C3,H3,no,N,25,,137128,25903,4JA
26,,SING,C4,H4,no,N,26,,137128,25903,4JA
27,,SING,C5,H5,no,N,27,,137128,25903,4JA
28,,SING,C6,H61,no,N,28,,137128,25903,4JA
29,,SING,C6,H62,no,N,29,,137128,25903,4JA
30,,SING,C6,H63,no,N,30,,137128,25903,4JA
31,,SING,OP2,HOP2,no,N,31,,137128,25903,4JA
32,,SING,C5',H5'',no,N,32,,137128,25903,4JA
33,,SING,C5',H5',no,N,33,,137128,25903,4JA
34,,SING,C3',H3',no,N,34,,137128,25903,4JA
35,,SING,C2',H2'',no,N,35,,137128,25903,4JA
36,,SING,C2',H2',no,N,36,,137128,25903,4JA
37,,SING,O3',HO3',no,N,37,,137128,25903,4JA
38,,SING,P,OP3,no,N,38,,137128,25903,4JA
39,,SING,OP3,HOP3,no,N,39,,137128,25903,4JA
1,,SING,OP2,P,no,N,1,,137176,25906,4JA
2,,SING,C6,C5,no,N,2,,137176,25906,4JA
3,,SING,P,O5',no,N,3,,137176,25906,4JA
4,,DOUB,P,OP1,no,N,4,,137176,25906,4JA
5,,SING,O5',C5',no,N,5,,137176,25906,4JA
6,,SING,C5,O5,no,N,6,,137176,25906,4JA
7,,SING,C5,C4,no,N,7,,137176,25906,4JA
8,,SING,O5,C1,no,N,8,,137176,25906,4JA
9,,SING,C5',C3',no,N,9,,137176,25906,4JA
10,,SING,C3',C2',no,N,10,,137176,25906,4JA
11,,SING,C3',O3',no,N,11,,137176,25906,4JA
12,,SING,C2',O1,no,N,12,,137176,25906,4JA
13,,SING,O4,C4,no,N,13,,137176,25906,4JA
14,,SING,C4,C3,no,N,14,,137176,25906,4JA
15,,SING,C1,O1,no,N,15,,137176,25906,4JA
16,,SING,C1,C2,no,N,16,,137176,25906,4JA
17,,SING,C3,C2,no,N,17,,137176,25906,4JA
18,,SING,C3,O3,no,N,18,,137176,25906,4JA
19,,SING,C2,O2,no,N,19,,137176,25906,4JA
20,,SING,O2,HO2,no,N,20,,137176,25906,4JA
21,,SING,O3,HO3,no,N,21,,137176,25906,4JA
22,,SING,O4,HO4,no,N,22,,137176,25906,4JA
23,,SING,C1,H1,no,N,23,,137176,25906,4JA
24,,SING,C2,H2,no,N,24,,137176,25906,4JA
25,,SING,C3,H3,no,N,25,,137176,25906,4JA
26,,SING,C4,H4,no,N,26,,137176,25906,4JA
27,,SING,C5,H5,no,N,27,,137176,25906,4JA
28,,SING,C6,H61,no,N,28,,137176,25906,4JA
29,,SING,C6,H62,no,N,29,,137176,25906,4JA
30,,SING,C6,H63,no,N,30,,137176,25906,4JA
31,,SING,OP2,HOP2,no,N,31,,137176,25906,4JA
32,,SING,C5',H5'',no,N,32,,137176,25906,4JA
33,,SING,C5',H5',no,N,33,,137176,25906,4JA
34,,SING,C3',H3',no,N,34,,137176,25906,4JA
35,,SING,C2',H2'',no,N,35,,137176,25906,4JA
36,,SING,C2',H2',no,N,36,,137176,25906,4JA
37,,SING,O3',HO3',no,N,37,,137176,25906,4JA
38,,SING,P,OP3,no,N,38,,137176,25906,4JA
39,,SING,OP3,HOP3,no,N,39,,137176,25906,4JA
1,,SING,FE,NA,no,N,1,,137193,25907,HEC
2,,SING,FE,NB,no,N,2,,137193,25907,HEC
3,,SING,FE,NC,no,N,3,,137193,25907,HEC
4,,SING,FE,ND,no,N,4,,137193,25907,HEC
5,,DOUB,CHA,C1A,no,N,5,,137193,25907,HEC
6,,SING,CHA,C4D,no,N,6,,137193,25907,HEC
7,,SING,CHA,HHA,no,N,7,,137193,25907,HEC
8,,DOUB,CHB,C4A,no,N,8,,137193,25907,HEC
9,,SING,CHB,C1B,no,N,9,,137193,25907,HEC
10,,SING,CHB,HHB,no,N,10,,137193,25907,HEC
11,,DOUB,CHC,C4B,no,N,11,,137193,25907,HEC
12,,SING,CHC,C1C,no,N,12,,137193,25907,HEC
13,,SING,CHC,HHC,no,N,13,,137193,25907,HEC
14,,DOUB,CHD,C4C,no,N,14,,137193,25907,HEC
15,,SING,CHD,C1D,no,N,15,,137193,25907,HEC
16,,SING,CHD,HHD,no,N,16,,137193,25907,HEC
17,,SING,NA,C1A,yes,N,17,,137193,25907,HEC
18,,SING,NA,C4A,yes,N,18,,137193,25907,HEC
19,,SING,C1A,C2A,yes,N,19,,137193,25907,HEC
20,,DOUB,C2A,C3A,yes,N,20,,137193,25907,HEC
21,,SING,C2A,CAA,no,N,21,,137193,25907,HEC
22,,SING,C3A,C4A,yes,N,22,,137193,25907,HEC
23,,SING,C3A,CMA,no,N,23,,137193,25907,HEC
24,,SING,CMA,HMA1,no,N,24,,137193,25907,HEC
25,,SING,CMA,HMA2,no,N,25,,137193,25907,HEC
26,,SING,CMA,HMA3,no,N,26,,137193,25907,HEC
27,,SING,CAA,CBA,no,N,27,,137193,25907,HEC
28,,SING,CAA,HAA1,no,N,28,,137193,25907,HEC
29,,SING,CAA,HAA2,no,N,29,,137193,25907,HEC
30,,SING,CBA,CGA,no,N,30,,137193,25907,HEC
31,,SING,CBA,HBA1,no,N,31,,137193,25907,HEC
32,,SING,CBA,HBA2,no,N,32,,137193,25907,HEC
33,,DOUB,CGA,O1A,no,N,33,,137193,25907,HEC
34,,SING,CGA,O2A,no,N,34,,137193,25907,HEC
35,,SING,O2A,H2A,no,N,35,,137193,25907,HEC
36,,SING,NB,C1B,yes,N,36,,137193,25907,HEC
37,,SING,NB,C4B,yes,N,37,,137193,25907,HEC
38,,DOUB,C1B,C2B,yes,N,38,,137193,25907,HEC
39,,SING,C2B,C3B,yes,N,39,,137193,25907,HEC
40,,SING,C2B,CMB,no,N,40,,137193,25907,HEC
41,,SING,C3B,C4B,yes,N,41,,137193,25907,HEC
42,,DOUB,C3B,CAB,no,E,42,,137193,25907,HEC
43,,SING,CMB,HMB1,no,N,43,,137193,25907,HEC
44,,SING,CMB,HMB2,no,N,44,,137193,25907,HEC
45,,SING,CMB,HMB3,no,N,45,,137193,25907,HEC
46,,SING,CAB,CBB,no,N,46,,137193,25907,HEC
47,,SING,CAB,HAB,no,N,47,,137193,25907,HEC
48,,SING,CBB,HBB1,no,N,48,,137193,25907,HEC
49,,SING,CBB,HBB2,no,N,49,,137193,25907,HEC
50,,SING,CBB,HBB3,no,N,50,,137193,25907,HEC
51,,SING,NC,C1C,yes,N,51,,137193,25907,HEC
52,,SING,NC,C4C,yes,N,52,,137193,25907,HEC
53,,DOUB,C1C,C2C,yes,N,53,,137193,25907,HEC
54,,SING,C2C,C3C,yes,N,54,,137193,25907,HEC
55,,SING,C2C,CMC,no,N,55,,137193,25907,HEC
56,,SING,C3C,C4C,yes,N,56,,137193,25907,HEC
8,,DOUB,C,O,,,,,240395,6146,ABA_2
57,,DOUB,C3C,CAC,no,E,57,,137193,25907,HEC
58,,SING,CMC,HMC1,no,N,58,,137193,25907,HEC
59,,SING,CMC,HMC2,no,N,59,,137193,25907,HEC
60,,SING,CMC,HMC3,no,N,60,,137193,25907,HEC
61,,SING,CAC,CBC,no,N,61,,137193,25907,HEC
62,,SING,CAC,HAC,no,N,62,,137193,25907,HEC
63,,SING,CBC,HBC1,no,N,63,,137193,25907,HEC
64,,SING,CBC,HBC2,no,N,64,,137193,25907,HEC
65,,SING,CBC,HBC3,no,N,65,,137193,25907,HEC
66,,SING,ND,C1D,yes,N,66,,137193,25907,HEC
67,,SING,ND,C4D,yes,N,67,,137193,25907,HEC
68,,DOUB,C1D,C2D,yes,N,68,,137193,25907,HEC
69,,SING,C2D,C3D,yes,N,69,,137193,25907,HEC
70,,SING,C2D,CMD,no,N,70,,137193,25907,HEC
71,,DOUB,C3D,C4D,yes,N,71,,137193,25907,HEC
72,,SING,C3D,CAD,no,N,72,,137193,25907,HEC
73,,SING,CMD,HMD1,no,N,73,,137193,25907,HEC
74,,SING,CMD,HMD2,no,N,74,,137193,25907,HEC
75,,SING,CMD,HMD3,no,N,75,,137193,25907,HEC
76,,SING,CAD,CBD,no,N,76,,137193,25907,HEC
77,,SING,CAD,HAD1,no,N,77,,137193,25907,HEC
78,,SING,CAD,HAD2,no,N,78,,137193,25907,HEC
79,,SING,CBD,CGD,no,N,79,,137193,25907,HEC
80,,SING,CBD,HBD1,no,N,80,,137193,25907,HEC
81,,SING,CBD,HBD2,no,N,81,,137193,25907,HEC
82,,DOUB,CGD,O1D,no,N,82,,137193,25907,HEC
83,,SING,CGD,O2D,no,N,83,,137193,25907,HEC
84,,SING,O2D,H2D,no,N,84,,137193,25907,HEC
1,,SING,FE,NA,no,N,1,,137216,25908,HEC
2,,SING,FE,NB,no,N,2,,137216,25908,HEC
3,,SING,FE,NC,no,N,3,,137216,25908,HEC
4,,SING,FE,ND,no,N,4,,137216,25908,HEC
5,,DOUB,CHA,C1A,no,N,5,,137216,25908,HEC
6,,SING,CHA,C4D,no,N,6,,137216,25908,HEC
7,,SING,CHA,HHA,no,N,7,,137216,25908,HEC
8,,DOUB,CHB,C4A,no,N,8,,137216,25908,HEC
9,,SING,CHB,C1B,no,N,9,,137216,25908,HEC
10,,SING,CHB,HHB,no,N,10,,137216,25908,HEC
11,,DOUB,CHC,C4B,no,N,11,,137216,25908,HEC
12,,SING,CHC,C1C,no,N,12,,137216,25908,HEC
13,,SING,CHC,HHC,no,N,13,,137216,25908,HEC
14,,DOUB,CHD,C4C,no,N,14,,137216,25908,HEC
15,,SING,CHD,C1D,no,N,15,,137216,25908,HEC
16,,SING,CHD,HHD,no,N,16,,137216,25908,HEC
17,,SING,NA,C1A,yes,N,17,,137216,25908,HEC
18,,SING,NA,C4A,yes,N,18,,137216,25908,HEC
19,,SING,C1A,C2A,yes,N,19,,137216,25908,HEC
20,,DOUB,C2A,C3A,yes,N,20,,137216,25908,HEC
21,,SING,C2A,CAA,no,N,21,,137216,25908,HEC
22,,SING,C3A,C4A,yes,N,22,,137216,25908,HEC
23,,SING,C3A,CMA,no,N,23,,137216,25908,HEC
24,,SING,CMA,HMA1,no,N,24,,137216,25908,HEC
25,,SING,CMA,HMA2,no,N,25,,137216,25908,HEC
26,,SING,CMA,HMA3,no,N,26,,137216,25908,HEC
27,,SING,CAA,CBA,no,N,27,,137216,25908,HEC
28,,SING,CAA,HAA1,no,N,28,,137216,25908,HEC
29,,SING,CAA,HAA2,no,N,29,,137216,25908,HEC
30,,SING,CBA,CGA,no,N,30,,137216,25908,HEC
31,,SING,CBA,HBA1,no,N,31,,137216,25908,HEC
32,,SING,CBA,HBA2,no,N,32,,137216,25908,HEC
33,,DOUB,CGA,O1A,no,N,33,,137216,25908,HEC
34,,SING,CGA,O2A,no,N,34,,137216,25908,HEC
35,,SING,O2A,H2A,no,N,35,,137216,25908,HEC
36,,SING,NB,C1B,yes,N,36,,137216,25908,HEC
37,,SING,NB,C4B,yes,N,37,,137216,25908,HEC
38,,DOUB,C1B,C2B,yes,N,38,,137216,25908,HEC
39,,SING,C2B,C3B,yes,N,39,,137216,25908,HEC
40,,SING,C2B,CMB,no,N,40,,137216,25908,HEC
41,,SING,C3B,C4B,yes,N,41,,137216,25908,HEC
42,,DOUB,C3B,CAB,no,E,42,,137216,25908,HEC
43,,SING,CMB,HMB1,no,N,43,,137216,25908,HEC
44,,SING,CMB,HMB2,no,N,44,,137216,25908,HEC
45,,SING,CMB,HMB3,no,N,45,,137216,25908,HEC
46,,SING,CAB,CBB,no,N,46,,137216,25908,HEC
47,,SING,CAB,HAB,no,N,47,,137216,25908,HEC
48,,SING,CBB,HBB1,no,N,48,,137216,25908,HEC
49,,SING,CBB,HBB2,no,N,49,,137216,25908,HEC
50,,SING,CBB,HBB3,no,N,50,,137216,25908,HEC
51,,SING,NC,C1C,yes,N,51,,137216,25908,HEC
52,,SING,NC,C4C,yes,N,52,,137216,25908,HEC
53,,DOUB,C1C,C2C,yes,N,53,,137216,25908,HEC
54,,SING,C2C,C3C,yes,N,54,,137216,25908,HEC
55,,SING,C2C,CMC,no,N,55,,137216,25908,HEC
56,,SING,C3C,C4C,yes,N,56,,137216,25908,HEC
57,,DOUB,C3C,CAC,no,E,57,,137216,25908,HEC
58,,SING,CMC,HMC1,no,N,58,,137216,25908,HEC
59,,SING,CMC,HMC2,no,N,59,,137216,25908,HEC
60,,SING,CMC,HMC3,no,N,60,,137216,25908,HEC
61,,SING,CAC,CBC,no,N,61,,137216,25908,HEC
62,,SING,CAC,HAC,no,N,62,,137216,25908,HEC
63,,SING,CBC,HBC1,no,N,63,,137216,25908,HEC
64,,SING,CBC,HBC2,no,N,64,,137216,25908,HEC
65,,SING,CBC,HBC3,no,N,65,,137216,25908,HEC
66,,SING,ND,C1D,yes,N,66,,137216,25908,HEC
67,,SING,ND,C4D,yes,N,67,,137216,25908,HEC
68,,DOUB,C1D,C2D,yes,N,68,,137216,25908,HEC
69,,SING,C2D,C3D,yes,N,69,,137216,25908,HEC
70,,SING,C2D,CMD,no,N,70,,137216,25908,HEC
71,,DOUB,C3D,C4D,yes,N,71,,137216,25908,HEC
72,,SING,C3D,CAD,no,N,72,,137216,25908,HEC
73,,SING,CMD,HMD1,no,N,73,,137216,25908,HEC
74,,SING,CMD,HMD2,no,N,74,,137216,25908,HEC
75,,SING,CMD,HMD3,no,N,75,,137216,25908,HEC
76,,SING,CAD,CBD,no,N,76,,137216,25908,HEC
77,,SING,CAD,HAD1,no,N,77,,137216,25908,HEC
78,,SING,CAD,HAD2,no,N,78,,137216,25908,HEC
79,,SING,CBD,CGD,no,N,79,,137216,25908,HEC
80,,SING,CBD,HBD1,no,N,80,,137216,25908,HEC
81,,SING,CBD,HBD2,no,N,81,,137216,25908,HEC
82,,DOUB,CGD,O1D,no,N,82,,137216,25908,HEC
83,,SING,CGD,O2D,no,N,83,,137216,25908,HEC
84,,SING,O2D,H2D,no,N,84,,137216,25908,HEC
1,,DOUB,OP1,P,no,N,1,,137368,25915,AZW
2,,SING,P,OP2,no,N,2,,137368,25915,AZW
3,,SING,P,O5',no,N,3,,137368,25915,AZW
4,,SING,C5',O5',no,N,4,,137368,25915,AZW
5,,SING,C5',C1A,no,N,5,,137368,25915,AZW
6,,DOUB,C2A,C1A,yes,N,6,,137368,25915,AZW
7,,SING,C2A,C3A,yes,N,7,,137368,25915,AZW
8,,SING,C1A,C6A,yes,N,8,,137368,25915,AZW
9,,DOUB,C3A,C4A,yes,N,9,,137368,25915,AZW
10,,DOUB,C6A,C5A,yes,N,10,,137368,25915,AZW
11,,SING,C4A,C5A,yes,N,11,,137368,25915,AZW
12,,SING,C4A,N5A,no,N,12,,137368,25915,AZW
13,,DOUB,N5B,N5A,no,N,13,,137368,25915,AZW
14,,SING,N5B,C4B,no,N,14,,137368,25915,AZW
15,,DOUB,C3B,C4B,yes,N,15,,137368,25915,AZW
16,,SING,C3B,C2B,yes,N,16,,137368,25915,AZW
17,,SING,C4B,C5B,yes,N,17,,137368,25915,AZW
18,,DOUB,C2B,C1B,yes,N,18,,137368,25915,AZW
19,,DOUB,C5B,C6B,yes,N,19,,137368,25915,AZW
20,,SING,C1B,C6B,yes,N,20,,137368,25915,AZW
21,,SING,C1B,C3',no,N,21,,137368,25915,AZW
22,,SING,O3',C3',no,N,22,,137368,25915,AZW
23,,SING,OP2,H2,no,N,23,,137368,25915,AZW
24,,SING,C5',H5',no,N,24,,137368,25915,AZW
25,,SING,C5',H5'',no,N,25,,137368,25915,AZW
26,,SING,C2A,H2A,no,N,26,,137368,25915,AZW
27,,SING,C6A,H6A,no,N,27,,137368,25915,AZW
28,,SING,C3A,H3A,no,N,28,,137368,25915,AZW
29,,SING,C5A,H5A,no,N,29,,137368,25915,AZW
30,,SING,C2B,H2B,no,N,30,,137368,25915,AZW
31,,SING,C6B,H6B,no,N,31,,137368,25915,AZW
32,,SING,C3B,H3B,no,N,32,,137368,25915,AZW
33,,SING,C5B,H5B,no,N,33,,137368,25915,AZW
34,,SING,C3',H3',no,N,34,,137368,25915,AZW
35,,SING,C3',H3'',no,N,35,,137368,25915,AZW
36,,SING,O3',H3,no,N,36,,137368,25915,AZW
37,,SING,P,OP3,no,N,37,,137368,25915,AZW
38,,SING,OP3,HOP3,no,N,38,,137368,25915,AZW
1,,DOUB,C1,C2,yes,N,1,,137616,25928,LCT
2,,SING,C1,C6,yes,N,2,,137616,25928,LCT
3,,SING,C2,C3,yes,N,3,,137616,25928,LCT
4,,SING,C2,N13,no,N,4,,137616,25928,LCT
5,,DOUB,C3,C4,yes,N,5,,137616,25928,LCT
6,,SING,C4,C5,yes,N,6,,137616,25928,LCT
7,,DOUB,C5,C6,yes,N,7,,137616,25928,LCT
8,,SING,C5,C19,no,N,8,,137616,25928,LCT
9,,DOUB,O34,C32,no,N,9,,137616,25928,LCT
10,,SING,C32,C36,no,N,10,,137616,25928,LCT
11,,SING,C32,N30,no,N,11,,137616,25928,LCT
12,,SING,N30,C22,no,N,12,,137616,25928,LCT
13,,DOUB,C22,N23,yes,N,13,,137616,25928,LCT
14,,SING,C22,S21,yes,N,14,,137616,25928,LCT
15,,SING,N23,N24,yes,N,15,,137616,25928,LCT
16,,DOUB,N24,C19,yes,N,16,,137616,25928,LCT
17,,SING,S21,C19,yes,N,17,,137616,25928,LCT
18,,SING,N13,O15,no,N,18,,137616,25928,LCT
19,,DOUB,N13,O17,no,N,19,,137616,25928,LCT
20,,SING,C1,H1,no,N,20,,137616,25928,LCT
21,,SING,C3,H2,no,N,21,,137616,25928,LCT
22,,SING,C4,H3,no,N,22,,137616,25928,LCT
23,,SING,C6,H4,no,N,23,,137616,25928,LCT
24,,SING,C36,H5,no,N,24,,137616,25928,LCT
25,,SING,C36,H6,no,N,25,,137616,25928,LCT
26,,SING,C36,H7,no,N,26,,137616,25928,LCT
27,,SING,N30,H8,no,N,27,,137616,25928,LCT
1,,SING,N,HN1,no,N,1,,137904,25948,NH2
2,,SING,N,HN2,no,N,2,,137904,25948,NH2
1,,SING,C1,C2,no,N,1,,137942,25950,BMA
2,,SING,C1,O1,no,N,2,,137942,25950,BMA
3,,SING,C1,O5,no,N,3,,137942,25950,BMA
4,,SING,C1,H1,no,N,4,,137942,25950,BMA
5,,SING,C2,C3,no,N,5,,137942,25950,BMA
6,,SING,C2,O2,no,N,6,,137942,25950,BMA
7,,SING,C2,H2,no,N,7,,137942,25950,BMA
8,,SING,C3,C4,no,N,8,,137942,25950,BMA
9,,SING,C3,O3,no,N,9,,137942,25950,BMA
10,,SING,C3,H3,no,N,10,,137942,25950,BMA
11,,SING,C4,C5,no,N,11,,137942,25950,BMA
12,,SING,C4,O4,no,N,12,,137942,25950,BMA
13,,SING,C4,H4,no,N,13,,137942,25950,BMA
14,,SING,C5,C6,no,N,14,,137942,25950,BMA
15,,SING,C5,O5,no,N,15,,137942,25950,BMA
16,,SING,C5,H5,no,N,16,,137942,25950,BMA
17,,SING,C6,O6,no,N,17,,137942,25950,BMA
18,,SING,C6,H61,no,N,18,,137942,25950,BMA
19,,SING,C6,H62,no,N,19,,137942,25950,BMA
20,,SING,O1,HO1,no,N,20,,137942,25950,BMA
21,,SING,O2,HO2,no,N,21,,137942,25950,BMA
22,,SING,O3,HO3,no,N,22,,137942,25950,BMA
23,,SING,O4,HO4,no,N,23,,137942,25950,BMA
24,,SING,O6,HO6,no,N,24,,137942,25950,BMA
1,,SING,C1,C2,no,N,1,,137960,25951,FUC
2,,SING,C1,O1,no,N,2,,137960,25951,FUC
3,,SING,C1,O5,no,N,3,,137960,25951,FUC
4,,SING,C1,H1,no,N,4,,137960,25951,FUC
5,,SING,C2,C3,no,N,5,,137960,25951,FUC
6,,SING,C2,O2,no,N,6,,137960,25951,FUC
7,,SING,C2,H2,no,N,7,,137960,25951,FUC
8,,SING,C3,C4,no,N,8,,137960,25951,FUC
9,,SING,C3,O3,no,N,9,,137960,25951,FUC
10,,SING,C3,H3,no,N,10,,137960,25951,FUC
11,,SING,C4,C5,no,N,11,,137960,25951,FUC
12,,SING,C4,O4,no,N,12,,137960,25951,FUC
13,,SING,C4,H4,no,N,13,,137960,25951,FUC
14,,SING,C5,C6,no,N,14,,137960,25951,FUC
15,,SING,C5,O5,no,N,15,,137960,25951,FUC
16,,SING,C5,H5,no,N,16,,137960,25951,FUC
17,,SING,C6,H61,no,N,17,,137960,25951,FUC
18,,SING,C6,H62,no,N,18,,137960,25951,FUC
19,,SING,C6,H63,no,N,19,,137960,25951,FUC
20,,SING,O1,HO1,no,N,20,,137960,25951,FUC
21,,SING,O2,HO2,no,N,21,,137960,25951,FUC
22,,SING,O3,HO3,no,N,22,,137960,25951,FUC
23,,SING,O4,HO4,no,N,23,,137960,25951,FUC
1,,DOUB,CAL,CAX,yes,N,1,,137996,25953,CY2
2,,SING,CAL,CAY,yes,N,2,,137996,25953,CY2
3,,SING,CAL,HAL,no,N,3,,137996,25953,CY2
4,,SING,CAX,BRA,no,N,4,,137996,25953,CY2
5,,SING,CAX,CAH,yes,N,5,,137996,25953,CY2
6,,SING,CAH,HAH,no,N,6,,137996,25953,CY2
7,,DOUB,CAH,CAF,yes,N,7,,137996,25953,CY2
8,,SING,CAF,CAI,yes,N,8,,137996,25953,CY2
9,,SING,CAF,HAF,no,N,9,,137996,25953,CY2
10,,DOUB,CAI,CAY,yes,N,10,,137996,25953,CY2
11,,SING,CAI,HAI,no,N,11,,137996,25953,CY2
12,,SING,CAY,NAT,no,N,12,,137996,25953,CY2
13,,DOUB,NAT,C6,no,Z,13,,137996,25953,CY2
14,,SING,C6,C5,yes,N,14,,137996,25953,CY2
15,,SING,C6,N1,yes,N,15,,137996,25953,CY2
16,,SING,C5,CAM,yes,N,16,,137996,25953,CY2
17,,DOUB,C5,C4,yes,N,17,,137996,25953,CY2
18,,DOUB,CAM,CAZ,yes,N,18,,137996,25953,CY2
19,,SING,CAM,HAM,no,N,19,,137996,25953,CY2
20,,DOUB,N1,C2,yes,N,20,,137996,25953,CY2
21,,SING,C2,N3,yes,N,21,,137996,25953,CY2
22,,SING,C2,H2,no,N,22,,137996,25953,CY2
23,,SING,N3,C4,yes,N,23,,137996,25953,CY2
24,,SING,N3,H3,no,N,24,,137996,25953,CY2
25,,SING,C4,CAK,yes,N,25,,137996,25953,CY2
26,,DOUB,CAK,CAJ,yes,N,26,,137996,25953,CY2
27,,SING,CAK,HAK,no,N,27,,137996,25953,CY2
28,,SING,CAJ,CAZ,yes,N,28,,137996,25953,CY2
29,,SING,CAJ,HAJ,no,N,29,,137996,25953,CY2
30,,SING,CAZ,NAS,no,N,30,,137996,25953,CY2
31,,SING,NAS,CAW,no,N,31,,137996,25953,CY2
32,,SING,NAS,HAS,no,N,32,,137996,25953,CY2
33,,DOUB,CAW,OAC,no,N,33,,137996,25953,CY2
34,,SING,CAW,CAO,no,N,34,,137996,25953,CY2
35,,SING,CAO,CAN,no,N,35,,137996,25953,CY2
36,,SING,CAO,HAO1,no,N,36,,137996,25953,CY2
37,,SING,CAO,HAO2,no,N,37,,137996,25953,CY2
38,,SING,CAN,SG,no,N,38,,137996,25953,CY2
39,,SING,CAN,HAN1,no,N,39,,137996,25953,CY2
40,,SING,CAN,HAN2,no,N,40,,137996,25953,CY2
41,,SING,SG,CB,no,N,41,,137996,25953,CY2
42,,SING,CB,CA,no,N,42,,137996,25953,CY2
43,,SING,CB,HBC1,no,N,43,,137996,25953,CY2
44,,SING,CB,HBC2,no,N,44,,137996,25953,CY2
45,,SING,CA,C,no,N,45,,137996,25953,CY2
46,,SING,CA,N,no,N,46,,137996,25953,CY2
47,,SING,CA,HA,no,N,47,,137996,25953,CY2
48,,DOUB,C,O,no,N,48,,137996,25953,CY2
49,,SING,C,OXT,no,N,49,,137996,25953,CY2
50,,SING,N,HN1,no,N,50,,137996,25953,CY2
51,,SING,N,HN2,no,N,51,,137996,25953,CY2
52,,SING,OXT,HOT,no,N,52,,137996,25953,CY2
1,,SING,P1,O1,no,N,1,,137997,25953,HE1
2,,SING,P1,O2,no,N,2,,137997,25953,HE1
3,,DOUB,P1,O3,no,N,3,,137997,25953,HE1
4,,SING,P1,C1,no,N,4,,137997,25953,HE1
5,,SING,O1,HO1,no,N,5,,137997,25953,HE1
6,,SING,O2,HO2,no,N,6,,137997,25953,HE1
7,,DOUB,C1,C2,no,Z,7,,137997,25953,HE1
8,,SING,C1,H1,no,N,8,,137997,25953,HE1
9,,SING,C2,C4,no,N,9,,137997,25953,HE1
10,,SING,C2,H2,no,N,10,,137997,25953,HE1
11,,SING,C3,C4,no,N,11,,137997,25953,HE1
12,,SING,C3,S1,no,N,12,,137997,25953,HE1
13,,SING,C3,H31,no,N,13,,137997,25953,HE1
14,,SING,C3,H32,no,N,14,,137997,25953,HE1
15,,SING,C4,H41,no,N,15,,137997,25953,HE1
16,,SING,C4,H42,no,N,16,,137997,25953,HE1
17,,SING,S1,C8,no,N,17,,137997,25953,HE1
18,,SING,OH,C7,no,N,18,,137997,25953,HE1
19,,SING,OH,HO7,no,N,19,,137997,25953,HE1
20,,DOUB,C5,C6,yes,N,20,,137997,25953,HE1
21,,SING,C5,C10,yes,N,21,,137997,25953,HE1
22,,SING,C5,H5,no,N,22,,137997,25953,HE1
23,,SING,C6,C7,yes,N,23,,137997,25953,HE1
24,,SING,C6,H6,no,N,24,,137997,25953,HE1
25,,DOUB,C7,C8,yes,N,25,,137997,25953,HE1
26,,SING,C8,C9,yes,N,26,,137997,25953,HE1
27,,DOUB,C9,C10,yes,N,27,,137997,25953,HE1
28,,SING,C9,H9,no,N,28,,137997,25953,HE1
29,,SING,C10,H10,no,N,29,,137997,25953,HE1
1,,SING,C8,N2,no,N,1,,137998,25953,HIE
2,,SING,C8,C13,no,N,2,,137998,25953,HIE
3,,SING,C8,C9,no,N,3,,137998,25953,HIE
4,,DOUB,C5,C6,yes,N,4,,137998,25953,HIE
5,,SING,C5,N2,no,N,5,,137998,25953,HIE
6,,SING,C5,C4,yes,N,6,,137998,25953,HIE
7,,SING,C6,C1,yes,N,7,,137998,25953,HIE
8,,SING,C6,C7,no,N,8,,137998,25953,HIE
9,,SING,N1,C7,no,N,9,,137998,25953,HIE
10,,SING,C2,C3,yes,N,10,,137998,25953,HIE
11,,DOUB,C2,C1,yes,N,11,,137998,25953,HIE
12,,DOUB,O2,C7,no,N,12,,137998,25953,HIE
13,,SING,N3,C3,yes,N,13,,137998,25953,HIE
14,,SING,N3,N4,yes,N,14,,137998,25953,HIE
15,,SING,N3,C16,yes,N,15,,137998,25953,HIE
16,,DOUB,C3,C4,yes,N,16,,137998,25953,HIE
17,,DOUB,N4,C14,yes,N,17,,137998,25953,HIE
18,,SING,C10,C11,no,N,18,,137998,25953,HIE
19,,SING,C10,C9,no,N,19,,137998,25953,HIE
20,,SING,C11,C12,no,N,20,,137998,25953,HIE
21,,SING,C11,O3,no,N,21,,137998,25953,HIE
22,,SING,C12,C13,no,N,22,,137998,25953,HIE
23,,SING,C14,C15,yes,N,23,,137998,25953,HIE
24,,SING,C14,C23,no,N,24,,137998,25953,HIE
25,,DOUB,C15,C16,yes,N,25,,137998,25953,HIE
26,,SING,C15,C20,no,N,26,,137998,25953,HIE
27,,SING,C16,C17,no,N,27,,137998,25953,HIE
28,,SING,C19,C18,no,N,28,,137998,25953,HIE
29,,SING,C19,C20,no,N,29,,137998,25953,HIE
30,,SING,C21,C18,no,N,30,,137998,25953,HIE
31,,SING,F1,C23,no,N,31,,137998,25953,HIE
32,,DOUB,O1,C20,no,N,32,,137998,25953,HIE
33,,SING,F2,C23,no,N,33,,137998,25953,HIE
34,,SING,F3,C23,no,N,34,,137998,25953,HIE
35,,SING,C17,C18,no,N,35,,137998,25953,HIE
36,,SING,C18,C22,no,N,36,,137998,25953,HIE
37,,SING,C8,H8,no,N,37,,137998,25953,HIE
38,,SING,N1,HN1,no,N,38,,137998,25953,HIE
39,,SING,N1,HN1A,no,N,39,,137998,25953,HIE
40,,SING,C2,H2,no,N,40,,137998,25953,HIE
41,,SING,N2,HN2,no,N,41,,137998,25953,HIE
42,,SING,C4,H4,no,N,42,,137998,25953,HIE
43,,SING,C10,H10,no,N,43,,137998,25953,HIE
44,,SING,C10,H10A,no,N,44,,137998,25953,HIE
45,,SING,C11,H11,no,N,45,,137998,25953,HIE
46,,SING,C12,H12,no,N,46,,137998,25953,HIE
47,,SING,C12,H12A,no,N,47,,137998,25953,HIE
48,,SING,C13,H13,no,N,48,,137998,25953,HIE
49,,SING,C13,H13A,no,N,49,,137998,25953,HIE
50,,SING,C19,H19,no,N,50,,137998,25953,HIE
51,,SING,C19,H19A,no,N,51,,137998,25953,HIE
52,,SING,C21,H21,no,N,52,,137998,25953,HIE
53,,SING,C21,H21A,no,N,53,,137998,25953,HIE
54,,SING,C21,H21B,no,N,54,,137998,25953,HIE
55,,SING,C1,H1,no,N,55,,137998,25953,HIE
56,,SING,O3,HO3,no,N,56,,137998,25953,HIE
57,,SING,C9,H9,no,N,57,,137998,25953,HIE
58,,SING,C9,H9A,no,N,58,,137998,25953,HIE
59,,SING,C17,H17,no,N,59,,137998,25953,HIE
60,,SING,C17,H17A,no,N,60,,137998,25953,HIE
61,,SING,C22,H22,no,N,61,,137998,25953,HIE
62,,SING,C22,H22A,no,N,62,,137998,25953,HIE
63,,SING,C22,H22B,no,N,63,,137998,25953,HIE
1,,SING,N,HN1,no,N,1,,138020,25954,NH2
2,,SING,N,HN2,no,N,2,,138020,25954,NH2
1,,SING,N,HN1,no,N,1,,138300,25971,NH2
2,,SING,N,HN2,no,N,2,,138300,25971,NH2
1,,SING,N,HN1,no,N,1,,138428,25982,NH2
2,,SING,N,HN2,no,N,2,,138428,25982,NH2
1,,SING,C11,C9,no,N,1,,138429,25982,4FU
2,,SING,C11,C12,no,N,2,,138429,25982,4FU
3,,SING,C9,C8,no,N,3,,138429,25982,4FU
4,,SING,C12,C13,no,N,4,,138429,25982,4FU
5,,DOUB,OAB,C15,no,N,5,,138429,25982,4FU
6,,SING,C8,C7,no,N,6,,138429,25982,4FU
7,,SING,C8,C14,no,N,7,,138429,25982,4FU
8,,DOUB,C7,O7,no,N,8,,138429,25982,4FU
9,,SING,C15,C14,no,N,9,,138429,25982,4FU
10,,SING,C13,C14,no,N,10,,138429,25982,4FU
11,,SING,C7,O1,no,N,11,,138429,25982,4FU
12,,SING,C8,H8,no,N,12,,138429,25982,4FU
13,,SING,C9,H9,no,N,13,,138429,25982,4FU
14,,SING,C9,HAI,no,N,14,,138429,25982,4FU
15,,SING,C11,H112,no,N,15,,138429,25982,4FU
16,,SING,C11,H111,no,N,16,,138429,25982,4FU
17,,SING,C12,HAG,no,N,17,,138429,25982,4FU
18,,SING,C12,H12,no,N,18,,138429,25982,4FU
19,,SING,C13,HAL,no,N,19,,138429,25982,4FU
20,,SING,C13,HAK,no,N,20,,138429,25982,4FU
21,,SING,C14,H14,no,N,21,,138429,25982,4FU
22,,SING,C15,O2,no,N,22,,138429,25982,4FU
23,,SING,O1,H1,no,N,23,,138429,25982,4FU
24,,SING,O2,H2,no,N,24,,138429,25982,4FU
1,,SING,N,CA,no,N,1,,138430,25982,DAL
2,,SING,N,H,no,N,2,,138430,25982,DAL
3,,SING,N,H2,no,N,3,,138430,25982,DAL
4,,SING,CA,CB,no,N,4,,138430,25982,DAL
5,,SING,CA,C,no,N,5,,138430,25982,DAL
6,,SING,CA,HA,no,N,6,,138430,25982,DAL
1,,SING,N,CA,,,,,240396,6146,MLN_2
7,,SING,CB,HB1,no,N,7,,138430,25982,DAL
8,,SING,CB,HB2,no,N,8,,138430,25982,DAL
9,,SING,CB,HB3,no,N,9,,138430,25982,DAL
10,,DOUB,C,O,no,N,10,,138430,25982,DAL
11,,SING,C,OXT,no,N,11,,138430,25982,DAL
12,,SING,OXT,HXT,no,N,12,,138430,25982,DAL
1,,SING,N,CA,no,N,1,,138431,25982,DPR
2,,SING,N,CD,no,N,2,,138431,25982,DPR
3,,SING,N,H,no,N,3,,138431,25982,DPR
4,,SING,CA,CB,no,N,4,,138431,25982,DPR
5,,SING,CA,C,no,N,5,,138431,25982,DPR
6,,SING,CA,HA,no,N,6,,138431,25982,DPR
7,,SING,CB,CG,no,N,7,,138431,25982,DPR
8,,SING,CB,HB2,no,N,8,,138431,25982,DPR
9,,SING,CB,HB3,no,N,9,,138431,25982,DPR
10,,SING,CG,CD,no,N,10,,138431,25982,DPR
11,,SING,CG,HG2,no,N,11,,138431,25982,DPR
12,,SING,CG,HG3,no,N,12,,138431,25982,DPR
13,,SING,CD,HD2,no,N,13,,138431,25982,DPR
14,,SING,CD,HD3,no,N,14,,138431,25982,DPR
15,,DOUB,C,O,no,N,15,,138431,25982,DPR
16,,SING,C,OXT,no,N,16,,138431,25982,DPR
17,,SING,OXT,HXT,no,N,17,,138431,25982,DPR
1,,SING,NAC,CAE,no,N,1,,138432,25982,4G6
2,,SING,CAE,CAF,no,N,2,,138432,25982,4G6
3,,SING,NAD,CAF,no,N,3,,138432,25982,4G6
4,,SING,CAF,CAA,no,N,4,,138432,25982,4G6
5,,SING,CAF,CAB,no,N,5,,138432,25982,4G6
6,,SING,CAA,HAC,no,N,6,,138432,25982,4G6
7,,SING,CAA,HAB,no,N,7,,138432,25982,4G6
8,,SING,CAA,HAA,no,N,8,,138432,25982,4G6
9,,SING,CAB,HAF,no,N,9,,138432,25982,4G6
10,,SING,CAB,HAD,no,N,10,,138432,25982,4G6
11,,SING,CAB,HAE,no,N,11,,138432,25982,4G6
12,,SING,NAD,HAL,no,N,12,,138432,25982,4G6
13,,SING,NAD,H1,no,N,13,,138432,25982,4G6
14,,SING,CAE,HAH,no,N,14,,138432,25982,4G6
15,,SING,CAE,HAG,no,N,15,,138432,25982,4G6
16,,SING,NAC,HAI,no,N,16,,138432,25982,4G6
17,,SING,NAC,H3,no,N,17,,138432,25982,4G6
1,,DOUB,C,O,no,N,1,,138433,25982,ACE
2,,SING,C,CH3,no,N,2,,138433,25982,ACE
3,,SING,C,H,no,N,3,,138433,25982,ACE
4,,SING,CH3,H1,no,N,4,,138433,25982,ACE
5,,SING,CH3,H2,no,N,5,,138433,25982,ACE
6,,SING,CH3,H3,no,N,6,,138433,25982,ACE
1,,SING,C1,O1,no,N,1,,138471,25984,PAM
2,,DOUB,C1,O2,no,N,2,,138471,25984,PAM
3,,SING,C1,C2,no,N,3,,138471,25984,PAM
4,,SING,O1,HO1,no,N,4,,138471,25984,PAM
5,,SING,C2,C3,no,N,5,,138471,25984,PAM
6,,SING,C2,H21,no,N,6,,138471,25984,PAM
7,,SING,C2,H22,no,N,7,,138471,25984,PAM
8,,SING,C3,C4,no,N,8,,138471,25984,PAM
9,,SING,C3,H31,no,N,9,,138471,25984,PAM
10,,SING,C3,H32,no,N,10,,138471,25984,PAM
11,,SING,C4,C5,no,N,11,,138471,25984,PAM
12,,SING,C4,H41,no,N,12,,138471,25984,PAM
13,,SING,C4,H42,no,N,13,,138471,25984,PAM
14,,SING,C5,C6,no,N,14,,138471,25984,PAM
15,,SING,C5,H51,no,N,15,,138471,25984,PAM
16,,SING,C5,H52,no,N,16,,138471,25984,PAM
17,,SING,C6,C7,no,N,17,,138471,25984,PAM
18,,SING,C6,H61,no,N,18,,138471,25984,PAM
19,,SING,C6,H62,no,N,19,,138471,25984,PAM
20,,SING,C7,C8,no,N,20,,138471,25984,PAM
21,,SING,C7,H71,no,N,21,,138471,25984,PAM
22,,SING,C7,H72,no,N,22,,138471,25984,PAM
23,,SING,C8,C9,no,N,23,,138471,25984,PAM
24,,SING,C8,H81,no,N,24,,138471,25984,PAM
25,,SING,C8,H82,no,N,25,,138471,25984,PAM
26,,DOUB,C9,C10,no,Z,26,,138471,25984,PAM
27,,SING,C9,H9,no,N,27,,138471,25984,PAM
28,,SING,C10,C11,no,N,28,,138471,25984,PAM
29,,SING,C10,H10,no,N,29,,138471,25984,PAM
30,,SING,C11,C12,no,N,30,,138471,25984,PAM
31,,SING,C11,H111,no,N,31,,138471,25984,PAM
32,,SING,C11,H112,no,N,32,,138471,25984,PAM
33,,SING,C12,C13,no,N,33,,138471,25984,PAM
34,,SING,C12,H121,no,N,34,,138471,25984,PAM
35,,SING,C12,H122,no,N,35,,138471,25984,PAM
36,,SING,C13,C14,no,N,36,,138471,25984,PAM
37,,SING,C13,H131,no,N,37,,138471,25984,PAM
38,,SING,C13,H132,no,N,38,,138471,25984,PAM
39,,SING,C14,C15,no,N,39,,138471,25984,PAM
40,,SING,C14,H141,no,N,40,,138471,25984,PAM
41,,SING,C14,H142,no,N,41,,138471,25984,PAM
42,,SING,C15,C16,no,N,42,,138471,25984,PAM
43,,SING,C15,H151,no,N,43,,138471,25984,PAM
44,,SING,C15,H152,no,N,44,,138471,25984,PAM
45,,SING,C16,H161,no,N,45,,138471,25984,PAM
46,,SING,C16,H162,no,N,46,,138471,25984,PAM
47,,SING,C16,H163,no,N,47,,138471,25984,PAM
1,,SING,C1',C2',no,N,1,,138990,26005,ALL
2,,SING,C1',O1',no,N,2,,138990,26005,ALL
3,,SING,C1',O5',no,N,3,,138990,26005,ALL
4,,SING,C1',H1',no,N,4,,138990,26005,ALL
5,,SING,C2',C3',no,N,5,,138990,26005,ALL
6,,SING,C2',O2',no,N,6,,138990,26005,ALL
7,,SING,C2',H2',no,N,7,,138990,26005,ALL
8,,SING,C3',C4',no,N,8,,138990,26005,ALL
9,,SING,C3',O3',no,N,9,,138990,26005,ALL
10,,SING,C3',H3',no,N,10,,138990,26005,ALL
11,,SING,C4',C5',no,N,11,,138990,26005,ALL
12,,SING,C4',O4',no,N,12,,138990,26005,ALL
13,,SING,C4',H4',no,N,13,,138990,26005,ALL
14,,SING,C5',C6',no,N,14,,138990,26005,ALL
15,,SING,C5',O5',no,N,15,,138990,26005,ALL
16,,SING,C5',H5',no,N,16,,138990,26005,ALL
17,,SING,C6',O6',no,N,17,,138990,26005,ALL
18,,SING,C6',H6'1,no,N,18,,138990,26005,ALL
19,,SING,C6',H6'2,no,N,19,,138990,26005,ALL
20,,SING,O1',HO'1,no,N,20,,138990,26005,ALL
21,,SING,O2',HO'2,no,N,21,,138990,26005,ALL
22,,SING,O3',HO'3,no,N,22,,138990,26005,ALL
23,,SING,O4',HO'4,no,N,23,,138990,26005,ALL
24,,SING,O6',HO'6,no,N,24,,138990,26005,ALL
1,,SING,C1,C2,no,N,1,,139006,26006,GAL
2,,SING,C1,O1,no,N,2,,139006,26006,GAL
3,,SING,C1,O5,no,N,3,,139006,26006,GAL
4,,SING,C1,H1,no,N,4,,139006,26006,GAL
5,,SING,C2,C3,no,N,5,,139006,26006,GAL
6,,SING,C2,O2,no,N,6,,139006,26006,GAL
7,,SING,C2,H2,no,N,7,,139006,26006,GAL
8,,SING,C3,C4,no,N,8,,139006,26006,GAL
9,,SING,C3,O3,no,N,9,,139006,26006,GAL
10,,SING,C3,H3,no,N,10,,139006,26006,GAL
11,,SING,C4,C5,no,N,11,,139006,26006,GAL
12,,SING,C4,O4,no,N,12,,139006,26006,GAL
13,,SING,C4,H4,no,N,13,,139006,26006,GAL
14,,SING,C5,C6,no,N,14,,139006,26006,GAL
15,,SING,C5,O5,no,N,15,,139006,26006,GAL
16,,SING,C5,H5,no,N,16,,139006,26006,GAL
17,,SING,C6,O6,no,N,17,,139006,26006,GAL
18,,SING,C6,H61,no,N,18,,139006,26006,GAL
19,,SING,C6,H62,no,N,19,,139006,26006,GAL
20,,SING,O1,HO1,no,N,20,,139006,26006,GAL
21,,SING,O2,HO2,no,N,21,,139006,26006,GAL
22,,SING,O3,HO3,no,N,22,,139006,26006,GAL
23,,SING,O4,HO4,no,N,23,,139006,26006,GAL
24,,SING,O6,HO6,no,N,24,,139006,26006,GAL
1,,SING,O4A,C1B,no,N,1,,139022,26007,XYP
2,,SING,O4A,HO4A,no,N,2,,139022,26007,XYP
3,,SING,C1B,C2B,no,N,3,,139022,26007,XYP
4,,SING,C1B,O5B,no,N,4,,139022,26007,XYP
5,,SING,C1B,H1B,no,N,5,,139022,26007,XYP
6,,SING,C2B,C3B,no,N,6,,139022,26007,XYP
7,,SING,C2B,O2B,no,N,7,,139022,26007,XYP
8,,SING,C2B,H2B,no,N,8,,139022,26007,XYP
9,,SING,C3B,C4B,no,N,9,,139022,26007,XYP
10,,SING,C3B,O3B,no,N,10,,139022,26007,XYP
11,,SING,C3B,H3B,no,N,11,,139022,26007,XYP
12,,SING,C4B,C5B,no,N,12,,139022,26007,XYP
13,,SING,C4B,O4B,no,N,13,,139022,26007,XYP
14,,SING,C4B,H4B,no,N,14,,139022,26007,XYP
15,,SING,C5B,O5B,no,N,15,,139022,26007,XYP
16,,SING,C5B,H5B1,no,N,16,,139022,26007,XYP
17,,SING,C5B,H5B2,no,N,17,,139022,26007,XYP
18,,SING,O2B,HO2B,no,N,18,,139022,26007,XYP
19,,SING,O3B,HO3B,no,N,19,,139022,26007,XYP
20,,SING,O4B,HO4B,no,N,20,,139022,26007,XYP
1,,SING,O3,C3,no,N,1,,139038,26008,4N2
2,,SING,C3,C4,no,N,2,,139038,26008,4N2
3,,SING,C3,C2,no,N,3,,139038,26008,4N2
4,,SING,C4,C5,no,N,4,,139038,26008,4N2
5,,SING,C4,O4,no,N,5,,139038,26008,4N2
6,,SING,C5,C6,no,N,6,,139038,26008,4N2
7,,SING,C5,O5,no,N,7,,139038,26008,4N2
8,,SING,C6,O6,no,N,8,,139038,26008,4N2
9,,SING,C2,C1,no,N,9,,139038,26008,4N2
10,,SING,C2,O2,no,N,10,,139038,26008,4N2
11,,SING,C1,O5,no,N,11,,139038,26008,4N2
12,,SING,C1,O1,no,N,12,,139038,26008,4N2
13,,SING,C1,H1,no,N,13,,139038,26008,4N2
14,,SING,C2,H2,no,N,14,,139038,26008,4N2
15,,SING,C3,H3,no,N,15,,139038,26008,4N2
16,,SING,C4,H4,no,N,16,,139038,26008,4N2
17,,SING,C5,H5,no,N,17,,139038,26008,4N2
18,,SING,C6,H62,no,N,18,,139038,26008,4N2
19,,SING,C6,H61,no,N,19,,139038,26008,4N2
20,,SING,O2,HO2,no,N,20,,139038,26008,4N2
21,,SING,O3,HO3,no,N,21,,139038,26008,4N2
22,,SING,O4,HO4,no,N,22,,139038,26008,4N2
23,,SING,O6,HO6,no,N,23,,139038,26008,4N2
24,,SING,O1,H6,no,N,24,,139038,26008,4N2
1,,SING,N,CA,no,N,1,,139645,26047,MLY
2,,SING,N,H,no,N,2,,139645,26047,MLY
3,,SING,N,H2,no,N,3,,139645,26047,MLY
4,,SING,CA,CB,no,N,4,,139645,26047,MLY
5,,SING,CA,C,no,N,5,,139645,26047,MLY
6,,SING,CA,HA,no,N,6,,139645,26047,MLY
7,,SING,CB,CG,no,N,7,,139645,26047,MLY
8,,SING,CB,HB2,no,N,8,,139645,26047,MLY
9,,SING,CB,HB3,no,N,9,,139645,26047,MLY
10,,SING,CG,CD,no,N,10,,139645,26047,MLY
11,,SING,CG,HG2,no,N,11,,139645,26047,MLY
12,,SING,CG,HG3,no,N,12,,139645,26047,MLY
13,,SING,CD,CE,no,N,13,,139645,26047,MLY
14,,SING,CD,HD2,no,N,14,,139645,26047,MLY
15,,SING,CD,HD3,no,N,15,,139645,26047,MLY
16,,SING,CE,NZ,no,N,16,,139645,26047,MLY
17,,SING,CE,HE2,no,N,17,,139645,26047,MLY
18,,SING,CE,HE3,no,N,18,,139645,26047,MLY
19,,SING,NZ,CH1,no,N,19,,139645,26047,MLY
20,,SING,NZ,CH2,no,N,20,,139645,26047,MLY
21,,SING,CH1,HH11,no,N,21,,139645,26047,MLY
22,,SING,CH1,HH12,no,N,22,,139645,26047,MLY
23,,SING,CH1,HH13,no,N,23,,139645,26047,MLY
24,,SING,CH2,HH21,no,N,24,,139645,26047,MLY
25,,SING,CH2,HH22,no,N,25,,139645,26047,MLY
26,,SING,CH2,HH23,no,N,26,,139645,26047,MLY
27,,DOUB,C,O,no,N,27,,139645,26047,MLY
28,,SING,C,OXT,no,N,28,,139645,26047,MLY
29,,SING,OXT,HXT,no,N,29,,139645,26047,MLY
1,,SING,CHA,C1A,no,N,1,,139664,26048,HEM
2,,DOUB,CHA,C4D,no,N,2,,139664,26048,HEM
3,,SING,CHA,HHA,no,N,3,,139664,26048,HEM
4,,SING,CHB,C4A,no,N,4,,139664,26048,HEM
5,,DOUB,CHB,C1B,no,N,5,,139664,26048,HEM
6,,SING,CHB,HHB,no,N,6,,139664,26048,HEM
7,,SING,CHC,C4B,no,N,7,,139664,26048,HEM
8,,DOUB,CHC,C1C,no,N,8,,139664,26048,HEM
9,,SING,CHC,HHC,no,N,9,,139664,26048,HEM
10,,DOUB,CHD,C4C,no,N,10,,139664,26048,HEM
11,,SING,CHD,C1D,no,N,11,,139664,26048,HEM
12,,SING,CHD,HHD,no,N,12,,139664,26048,HEM
13,,DOUB,C1A,C2A,yes,N,13,,139664,26048,HEM
14,,SING,C1A,NA,yes,N,14,,139664,26048,HEM
15,,SING,C2A,C3A,yes,N,15,,139664,26048,HEM
16,,SING,C2A,CAA,no,N,16,,139664,26048,HEM
17,,DOUB,C3A,C4A,yes,N,17,,139664,26048,HEM
18,,SING,C3A,CMA,no,N,18,,139664,26048,HEM
19,,SING,C4A,NA,yes,N,19,,139664,26048,HEM
20,,SING,CMA,HMA,no,N,20,,139664,26048,HEM
21,,SING,CMA,HMAA,no,N,21,,139664,26048,HEM
22,,SING,CMA,HMAB,no,N,22,,139664,26048,HEM
23,,SING,CAA,CBA,no,N,23,,139664,26048,HEM
24,,SING,CAA,HAA,no,N,24,,139664,26048,HEM
25,,SING,CAA,HAAA,no,N,25,,139664,26048,HEM
26,,SING,CBA,CGA,no,N,26,,139664,26048,HEM
27,,SING,CBA,HBA,no,N,27,,139664,26048,HEM
28,,SING,CBA,HBAA,no,N,28,,139664,26048,HEM
29,,DOUB,CGA,O1A,no,N,29,,139664,26048,HEM
30,,SING,CGA,O2A,no,N,30,,139664,26048,HEM
31,,SING,C1B,C2B,no,N,31,,139664,26048,HEM
32,,SING,C1B,NB,no,N,32,,139664,26048,HEM
33,,DOUB,C2B,C3B,no,N,33,,139664,26048,HEM
34,,SING,C2B,CMB,no,N,34,,139664,26048,HEM
35,,SING,C3B,C4B,no,N,35,,139664,26048,HEM
36,,SING,C3B,CAB,no,N,36,,139664,26048,HEM
37,,DOUB,C4B,NB,no,N,37,,139664,26048,HEM
38,,SING,CMB,HMB,no,N,38,,139664,26048,HEM
39,,SING,CMB,HMBA,no,N,39,,139664,26048,HEM
40,,SING,CMB,HMBB,no,N,40,,139664,26048,HEM
41,,DOUB,CAB,CBB,no,N,41,,139664,26048,HEM
42,,SING,CAB,HAB,no,N,42,,139664,26048,HEM
43,,SING,CBB,HBB,no,N,43,,139664,26048,HEM
44,,SING,CBB,HBBA,no,N,44,,139664,26048,HEM
45,,SING,C1C,C2C,yes,N,45,,139664,26048,HEM
46,,SING,C1C,NC,yes,N,46,,139664,26048,HEM
47,,DOUB,C2C,C3C,yes,N,47,,139664,26048,HEM
48,,SING,C2C,CMC,no,N,48,,139664,26048,HEM
49,,SING,C3C,C4C,yes,N,49,,139664,26048,HEM
50,,SING,C3C,CAC,no,N,50,,139664,26048,HEM
51,,SING,C4C,NC,yes,N,51,,139664,26048,HEM
52,,SING,CMC,HMC,no,N,52,,139664,26048,HEM
53,,SING,CMC,HMCA,no,N,53,,139664,26048,HEM
54,,SING,CMC,HMCB,no,N,54,,139664,26048,HEM
55,,DOUB,CAC,CBC,no,N,55,,139664,26048,HEM
56,,SING,CAC,HAC,no,N,56,,139664,26048,HEM
57,,SING,CBC,HBC,no,N,57,,139664,26048,HEM
58,,SING,CBC,HBCA,no,N,58,,139664,26048,HEM
59,,SING,C1D,C2D,no,N,59,,139664,26048,HEM
60,,DOUB,C1D,ND,no,N,60,,139664,26048,HEM
61,,DOUB,C2D,C3D,no,N,61,,139664,26048,HEM
62,,SING,C2D,CMD,no,N,62,,139664,26048,HEM
63,,SING,C3D,C4D,no,N,63,,139664,26048,HEM
64,,SING,C3D,CAD,no,N,64,,139664,26048,HEM
65,,SING,C4D,ND,no,N,65,,139664,26048,HEM
66,,SING,CMD,HMD,no,N,66,,139664,26048,HEM
67,,SING,CMD,HMDA,no,N,67,,139664,26048,HEM
68,,SING,CMD,HMDB,no,N,68,,139664,26048,HEM
69,,SING,CAD,CBD,no,N,69,,139664,26048,HEM
70,,SING,CAD,HAD,no,N,70,,139664,26048,HEM
71,,SING,CAD,HADA,no,N,71,,139664,26048,HEM
72,,SING,CBD,CGD,no,N,72,,139664,26048,HEM
73,,SING,CBD,HBD,no,N,73,,139664,26048,HEM
74,,SING,CBD,HBDA,no,N,74,,139664,26048,HEM
75,,DOUB,CGD,O1D,no,N,75,,139664,26048,HEM
76,,SING,CGD,O2D,no,N,76,,139664,26048,HEM
77,,SING,O2A,H2A,no,N,77,,139664,26048,HEM
78,,SING,O2D,H2D,no,N,78,,139664,26048,HEM
79,,SING,FE,NA,no,N,79,,139664,26048,HEM
80,,SING,FE,NB,no,N,80,,139664,26048,HEM
81,,SING,FE,NC,no,N,81,,139664,26048,HEM
82,,SING,FE,ND,no,N,82,,139664,26048,HEM
1,,DOUB,OH,CH,no,N,1,,139852,26059,ALY
2,,SING,CH,CH3,no,N,2,,139852,26059,ALY
3,,SING,CH,NZ,no,N,3,,139852,26059,ALY
4,,SING,CH3,HH31,no,N,4,,139852,26059,ALY
5,,SING,CH3,HH32,no,N,5,,139852,26059,ALY
6,,SING,CH3,HH33,no,N,6,,139852,26059,ALY
7,,SING,NZ,CE,no,N,7,,139852,26059,ALY
8,,SING,NZ,HZ,no,N,8,,139852,26059,ALY
9,,SING,CE,CD,no,N,9,,139852,26059,ALY
10,,SING,CE,HE3,no,N,10,,139852,26059,ALY
11,,SING,CE,HE2,no,N,11,,139852,26059,ALY
12,,SING,CD,CG,no,N,12,,139852,26059,ALY
13,,SING,CD,HD3,no,N,13,,139852,26059,ALY
14,,SING,CD,HD2,no,N,14,,139852,26059,ALY
15,,SING,CG,CB,no,N,15,,139852,26059,ALY
16,,SING,CG,HG3,no,N,16,,139852,26059,ALY
17,,SING,CG,HG2,no,N,17,,139852,26059,ALY
18,,SING,CB,CA,no,N,18,,139852,26059,ALY
19,,SING,CB,HB3,no,N,19,,139852,26059,ALY
20,,SING,CB,HB2,no,N,20,,139852,26059,ALY
21,,SING,CA,N,no,N,21,,139852,26059,ALY
22,,SING,CA,C,no,N,22,,139852,26059,ALY
23,,SING,CA,HCA,no,N,23,,139852,26059,ALY
24,,SING,N,H,no,N,24,,139852,26059,ALY
25,,SING,N,H2,no,N,25,,139852,26059,ALY
26,,DOUB,C,O,no,N,26,,139852,26059,ALY
27,,SING,C,OXT,no,N,27,,139852,26059,ALY
28,,SING,OXT,HXT,no,N,28,,139852,26059,ALY
1,,SING,CH3,CY,no,N,1,,139890,26060,KCR
2,,DOUB,CY,CX,no,E,2,,139890,26060,KCR
3,,SING,CX,CH,no,N,3,,139890,26060,KCR
4,,DOUB,OH,CH,no,N,4,,139890,26060,KCR
5,,SING,CH,NZ,no,N,5,,139890,26060,KCR
6,,SING,NZ,CE,no,N,6,,139890,26060,KCR
7,,SING,CE,CD,no,N,7,,139890,26060,KCR
8,,SING,CG,CD,no,N,8,,139890,26060,KCR
9,,SING,CG,CB,no,N,9,,139890,26060,KCR
10,,SING,CB,CA,no,N,10,,139890,26060,KCR
11,,SING,N,CA,no,N,11,,139890,26060,KCR
12,,SING,CA,C,no,N,12,,139890,26060,KCR
13,,DOUB,O,C,no,N,13,,139890,26060,KCR
14,,SING,C,O1,no,N,14,,139890,26060,KCR
15,,SING,N,H1,no,N,15,,139890,26060,KCR
16,,SING,N,H2,no,N,16,,139890,26060,KCR
17,,SING,CA,H4,no,N,17,,139890,26060,KCR
18,,SING,CB,H5,no,N,18,,139890,26060,KCR
19,,SING,CB,H6,no,N,19,,139890,26060,KCR
20,,SING,CG,H7,no,N,20,,139890,26060,KCR
21,,SING,CG,H8,no,N,21,,139890,26060,KCR
22,,SING,CD,H9,no,N,22,,139890,26060,KCR
23,,SING,CD,H10,no,N,23,,139890,26060,KCR
24,,SING,CE,H11,no,N,24,,139890,26060,KCR
25,,SING,CE,H12,no,N,25,,139890,26060,KCR
26,,SING,NZ,H13,no,N,26,,139890,26060,KCR
27,,SING,CX,H14,no,N,27,,139890,26060,KCR
28,,SING,CY,H15,no,N,28,,139890,26060,KCR
29,,SING,CH3,H16,no,N,29,,139890,26060,KCR
30,,SING,CH3,H17,no,N,30,,139890,26060,KCR
31,,SING,CH3,H18,no,N,31,,139890,26060,KCR
32,,SING,O1,H19,no,N,32,,139890,26060,KCR
1,,SING,O1,P1,no,N,1,,140571,26507,PX4
2,,SING,O1,H1P,no,N,2,,140571,26507,PX4
3,,DOUB,O2,P1,no,N,3,,140571,26507,PX4
4,,SING,P1,O3,no,N,4,,140571,26507,PX4
5,,SING,P1,O4,no,N,5,,140571,26507,PX4
6,,SING,O3,C1,no,N,6,,140571,26507,PX4
7,,SING,C1,C2,no,N,7,,140571,26507,PX4
8,,SING,C1,H1,no,N,8,,140571,26507,PX4
9,,SING,C1,H2,no,N,9,,140571,26507,PX4
10,,SING,C2,N1,no,N,10,,140571,26507,PX4
11,,SING,C2,H3,no,N,11,,140571,26507,PX4
12,,SING,C2,H4,no,N,12,,140571,26507,PX4
13,,SING,N1,C3,no,N,13,,140571,26507,PX4
14,,SING,N1,C4,no,N,14,,140571,26507,PX4
15,,SING,N1,C5,no,N,15,,140571,26507,PX4
16,,SING,C3,H5,no,N,16,,140571,26507,PX4
17,,SING,C3,H6,no,N,17,,140571,26507,PX4
18,,SING,C3,H7,no,N,18,,140571,26507,PX4
19,,SING,C4,H8,no,N,19,,140571,26507,PX4
20,,SING,C4,H9,no,N,20,,140571,26507,PX4
21,,SING,C4,H10,no,N,21,,140571,26507,PX4
22,,SING,C5,H11,no,N,22,,140571,26507,PX4
23,,SING,C5,H12,no,N,23,,140571,26507,PX4
24,,SING,C5,H13,no,N,24,,140571,26507,PX4
25,,SING,O4,C6,no,N,25,,140571,26507,PX4
26,,SING,C6,C7,no,N,26,,140571,26507,PX4
27,,SING,C6,H14,no,N,27,,140571,26507,PX4
28,,SING,C6,H15,no,N,28,,140571,26507,PX4
29,,SING,C7,C8,no,N,29,,140571,26507,PX4
30,,SING,C7,O7,no,N,30,,140571,26507,PX4
31,,SING,C7,H16,no,N,31,,140571,26507,PX4
32,,SING,C8,O5,no,N,32,,140571,26507,PX4
33,,SING,C8,H17,no,N,33,,140571,26507,PX4
34,,SING,C8,H18,no,N,34,,140571,26507,PX4
35,,SING,O5,C9,no,N,35,,140571,26507,PX4
36,,DOUB,C9,O6,no,N,36,,140571,26507,PX4
37,,SING,C9,C10,no,N,37,,140571,26507,PX4
38,,SING,C10,C11,no,N,38,,140571,26507,PX4
39,,SING,C10,H19,no,N,39,,140571,26507,PX4
40,,SING,C10,H20,no,N,40,,140571,26507,PX4
41,,SING,C11,C12,no,N,41,,140571,26507,PX4
42,,SING,C11,H21,no,N,42,,140571,26507,PX4
43,,SING,C11,H22,no,N,43,,140571,26507,PX4
44,,SING,C12,C13,no,N,44,,140571,26507,PX4
45,,SING,C12,H23,no,N,45,,140571,26507,PX4
46,,SING,C12,H24,no,N,46,,140571,26507,PX4
47,,SING,C13,C14,no,N,47,,140571,26507,PX4
48,,SING,C13,H25,no,N,48,,140571,26507,PX4
49,,SING,C13,H26,no,N,49,,140571,26507,PX4
50,,SING,C14,C15,no,N,50,,140571,26507,PX4
51,,SING,C14,H27,no,N,51,,140571,26507,PX4
52,,SING,C14,H28,no,N,52,,140571,26507,PX4
53,,SING,C15,C16,no,N,53,,140571,26507,PX4
54,,SING,C15,H29,no,N,54,,140571,26507,PX4
55,,SING,C15,H30,no,N,55,,140571,26507,PX4
56,,SING,C16,C17,no,N,56,,140571,26507,PX4
2,,SING,N,H,,,,,240396,6146,MLN_2
57,,SING,C16,H31,no,N,57,,140571,26507,PX4
58,,SING,C16,H32,no,N,58,,140571,26507,PX4
59,,SING,C17,C18,no,N,59,,140571,26507,PX4
60,,SING,C17,H33,no,N,60,,140571,26507,PX4
61,,SING,C17,H34,no,N,61,,140571,26507,PX4
62,,SING,C18,C19,no,N,62,,140571,26507,PX4
63,,SING,C18,H35,no,N,63,,140571,26507,PX4
64,,SING,C18,H36,no,N,64,,140571,26507,PX4
65,,SING,C19,C20,no,N,65,,140571,26507,PX4
66,,SING,C19,H37,no,N,66,,140571,26507,PX4
67,,SING,C19,H38,no,N,67,,140571,26507,PX4
68,,SING,C20,C21,no,N,68,,140571,26507,PX4
69,,SING,C20,H39,no,N,69,,140571,26507,PX4
70,,SING,C20,H40,no,N,70,,140571,26507,PX4
71,,SING,C21,C22,no,N,71,,140571,26507,PX4
72,,SING,C21,H41,no,N,72,,140571,26507,PX4
73,,SING,C21,H42,no,N,73,,140571,26507,PX4
74,,SING,C22,H43,no,N,74,,140571,26507,PX4
75,,SING,C22,H44,no,N,75,,140571,26507,PX4
76,,SING,C22,H45,no,N,76,,140571,26507,PX4
77,,SING,O7,C23,no,N,77,,140571,26507,PX4
78,,DOUB,C23,O8,no,N,78,,140571,26507,PX4
79,,SING,C23,C24,no,N,79,,140571,26507,PX4
80,,SING,C24,C25,no,N,80,,140571,26507,PX4
81,,SING,C24,H46,no,N,81,,140571,26507,PX4
82,,SING,C24,H47,no,N,82,,140571,26507,PX4
83,,SING,C25,C26,no,N,83,,140571,26507,PX4
84,,SING,C25,H48,no,N,84,,140571,26507,PX4
85,,SING,C25,H49,no,N,85,,140571,26507,PX4
86,,SING,C26,C27,no,N,86,,140571,26507,PX4
87,,SING,C26,H50,no,N,87,,140571,26507,PX4
88,,SING,C26,H51,no,N,88,,140571,26507,PX4
89,,SING,C27,C28,no,N,89,,140571,26507,PX4
90,,SING,C27,H52,no,N,90,,140571,26507,PX4
91,,SING,C27,H53,no,N,91,,140571,26507,PX4
92,,SING,C28,C29,no,N,92,,140571,26507,PX4
93,,SING,C28,H54,no,N,93,,140571,26507,PX4
94,,SING,C28,H55,no,N,94,,140571,26507,PX4
95,,SING,C29,C30,no,N,95,,140571,26507,PX4
96,,SING,C29,H56,no,N,96,,140571,26507,PX4
97,,SING,C29,H57,no,N,97,,140571,26507,PX4
98,,SING,C30,C31,no,N,98,,140571,26507,PX4
99,,SING,C30,H58,no,N,99,,140571,26507,PX4
100,,SING,C30,H59,no,N,100,,140571,26507,PX4
101,,SING,C31,C32,no,N,101,,140571,26507,PX4
102,,SING,C31,H60,no,N,102,,140571,26507,PX4
103,,SING,C31,H61,no,N,103,,140571,26507,PX4
104,,SING,C32,C33,no,N,104,,140571,26507,PX4
105,,SING,C32,H62,no,N,105,,140571,26507,PX4
106,,SING,C32,H63,no,N,106,,140571,26507,PX4
107,,SING,C33,C34,no,N,107,,140571,26507,PX4
108,,SING,C33,H64,no,N,108,,140571,26507,PX4
109,,SING,C33,H65,no,N,109,,140571,26507,PX4
110,,SING,C34,C35,no,N,110,,140571,26507,PX4
111,,SING,C34,H66,no,N,111,,140571,26507,PX4
112,,SING,C34,H67,no,N,112,,140571,26507,PX4
113,,SING,C35,C36,no,N,113,,140571,26507,PX4
114,,SING,C35,H68,no,N,114,,140571,26507,PX4
115,,SING,C35,H69,no,N,115,,140571,26507,PX4
116,,SING,C36,H70,no,N,116,,140571,26507,PX4
117,,SING,C36,H71,no,N,117,,140571,26507,PX4
118,,SING,C36,H72,no,N,118,,140571,26507,PX4
1,,SING,H1,O1,no,N,1,,140639,26508,lacmoid
2,,SING,O1,C1,no,N,2,,140639,26508,lacmoid
3,,DOUB,C1,C2,yes,N,3,,140639,26508,lacmoid
4,,SING,C2,H2,no,N,4,,140639,26508,lacmoid
5,,SING,C2,C3,yes,N,5,,140639,26508,lacmoid
6,,SING,C3,H3,no,N,6,,140639,26508,lacmoid
7,,DOUB,C3,C4,yes,N,7,,140639,26508,lacmoid
8,,SING,C4,C7,no,N,8,,140639,26508,lacmoid
9,,SING,C4,C5,yes,N,9,,140639,26508,lacmoid
10,,SING,C5,O2,no,N,10,,140639,26508,lacmoid
11,,SING,O2,H4,no,N,11,,140639,26508,lacmoid
12,,DOUB,C5,C6,yes,N,12,,140639,26508,lacmoid
13,,SING,C6,H5,no,N,13,,140639,26508,lacmoid
14,,SING,C6,C1,yes,N,14,,140639,26508,lacmoid
15,,DOUB,C7,C8,yes,N,15,,140639,26508,lacmoid
16,,SING,C7,C12,yes,N,16,,140639,26508,lacmoid
17,,SING,C8,C9,yes,N,17,,140639,26508,lacmoid
18,,SING,C9,C10,yes,N,18,,140639,26508,lacmoid
19,,DOUB,C10,C11,yes,N,19,,140639,26508,lacmoid
20,,SING,C11,C12,yes,N,20,,140639,26508,lacmoid
21,,SING,C8,H6,no,N,21,,140639,26508,lacmoid
22,,DOUB,C9,N1,no,N,22,,140639,26508,lacmoid
23,,SING,C10,O4,yes,N,23,,140639,26508,lacmoid
24,,SING,C11,H7,no,N,24,,140639,26508,lacmoid
25,,DOUB,C12,O3,yes,N,25,,140639,26508,lacmoid
26,,SING,N1,C13,yes,N,26,,140639,26508,lacmoid
27,,SING,C13,C14,yes,N,27,,140639,26508,lacmoid
28,,SING,C14,O4,yes,N,28,,140639,26508,lacmoid
29,,DOUB,C13,C15,yes,N,29,,140639,26508,lacmoid
30,,SING,C15,C16,yes,N,30,,140639,26508,lacmoid
31,,DOUB,C16,C17,yes,N,31,,140639,26508,lacmoid
32,,SING,C17,C18,yes,N,32,,140639,26508,lacmoid
33,,DOUB,C18,C14,yes,N,33,,140639,26508,lacmoid
34,,SING,C15,H8,no,N,34,,140639,26508,lacmoid
35,,SING,C7,N2,no,N,35,,140639,26508,lacmoid
36,,SING,N2,H9,no,N,36,,140639,26508,lacmoid
37,,SING,N2,H10,no,N,37,,140639,26508,lacmoid
38,,SING,C18,H11,no,N,38,,140639,26508,lacmoid
39,,SING,C16,C19,no,N,39,,140639,26508,lacmoid
40,,SING,C19,C20,yes,N,40,,140639,26508,lacmoid
41,,DOUB,C20,C21,yes,N,41,,140639,26508,lacmoid
42,,SING,C21,C22,yes,N,42,,140639,26508,lacmoid
43,,DOUB,C22,C23,yes,N,43,,140639,26508,lacmoid
44,,SING,C23,C24,yes,N,44,,140639,26508,lacmoid
45,,DOUB,C24,C19,yes,N,45,,140639,26508,lacmoid
46,,SING,C20,O5,no,N,46,,140639,26508,lacmoid
47,,SING,O5,H12,no,N,47,,140639,26508,lacmoid
48,,SING,C21,H13,no,N,48,,140639,26508,lacmoid
49,,SING,C22,O6,no,N,49,,140639,26508,lacmoid
50,,SING,O5,H14,no,N,50,,140639,26508,lacmoid
51,,SING,C23,H15,no,N,51,,140639,26508,lacmoid
52,,SING,C24,H16,no,N,52,,140639,26508,lacmoid
1,,SING,C1,N2,no,N,1,,140703,26511,DMP
2,,SING,C1,N7,no,N,2,,140703,26511,DMP
3,,DOUB,C1,O1,no,N,3,,140703,26511,DMP
4,,SING,C3,C4,no,N,4,,140703,26511,DMP
5,,SING,C3,C30,no,N,5,,140703,26511,DMP
6,,SING,C3,N2,no,N,6,,140703,26511,DMP
7,,SING,C3,H3,no,N,7,,140703,26511,DMP
8,,SING,C4,C5,no,N,8,,140703,26511,DMP
9,,SING,C4,O4,no,N,9,,140703,26511,DMP
10,,SING,C4,H4,no,N,10,,140703,26511,DMP
11,,SING,C5,C6,no,N,11,,140703,26511,DMP
12,,SING,C5,O5,no,N,12,,140703,26511,DMP
13,,SING,C5,H5,no,N,13,,140703,26511,DMP
14,,SING,C6,C60,no,N,14,,140703,26511,DMP
15,,SING,C6,N7,no,N,15,,140703,26511,DMP
16,,SING,C6,H6,no,N,16,,140703,26511,DMP
17,,SING,C20,C21,no,N,17,,140703,26511,DMP
18,,SING,C20,N2,no,N,18,,140703,26511,DMP
19,,SING,C20,H201,no,N,19,,140703,26511,DMP
20,,SING,C20,H202,no,N,20,,140703,26511,DMP
21,,DOUB,C21,C22,yes,N,21,,140703,26511,DMP
22,,SING,C21,C26,yes,N,22,,140703,26511,DMP
23,,SING,C22,C23,yes,N,23,,140703,26511,DMP
24,,SING,C22,H22,no,N,24,,140703,26511,DMP
25,,DOUB,C23,C24,yes,N,25,,140703,26511,DMP
26,,SING,C23,H23,no,N,26,,140703,26511,DMP
27,,SING,C24,C25,yes,N,27,,140703,26511,DMP
28,,SING,C24,C27,no,N,28,,140703,26511,DMP
29,,DOUB,C25,C26,yes,N,29,,140703,26511,DMP
30,,SING,C25,H25,no,N,30,,140703,26511,DMP
31,,SING,C26,H26,no,N,31,,140703,26511,DMP
32,,SING,C27,O27,no,N,32,,140703,26511,DMP
33,,SING,C27,H271,no,N,33,,140703,26511,DMP
34,,SING,C27,H272,no,N,34,,140703,26511,DMP
35,,SING,C30,C31,no,N,35,,140703,26511,DMP
36,,SING,C30,H301,no,N,36,,140703,26511,DMP
37,,SING,C30,H302,no,N,37,,140703,26511,DMP
38,,DOUB,C31,C32,yes,N,38,,140703,26511,DMP
39,,SING,C31,C36,yes,N,39,,140703,26511,DMP
40,,SING,C32,C33,yes,N,40,,140703,26511,DMP
41,,SING,C32,H32,no,N,41,,140703,26511,DMP
42,,DOUB,C33,C34,yes,N,42,,140703,26511,DMP
43,,SING,C33,H33,no,N,43,,140703,26511,DMP
44,,SING,C34,C35,yes,N,44,,140703,26511,DMP
45,,SING,C34,H34,no,N,45,,140703,26511,DMP
46,,DOUB,C35,C36,yes,N,46,,140703,26511,DMP
47,,SING,C35,H35,no,N,47,,140703,26511,DMP
48,,SING,C36,H36,no,N,48,,140703,26511,DMP
49,,SING,C60,C61,no,N,49,,140703,26511,DMP
50,,SING,C60,H601,no,N,50,,140703,26511,DMP
51,,SING,C60,H602,no,N,51,,140703,26511,DMP
52,,DOUB,C61,C62,yes,N,52,,140703,26511,DMP
53,,SING,C61,C66,yes,N,53,,140703,26511,DMP
54,,SING,C62,C63,yes,N,54,,140703,26511,DMP
55,,SING,C62,H62,no,N,55,,140703,26511,DMP
56,,DOUB,C63,C64,yes,N,56,,140703,26511,DMP
57,,SING,C63,H63,no,N,57,,140703,26511,DMP
58,,SING,C64,C65,yes,N,58,,140703,26511,DMP
59,,SING,C64,H64,no,N,59,,140703,26511,DMP
60,,DOUB,C65,C66,yes,N,60,,140703,26511,DMP
61,,SING,C65,H65,no,N,61,,140703,26511,DMP
62,,SING,C66,H66,no,N,62,,140703,26511,DMP
63,,SING,C70,C71,no,N,63,,140703,26511,DMP
64,,SING,C70,N7,no,N,64,,140703,26511,DMP
65,,SING,C70,H701,no,N,65,,140703,26511,DMP
66,,SING,C70,H702,no,N,66,,140703,26511,DMP
67,,DOUB,C71,C72,yes,N,67,,140703,26511,DMP
68,,SING,C71,C76,yes,N,68,,140703,26511,DMP
69,,SING,C72,C73,yes,N,69,,140703,26511,DMP
70,,SING,C72,H72,no,N,70,,140703,26511,DMP
71,,DOUB,C73,C74,yes,N,71,,140703,26511,DMP
72,,SING,C73,H73,no,N,72,,140703,26511,DMP
73,,SING,C74,C75,yes,N,73,,140703,26511,DMP
74,,SING,C74,C77,no,N,74,,140703,26511,DMP
75,,DOUB,C75,C76,yes,N,75,,140703,26511,DMP
76,,SING,C75,H75,no,N,76,,140703,26511,DMP
77,,SING,C76,H76,no,N,77,,140703,26511,DMP
78,,SING,C77,O77,no,N,78,,140703,26511,DMP
79,,SING,C77,H771,no,N,79,,140703,26511,DMP
80,,SING,C77,H772,no,N,80,,140703,26511,DMP
81,,SING,O4,HO4,no,N,81,,140703,26511,DMP
82,,SING,O5,HO5,no,N,82,,140703,26511,DMP
83,,SING,O27,HO27,no,N,83,,140703,26511,DMP
84,,SING,O77,HO77,no,N,84,,140703,26511,DMP
1,,SING,N,CA,no,N,1,,140777,26514,GLN
2,,SING,N,H,no,N,2,,140777,26514,GLN
3,,SING,N,H2,no,N,3,,140777,26514,GLN
4,,SING,CA,C,no,N,4,,140777,26514,GLN
5,,SING,CA,CB,no,N,5,,140777,26514,GLN
6,,SING,CA,HA,no,N,6,,140777,26514,GLN
7,,DOUB,C,O,no,N,7,,140777,26514,GLN
8,,SING,C,OXT,no,N,8,,140777,26514,GLN
9,,SING,CB,CG,no,N,9,,140777,26514,GLN
10,,SING,CB,HB2,no,N,10,,140777,26514,GLN
11,,SING,CB,HB3,no,N,11,,140777,26514,GLN
12,,SING,CG,CD,no,N,12,,140777,26514,GLN
13,,SING,CG,HG2,no,N,13,,140777,26514,GLN
14,,SING,CG,HG3,no,N,14,,140777,26514,GLN
15,,DOUB,CD,OE1,no,N,15,,140777,26514,GLN
16,,SING,CD,NE2,no,N,16,,140777,26514,GLN
17,,SING,NE2,HE21,no,N,17,,140777,26514,GLN
18,,SING,NE2,HE22,no,N,18,,140777,26514,GLN
19,,SING,OXT,HXT,no,N,19,,140777,26514,GLN
1,,SING,OAA,SAD,no,N,1,,140833,26516,CGO
2,,DOUB,CAB,CBP,yes,N,2,,140833,26516,CGO
3,,SING,CAB,CBT,yes,N,3,,140833,26516,CGO
4,,DOUB,OAC,SAD,no,N,4,,140833,26516,CGO
5,,DOUB,SAD,OAE,no,N,5,,140833,26516,CGO
6,,SING,SAD,CAI,no,N,6,,140833,26516,CGO
7,,DOUB,CAF,CAG,yes,N,7,,140833,26516,CGO
8,,SING,CAF,CAK,yes,N,8,,140833,26516,CGO
9,,SING,CAG,CAH,yes,N,9,,140833,26516,CGO
10,,DOUB,CAH,CAI,yes,N,10,,140833,26516,CGO
11,,SING,CAH,CAM,yes,N,11,,140833,26516,CGO
12,,SING,CAI,CAJ,yes,N,12,,140833,26516,CGO
13,,DOUB,CAJ,CAO,yes,N,13,,140833,26516,CGO
14,,DOUB,CAK,CAL,yes,N,14,,140833,26516,CGO
15,,SING,CAL,CAM,yes,N,15,,140833,26516,CGO
16,,DOUB,CAM,CAN,yes,N,16,,140833,26516,CGO
17,,SING,CAN,CAO,yes,N,17,,140833,26516,CGO
18,,SING,CAN,NAV,no,N,18,,140833,26516,CGO
19,,SING,CAO,NAP,no,N,19,,140833,26516,CGO
20,,DOUB,NAP,NAQ,no,N,20,,140833,26516,CGO
21,,SING,NAQ,CAR,no,N,21,,140833,26516,CGO
22,,DOUB,CAR,CAS,yes,N,22,,140833,26516,CGO
23,,SING,CAR,CAW,yes,N,23,,140833,26516,CGO
24,,SING,CAS,CAT,yes,N,24,,140833,26516,CGO
25,,DOUB,CAT,CAY,yes,N,25,,140833,26516,CGO
26,,SING,OAU,SBC,no,N,26,,140833,26516,CGO
27,,DOUB,CAW,CAX,yes,N,27,,140833,26516,CGO
28,,SING,CAX,CAY,yes,N,28,,140833,26516,CGO
29,,SING,CAY,CAZ,yes,N,29,,140833,26516,CGO
30,,DOUB,CAZ,CBA,yes,N,30,,140833,26516,CGO
31,,SING,CAZ,CBG,yes,N,31,,140833,26516,CGO
32,,SING,CBA,CBB,yes,N,32,,140833,26516,CGO
33,,DOUB,CBB,CBI,yes,N,33,,140833,26516,CGO
34,,DOUB,SBC,OBE,no,N,34,,140833,26516,CGO
35,,DOUB,SBC,OBF,no,N,35,,140833,26516,CGO
36,,SING,SBC,CBR,no,N,36,,140833,26516,CGO
37,,SING,NBD,CBM,no,N,37,,140833,26516,CGO
38,,DOUB,CBG,CBH,yes,N,38,,140833,26516,CGO
39,,SING,CBH,CBI,yes,N,39,,140833,26516,CGO
40,,SING,CBI,NBJ,no,N,40,,140833,26516,CGO
41,,DOUB,NBJ,NBK,no,N,41,,140833,26516,CGO
42,,SING,NBK,CBL,no,N,42,,140833,26516,CGO
43,,DOUB,CBL,CBM,yes,N,43,,140833,26516,CGO
44,,SING,CBL,CBQ,yes,N,44,,140833,26516,CGO
45,,SING,CBM,CBN,yes,N,45,,140833,26516,CGO
46,,DOUB,CBN,CBO,yes,N,46,,140833,26516,CGO
47,,SING,CBN,CBS,yes,N,47,,140833,26516,CGO
48,,SING,CBO,CBP,yes,N,48,,140833,26516,CGO
49,,DOUB,CBQ,CBR,yes,N,49,,140833,26516,CGO
50,,SING,CBR,CBS,yes,N,50,,140833,26516,CGO
51,,DOUB,CBS,CBT,yes,N,51,,140833,26516,CGO
52,,SING,OAA,NAA,no,N,52,,140833,26516,CGO
53,,SING,CAB,HAB,no,N,53,,140833,26516,CGO
54,,SING,CAF,HAF,no,N,54,,140833,26516,CGO
55,,SING,CAG,HAG,no,N,55,,140833,26516,CGO
56,,SING,CAJ,HAJ,no,N,56,,140833,26516,CGO
57,,SING,CAK,HAK,no,N,57,,140833,26516,CGO
58,,SING,CAL,HAL,no,N,58,,140833,26516,CGO
59,,SING,CAS,HAS,no,N,59,,140833,26516,CGO
60,,SING,CAT,HAT,no,N,60,,140833,26516,CGO
61,,SING,OAU,NAU,no,N,61,,140833,26516,CGO
62,,SING,NAV,HNAV,no,N,62,,140833,26516,CGO
63,,SING,NAV,HNAA,no,N,63,,140833,26516,CGO
64,,SING,CAW,HAW,no,N,64,,140833,26516,CGO
65,,SING,CAX,HAX,no,N,65,,140833,26516,CGO
66,,SING,CBA,HBA,no,N,66,,140833,26516,CGO
67,,SING,CBB,HBB,no,N,67,,140833,26516,CGO
68,,SING,NBD,HNBD,no,N,68,,140833,26516,CGO
69,,SING,NBD,HNBA,no,N,69,,140833,26516,CGO
70,,SING,CBG,HBG,no,N,70,,140833,26516,CGO
71,,SING,CBH,HBH,no,N,71,,140833,26516,CGO
72,,SING,CBO,HBO,no,N,72,,140833,26516,CGO
73,,SING,CBP,HBP,no,N,73,,140833,26516,CGO
74,,SING,CBQ,HBQ,no,N,74,,140833,26516,CGO
75,,SING,CBT,HBT,no,N,75,,140833,26516,CGO
1,,SING,BE,F1,no,N,1,,141066,26532,BEF
2,,SING,BE,F2,no,N,2,,141066,26532,BEF
3,,SING,BE,F3,no,N,3,,141066,26532,BEF
1,,SING,BE,F1,no,N,1,,141121,26535,BEF
2,,SING,BE,F2,no,N,2,,141121,26535,BEF
3,,SING,BE,F3,no,N,3,,141121,26535,BEF
1,,SING,N,CA,no,N,1,,141137,26536,AIB
2,,SING,N,H,no,N,2,,141137,26536,AIB
3,,SING,N,H2,no,N,3,,141137,26536,AIB
4,,SING,CA,C,no,N,4,,141137,26536,AIB
5,,SING,CA,CB1,no,N,5,,141137,26536,AIB
6,,SING,CA,CB2,no,N,6,,141137,26536,AIB
7,,DOUB,C,O,no,N,7,,141137,26536,AIB
8,,SING,C,OXT,no,N,8,,141137,26536,AIB
9,,SING,OXT,HO2,no,N,9,,141137,26536,AIB
10,,SING,CB1,HB11,no,N,10,,141137,26536,AIB
11,,SING,CB1,HB12,no,N,11,,141137,26536,AIB
12,,SING,CB1,HB13,no,N,12,,141137,26536,AIB
13,,SING,CB2,HB21,no,N,13,,141137,26536,AIB
14,,SING,CB2,HB22,no,N,14,,141137,26536,AIB
15,,SING,CB2,HB23,no,N,15,,141137,26536,AIB
1,,SING,N,CA,no,N,1,,141152,26537,AIB
2,,SING,N,H,no,N,2,,141152,26537,AIB
3,,SING,N,H2,no,N,3,,141152,26537,AIB
4,,SING,CA,C,no,N,4,,141152,26537,AIB
5,,SING,CA,CB1,no,N,5,,141152,26537,AIB
6,,SING,CA,CB2,no,N,6,,141152,26537,AIB
7,,DOUB,C,O,no,N,7,,141152,26537,AIB
8,,SING,C,OXT,no,N,8,,141152,26537,AIB
9,,SING,OXT,HO2,no,N,9,,141152,26537,AIB
10,,SING,CB1,HB11,no,N,10,,141152,26537,AIB
11,,SING,CB1,HB12,no,N,11,,141152,26537,AIB
12,,SING,CB1,HB13,no,N,12,,141152,26537,AIB
13,,SING,CB2,HB21,no,N,13,,141152,26537,AIB
14,,SING,CB2,HB22,no,N,14,,141152,26537,AIB
15,,SING,CB2,HB23,no,N,15,,141152,26537,AIB
1,,SING,CA,C,no,N,1,,141153,26537,PH8
2,,DOUB,O,C,no,N,2,,141153,26537,PH8
3,,SING,C,OXT,no,N,3,,141153,26537,PH8
4,,SING,CA,N,no,N,4,,141153,26537,PH8
5,,SING,N,HN,no,N,5,,141153,26537,PH8
6,,SING,N,HNA,no,N,6,,141153,26537,PH8
7,,SING,CB,CA,no,N,7,,141153,26537,PH8
8,,SING,HA,CA,no,N,8,,141153,26537,PH8
9,,SING,CI,CB,no,N,9,,141153,26537,PH8
10,,SING,HBA,CB,no,N,10,,141153,26537,PH8
11,,SING,CB,HB,no,N,11,,141153,26537,PH8
12,,DOUB,CD2,CG,yes,N,12,,141153,26537,PH8
13,,SING,CJ,CG,no,N,13,,141153,26537,PH8
14,,SING,CG,CD1,yes,N,14,,141153,26537,PH8
15,,SING,CJ,CI,no,N,15,,141153,26537,PH8
16,,SING,HIA,CI,no,N,16,,141153,26537,PH8
17,,SING,CI,HI,no,N,17,,141153,26537,PH8
18,,SING,HJ,CJ,no,N,18,,141153,26537,PH8
19,,SING,CJ,HJA,no,N,19,,141153,26537,PH8
20,,DOUB,CE2,CZ,yes,N,20,,141153,26537,PH8
21,,SING,CZ,HZ,no,N,21,,141153,26537,PH8
22,,SING,CZ,CE1,yes,N,22,,141153,26537,PH8
23,,DOUB,CD1,CE1,yes,N,23,,141153,26537,PH8
24,,SING,CD1,HD1,no,N,24,,141153,26537,PH8
25,,SING,HD2,CD2,no,N,25,,141153,26537,PH8
26,,SING,CD2,CE2,yes,N,26,,141153,26537,PH8
27,,SING,CE1,HE1,no,N,27,,141153,26537,PH8
28,,SING,HE2,CE2,no,N,28,,141153,26537,PH8
29,,SING,OXT,HXT,no,N,29,,141153,26537,PH8
1,,SING,N,HN1,no,N,1,,141154,26537,NH2
2,,SING,N,HN2,no,N,2,,141154,26537,NH2
1,,SING,OXT,C,no,N,1,,141169,26538,KCY
2,,DOUB,O,C,no,N,2,,141169,26538,KCY
3,,SING,C,CA,no,N,3,,141169,26538,KCY
4,,SING,CA,N,no,N,4,,141169,26538,KCY
5,,SING,N,HN,no,N,5,,141169,26538,KCY
6,,SING,N,HNA,no,N,6,,141169,26538,KCY
7,,SING,OXT,HXT,no,N,7,,141169,26538,KCY
8,,SING,CB,CA,no,N,8,,141169,26538,KCY
9,,SING,CA,HA,no,N,9,,141169,26538,KCY
10,,SING,HBA,CB,no,N,10,,141169,26538,KCY
11,,SING,CG,CB,no,N,11,,141169,26538,KCY
12,,SING,CB,HB,no,N,12,,141169,26538,KCY
13,,SING,SD,CG,no,N,13,,141169,26538,KCY
14,,SING,SD,HSD,no,N,14,,141169,26538,KCY
15,,SING,CG,HG,no,N,15,,141169,26538,KCY
16,,SING,CG,HGA,no,N,16,,141169,26538,KCY
1,,SING,N,CA,no,N,1,,141170,26538,HCS
2,,SING,N,H,no,N,2,,141170,26538,HCS
3,,SING,N,H2,no,N,3,,141170,26538,HCS
4,,SING,CA,CB,no,N,4,,141170,26538,HCS
5,,SING,CA,C,no,N,5,,141170,26538,HCS
6,,SING,CA,HCA,no,N,6,,141170,26538,HCS
7,,SING,CB,CG,no,N,7,,141170,26538,HCS
8,,SING,CB,HB2,no,N,8,,141170,26538,HCS
9,,SING,CB,HB3,no,N,9,,141170,26538,HCS
10,,SING,CG,SD,no,N,10,,141170,26538,HCS
11,,SING,CG,HG2,no,N,11,,141170,26538,HCS
12,,SING,CG,HG3,no,N,12,,141170,26538,HCS
13,,SING,SD,HD,no,N,13,,141170,26538,HCS
14,,SING,C,OXT,no,N,14,,141170,26538,HCS
15,,DOUB,C,O,no,N,15,,141170,26538,HCS
16,,SING,OXT,HXT,no,N,16,,141170,26538,HCS
1,,SING,CA,C,no,N,1,,141171,26538,PH8
2,,DOUB,O,C,no,N,2,,141171,26538,PH8
3,,SING,C,OXT,no,N,3,,141171,26538,PH8
4,,SING,CA,N,no,N,4,,141171,26538,PH8
5,,SING,N,HN,no,N,5,,141171,26538,PH8
6,,SING,N,HNA,no,N,6,,141171,26538,PH8
7,,SING,CB,CA,no,N,7,,141171,26538,PH8
8,,SING,HA,CA,no,N,8,,141171,26538,PH8
9,,SING,CI,CB,no,N,9,,141171,26538,PH8
3,,SING,CA,CB,,,,,240396,6146,MLN_2
10,,SING,HBA,CB,no,N,10,,141171,26538,PH8
11,,SING,CB,HB,no,N,11,,141171,26538,PH8
12,,DOUB,CD2,CG,yes,N,12,,141171,26538,PH8
13,,SING,CJ,CG,no,N,13,,141171,26538,PH8
14,,SING,CG,CD1,yes,N,14,,141171,26538,PH8
15,,SING,CJ,CI,no,N,15,,141171,26538,PH8
16,,SING,HIA,CI,no,N,16,,141171,26538,PH8
17,,SING,CI,HI,no,N,17,,141171,26538,PH8
18,,SING,HJ,CJ,no,N,18,,141171,26538,PH8
19,,SING,CJ,HJA,no,N,19,,141171,26538,PH8
20,,DOUB,CE2,CZ,yes,N,20,,141171,26538,PH8
21,,SING,CZ,HZ,no,N,21,,141171,26538,PH8
22,,SING,CZ,CE1,yes,N,22,,141171,26538,PH8
23,,DOUB,CD1,CE1,yes,N,23,,141171,26538,PH8
24,,SING,CD1,HD1,no,N,24,,141171,26538,PH8
25,,SING,HD2,CD2,no,N,25,,141171,26538,PH8
26,,SING,CD2,CE2,yes,N,26,,141171,26538,PH8
27,,SING,CE1,HE1,no,N,27,,141171,26538,PH8
28,,SING,HE2,CE2,no,N,28,,141171,26538,PH8
29,,SING,OXT,HXT,no,N,29,,141171,26538,PH8
1,,SING,N,HN1,no,N,1,,141172,26538,NH2
2,,SING,N,HN2,no,N,2,,141172,26538,NH2
1,,SING,N,CA,no,N,1,,141234,26545,TPO
2,,SING,N,H,no,N,2,,141234,26545,TPO
3,,SING,N,H2,no,N,3,,141234,26545,TPO
4,,SING,CA,CB,no,N,4,,141234,26545,TPO
5,,SING,CA,C,no,N,5,,141234,26545,TPO
6,,SING,CA,HA,no,N,6,,141234,26545,TPO
7,,SING,CB,CG2,no,N,7,,141234,26545,TPO
8,,SING,CB,OG1,no,N,8,,141234,26545,TPO
9,,SING,CB,HB,no,N,9,,141234,26545,TPO
10,,SING,CG2,HG21,no,N,10,,141234,26545,TPO
11,,SING,CG2,HG22,no,N,11,,141234,26545,TPO
12,,SING,CG2,HG23,no,N,12,,141234,26545,TPO
13,,SING,OG1,P,no,N,13,,141234,26545,TPO
14,,DOUB,P,O1P,no,N,14,,141234,26545,TPO
15,,SING,P,O2P,no,N,15,,141234,26545,TPO
16,,SING,P,O3P,no,N,16,,141234,26545,TPO
17,,SING,O2P,HOP2,no,N,17,,141234,26545,TPO
18,,SING,O3P,HOP3,no,N,18,,141234,26545,TPO
19,,DOUB,C,O,no,N,19,,141234,26545,TPO
20,,SING,C,OXT,no,N,20,,141234,26545,TPO
21,,SING,OXT,HXT,no,N,21,,141234,26545,TPO
1,,DOUB,CHA,C1A,no,Z,1,,141617,26577,CYC
2,,SING,CHA,C4D,no,N,2,,141617,26577,CYC
3,,SING,CHA,HHA,no,N,3,,141617,26577,CYC
4,,SING,NA,C1A,no,N,4,,141617,26577,CYC
5,,DOUB,NA,C4A,no,N,5,,141617,26577,CYC
6,,SING,C1A,C2A,no,N,6,,141617,26577,CYC
7,,DOUB,C2A,C3A,no,N,7,,141617,26577,CYC
8,,SING,C2A,CAA,no,N,8,,141617,26577,CYC
9,,SING,C3A,C4A,no,N,9,,141617,26577,CYC
10,,SING,C3A,CMA,no,N,10,,141617,26577,CYC
11,,SING,C4A,CHB,no,N,11,,141617,26577,CYC
12,,SING,CMA,HMA1,no,N,12,,141617,26577,CYC
13,,SING,CMA,HMA2,no,N,13,,141617,26577,CYC
14,,SING,CMA,HMA3,no,N,14,,141617,26577,CYC
15,,SING,CAA,CBA,no,N,15,,141617,26577,CYC
16,,SING,CAA,HAA1,no,N,16,,141617,26577,CYC
17,,SING,CAA,HAA2,no,N,17,,141617,26577,CYC
18,,SING,CBA,CGA,no,N,18,,141617,26577,CYC
19,,SING,CBA,HBA1,no,N,19,,141617,26577,CYC
20,,SING,CBA,HBA2,no,N,20,,141617,26577,CYC
21,,DOUB,CGA,O1A,no,N,21,,141617,26577,CYC
22,,SING,CGA,O2A,no,N,22,,141617,26577,CYC
23,,SING,O2A,H2A,no,N,23,,141617,26577,CYC
24,,DOUB,CHB,C1B,no,Z,24,,141617,26577,CYC
25,,SING,CHB,HHB,no,N,25,,141617,26577,CYC
26,,SING,NB,C1B,no,N,26,,141617,26577,CYC
27,,SING,NB,C4B,no,N,27,,141617,26577,CYC
28,,SING,NB,HB,no,N,28,,141617,26577,CYC
29,,SING,C1B,C2B,no,N,29,,141617,26577,CYC
30,,DOUB,C2B,C3B,no,N,30,,141617,26577,CYC
31,,SING,C2B,CMB,no,N,31,,141617,26577,CYC
32,,SING,C3B,C4B,no,N,32,,141617,26577,CYC
33,,SING,C3B,CAB,no,N,33,,141617,26577,CYC
34,,DOUB,C4B,OB,no,N,34,,141617,26577,CYC
35,,SING,CMB,HMB1,no,N,35,,141617,26577,CYC
36,,SING,CMB,HMB2,no,N,36,,141617,26577,CYC
37,,SING,CMB,HMB3,no,N,37,,141617,26577,CYC
38,,SING,CAB,CBB,no,N,38,,141617,26577,CYC
39,,SING,CAB,HAB1,no,N,39,,141617,26577,CYC
40,,SING,CAB,HAB2,no,N,40,,141617,26577,CYC
41,,SING,CBB,HBB1,no,N,41,,141617,26577,CYC
42,,SING,CBB,HBB2,no,N,42,,141617,26577,CYC
43,,SING,CBB,HBB3,no,N,43,,141617,26577,CYC
44,,SING,NC,C1C,no,N,44,,141617,26577,CYC
45,,SING,NC,C4C,no,N,45,,141617,26577,CYC
46,,SING,NC,HC,no,N,46,,141617,26577,CYC
47,,SING,C1C,C2C,no,N,47,,141617,26577,CYC
48,,DOUB,C1C,OC,no,N,48,,141617,26577,CYC
49,,SING,C2C,C3C,no,N,49,,141617,26577,CYC
50,,SING,C2C,CMC,no,N,50,,141617,26577,CYC
51,,SING,C2C,H2C,no,N,51,,141617,26577,CYC
52,,SING,C3C,C4C,no,N,52,,141617,26577,CYC
53,,SING,C3C,CAC,no,N,53,,141617,26577,CYC
54,,SING,C3C,H3C,no,N,54,,141617,26577,CYC
55,,DOUB,C4C,CHD,no,Z,55,,141617,26577,CYC
56,,SING,CMC,HMC1,no,N,56,,141617,26577,CYC
57,,SING,CMC,HMC2,no,N,57,,141617,26577,CYC
58,,SING,CMC,HMC3,no,N,58,,141617,26577,CYC
59,,SING,CAC,CBC,no,N,59,,141617,26577,CYC
60,,SING,CAC,HAC1,no,N,60,,141617,26577,CYC
61,,SING,CAC,HAC2,no,N,61,,141617,26577,CYC
62,,SING,CBC,HBC1,no,N,62,,141617,26577,CYC
63,,SING,CBC,HBC2,no,N,63,,141617,26577,CYC
64,,SING,CBC,HBC3,no,N,64,,141617,26577,CYC
65,,SING,CHD,C1D,no,N,65,,141617,26577,CYC
66,,SING,CHD,HHD,no,N,66,,141617,26577,CYC
67,,SING,ND,C1D,yes,N,67,,141617,26577,CYC
68,,SING,ND,C4D,yes,N,68,,141617,26577,CYC
69,,SING,ND,HD,no,N,69,,141617,26577,CYC
70,,DOUB,C1D,C2D,yes,N,70,,141617,26577,CYC
71,,SING,C2D,C3D,yes,N,71,,141617,26577,CYC
72,,SING,C2D,CMD,no,N,72,,141617,26577,CYC
73,,DOUB,C3D,C4D,yes,N,73,,141617,26577,CYC
74,,SING,C3D,CAD,no,N,74,,141617,26577,CYC
75,,SING,CMD,HMD1,no,N,75,,141617,26577,CYC
76,,SING,CMD,HMD2,no,N,76,,141617,26577,CYC
77,,SING,CMD,HMD3,no,N,77,,141617,26577,CYC
78,,SING,CAD,CBD,no,N,78,,141617,26577,CYC
79,,SING,CAD,HAD1,no,N,79,,141617,26577,CYC
80,,SING,CAD,HAD2,no,N,80,,141617,26577,CYC
81,,SING,CBD,CGD,no,N,81,,141617,26577,CYC
82,,SING,CBD,HBD1,no,N,82,,141617,26577,CYC
83,,SING,CBD,HBD2,no,N,83,,141617,26577,CYC
84,,DOUB,CGD,O1D,no,N,84,,141617,26577,CYC
85,,SING,CGD,O2D,no,N,85,,141617,26577,CYC
86,,SING,O2D,H2D,no,N,86,,141617,26577,CYC
1,,SING,FE,NA,no,N,1,,141635,26578,HEC
2,,SING,FE,NB,no,N,2,,141635,26578,HEC
3,,SING,FE,NC,no,N,3,,141635,26578,HEC
4,,SING,FE,ND,no,N,4,,141635,26578,HEC
5,,DOUB,CHA,C1A,no,N,5,,141635,26578,HEC
6,,SING,CHA,C4D,no,N,6,,141635,26578,HEC
7,,SING,CHA,HHA,no,N,7,,141635,26578,HEC
8,,DOUB,CHB,C4A,no,N,8,,141635,26578,HEC
9,,SING,CHB,C1B,no,N,9,,141635,26578,HEC
10,,SING,CHB,HHB,no,N,10,,141635,26578,HEC
11,,DOUB,CHC,C4B,no,N,11,,141635,26578,HEC
12,,SING,CHC,C1C,no,N,12,,141635,26578,HEC
13,,SING,CHC,HHC,no,N,13,,141635,26578,HEC
14,,DOUB,CHD,C4C,no,N,14,,141635,26578,HEC
15,,SING,CHD,C1D,no,N,15,,141635,26578,HEC
16,,SING,CHD,HHD,no,N,16,,141635,26578,HEC
17,,SING,NA,C1A,yes,N,17,,141635,26578,HEC
18,,SING,NA,C4A,yes,N,18,,141635,26578,HEC
19,,SING,C1A,C2A,yes,N,19,,141635,26578,HEC
20,,DOUB,C2A,C3A,yes,N,20,,141635,26578,HEC
21,,SING,C2A,CAA,no,N,21,,141635,26578,HEC
22,,SING,C3A,C4A,yes,N,22,,141635,26578,HEC
23,,SING,C3A,CMA,no,N,23,,141635,26578,HEC
24,,SING,CMA,HMA1,no,N,24,,141635,26578,HEC
25,,SING,CMA,HMA2,no,N,25,,141635,26578,HEC
26,,SING,CMA,HMA3,no,N,26,,141635,26578,HEC
27,,SING,CAA,CBA,no,N,27,,141635,26578,HEC
28,,SING,CAA,HAA1,no,N,28,,141635,26578,HEC
29,,SING,CAA,HAA2,no,N,29,,141635,26578,HEC
30,,SING,CBA,CGA,no,N,30,,141635,26578,HEC
31,,SING,CBA,HBA1,no,N,31,,141635,26578,HEC
32,,SING,CBA,HBA2,no,N,32,,141635,26578,HEC
33,,DOUB,CGA,O1A,no,N,33,,141635,26578,HEC
34,,SING,CGA,O2A,no,N,34,,141635,26578,HEC
35,,SING,O2A,H2A,no,N,35,,141635,26578,HEC
36,,SING,NB,C1B,yes,N,36,,141635,26578,HEC
37,,SING,NB,C4B,yes,N,37,,141635,26578,HEC
38,,DOUB,C1B,C2B,yes,N,38,,141635,26578,HEC
39,,SING,C2B,C3B,yes,N,39,,141635,26578,HEC
40,,SING,C2B,CMB,no,N,40,,141635,26578,HEC
41,,SING,C3B,C4B,yes,N,41,,141635,26578,HEC
42,,DOUB,C3B,CAB,no,E,42,,141635,26578,HEC
43,,SING,CMB,HMB1,no,N,43,,141635,26578,HEC
44,,SING,CMB,HMB2,no,N,44,,141635,26578,HEC
45,,SING,CMB,HMB3,no,N,45,,141635,26578,HEC
46,,SING,CAB,CBB,no,N,46,,141635,26578,HEC
47,,SING,CAB,HAB,no,N,47,,141635,26578,HEC
48,,SING,CBB,HBB1,no,N,48,,141635,26578,HEC
49,,SING,CBB,HBB2,no,N,49,,141635,26578,HEC
50,,SING,CBB,HBB3,no,N,50,,141635,26578,HEC
51,,SING,NC,C1C,yes,N,51,,141635,26578,HEC
52,,SING,NC,C4C,yes,N,52,,141635,26578,HEC
53,,DOUB,C1C,C2C,yes,N,53,,141635,26578,HEC
54,,SING,C2C,C3C,yes,N,54,,141635,26578,HEC
55,,SING,C2C,CMC,no,N,55,,141635,26578,HEC
56,,SING,C3C,C4C,yes,N,56,,141635,26578,HEC
57,,DOUB,C3C,CAC,no,E,57,,141635,26578,HEC
58,,SING,CMC,HMC1,no,N,58,,141635,26578,HEC
59,,SING,CMC,HMC2,no,N,59,,141635,26578,HEC
60,,SING,CMC,HMC3,no,N,60,,141635,26578,HEC
61,,SING,CAC,CBC,no,N,61,,141635,26578,HEC
62,,SING,CAC,HAC,no,N,62,,141635,26578,HEC
63,,SING,CBC,HBC1,no,N,63,,141635,26578,HEC
64,,SING,CBC,HBC2,no,N,64,,141635,26578,HEC
65,,SING,CBC,HBC3,no,N,65,,141635,26578,HEC
66,,SING,ND,C1D,yes,N,66,,141635,26578,HEC
67,,SING,ND,C4D,yes,N,67,,141635,26578,HEC
68,,DOUB,C1D,C2D,yes,N,68,,141635,26578,HEC
69,,SING,C2D,C3D,yes,N,69,,141635,26578,HEC
70,,SING,C2D,CMD,no,N,70,,141635,26578,HEC
71,,DOUB,C3D,C4D,yes,N,71,,141635,26578,HEC
72,,SING,C3D,CAD,no,N,72,,141635,26578,HEC
73,,SING,CMD,HMD1,no,N,73,,141635,26578,HEC
74,,SING,CMD,HMD2,no,N,74,,141635,26578,HEC
75,,SING,CMD,HMD3,no,N,75,,141635,26578,HEC
76,,SING,CAD,CBD,no,N,76,,141635,26578,HEC
77,,SING,CAD,HAD1,no,N,77,,141635,26578,HEC
78,,SING,CAD,HAD2,no,N,78,,141635,26578,HEC
79,,SING,CBD,CGD,no,N,79,,141635,26578,HEC
80,,SING,CBD,HBD1,no,N,80,,141635,26578,HEC
81,,SING,CBD,HBD2,no,N,81,,141635,26578,HEC
82,,DOUB,CGD,O1D,no,N,82,,141635,26578,HEC
83,,SING,CGD,O2D,no,N,83,,141635,26578,HEC
84,,SING,O2D,H2D,no,N,84,,141635,26578,HEC
1,,DOUB,CHA,C1A,no,Z,1,,141700,26582,CYC
2,,SING,CHA,C4D,no,N,2,,141700,26582,CYC
3,,SING,CHA,HHA,no,N,3,,141700,26582,CYC
4,,SING,NA,C1A,no,N,4,,141700,26582,CYC
5,,DOUB,NA,C4A,no,N,5,,141700,26582,CYC
6,,SING,C1A,C2A,no,N,6,,141700,26582,CYC
7,,DOUB,C2A,C3A,no,N,7,,141700,26582,CYC
8,,SING,C2A,CAA,no,N,8,,141700,26582,CYC
9,,SING,C3A,C4A,no,N,9,,141700,26582,CYC
10,,SING,C3A,CMA,no,N,10,,141700,26582,CYC
11,,SING,C4A,CHB,no,N,11,,141700,26582,CYC
12,,SING,CMA,HMA1,no,N,12,,141700,26582,CYC
13,,SING,CMA,HMA2,no,N,13,,141700,26582,CYC
14,,SING,CMA,HMA3,no,N,14,,141700,26582,CYC
15,,SING,CAA,CBA,no,N,15,,141700,26582,CYC
16,,SING,CAA,HAA1,no,N,16,,141700,26582,CYC
17,,SING,CAA,HAA2,no,N,17,,141700,26582,CYC
18,,SING,CBA,CGA,no,N,18,,141700,26582,CYC
19,,SING,CBA,HBA1,no,N,19,,141700,26582,CYC
20,,SING,CBA,HBA2,no,N,20,,141700,26582,CYC
21,,DOUB,CGA,O1A,no,N,21,,141700,26582,CYC
22,,SING,CGA,O2A,no,N,22,,141700,26582,CYC
23,,SING,O2A,H2A,no,N,23,,141700,26582,CYC
24,,DOUB,CHB,C1B,no,Z,24,,141700,26582,CYC
25,,SING,CHB,HHB,no,N,25,,141700,26582,CYC
26,,SING,NB,C1B,no,N,26,,141700,26582,CYC
27,,SING,NB,C4B,no,N,27,,141700,26582,CYC
28,,SING,NB,HB,no,N,28,,141700,26582,CYC
29,,SING,C1B,C2B,no,N,29,,141700,26582,CYC
30,,DOUB,C2B,C3B,no,N,30,,141700,26582,CYC
31,,SING,C2B,CMB,no,N,31,,141700,26582,CYC
32,,SING,C3B,C4B,no,N,32,,141700,26582,CYC
33,,SING,C3B,CAB,no,N,33,,141700,26582,CYC
34,,DOUB,C4B,OB,no,N,34,,141700,26582,CYC
35,,SING,CMB,HMB1,no,N,35,,141700,26582,CYC
36,,SING,CMB,HMB2,no,N,36,,141700,26582,CYC
37,,SING,CMB,HMB3,no,N,37,,141700,26582,CYC
38,,SING,CAB,CBB,no,N,38,,141700,26582,CYC
39,,SING,CAB,HAB1,no,N,39,,141700,26582,CYC
40,,SING,CAB,HAB2,no,N,40,,141700,26582,CYC
41,,SING,CBB,HBB1,no,N,41,,141700,26582,CYC
42,,SING,CBB,HBB2,no,N,42,,141700,26582,CYC
43,,SING,CBB,HBB3,no,N,43,,141700,26582,CYC
44,,SING,NC,C1C,no,N,44,,141700,26582,CYC
45,,SING,NC,C4C,no,N,45,,141700,26582,CYC
46,,SING,NC,HC,no,N,46,,141700,26582,CYC
47,,SING,C1C,C2C,no,N,47,,141700,26582,CYC
48,,DOUB,C1C,OC,no,N,48,,141700,26582,CYC
49,,SING,C2C,C3C,no,N,49,,141700,26582,CYC
50,,SING,C2C,CMC,no,N,50,,141700,26582,CYC
51,,SING,C2C,H2C,no,N,51,,141700,26582,CYC
52,,SING,C3C,C4C,no,N,52,,141700,26582,CYC
53,,SING,C3C,CAC,no,N,53,,141700,26582,CYC
54,,SING,C3C,H3C,no,N,54,,141700,26582,CYC
55,,DOUB,C4C,CHD,no,Z,55,,141700,26582,CYC
56,,SING,CMC,HMC1,no,N,56,,141700,26582,CYC
57,,SING,CMC,HMC2,no,N,57,,141700,26582,CYC
58,,SING,CMC,HMC3,no,N,58,,141700,26582,CYC
59,,SING,CAC,CBC,no,N,59,,141700,26582,CYC
60,,SING,CAC,HAC1,no,N,60,,141700,26582,CYC
61,,SING,CAC,HAC2,no,N,61,,141700,26582,CYC
62,,SING,CBC,HBC1,no,N,62,,141700,26582,CYC
63,,SING,CBC,HBC2,no,N,63,,141700,26582,CYC
64,,SING,CBC,HBC3,no,N,64,,141700,26582,CYC
65,,SING,CHD,C1D,no,N,65,,141700,26582,CYC
66,,SING,CHD,HHD,no,N,66,,141700,26582,CYC
67,,SING,ND,C1D,yes,N,67,,141700,26582,CYC
68,,SING,ND,C4D,yes,N,68,,141700,26582,CYC
69,,SING,ND,HD,no,N,69,,141700,26582,CYC
70,,DOUB,C1D,C2D,yes,N,70,,141700,26582,CYC
71,,SING,C2D,C3D,yes,N,71,,141700,26582,CYC
72,,SING,C2D,CMD,no,N,72,,141700,26582,CYC
73,,DOUB,C3D,C4D,yes,N,73,,141700,26582,CYC
74,,SING,C3D,CAD,no,N,74,,141700,26582,CYC
75,,SING,CMD,HMD1,no,N,75,,141700,26582,CYC
76,,SING,CMD,HMD2,no,N,76,,141700,26582,CYC
77,,SING,CMD,HMD3,no,N,77,,141700,26582,CYC
78,,SING,CAD,CBD,no,N,78,,141700,26582,CYC
79,,SING,CAD,HAD1,no,N,79,,141700,26582,CYC
80,,SING,CAD,HAD2,no,N,80,,141700,26582,CYC
81,,SING,CBD,CGD,no,N,81,,141700,26582,CYC
82,,SING,CBD,HBD1,no,N,82,,141700,26582,CYC
83,,SING,CBD,HBD2,no,N,83,,141700,26582,CYC
84,,DOUB,CGD,O1D,no,N,84,,141700,26582,CYC
4,,SING,CA,HA,,,,,240396,6146,MLN_2
85,,SING,CGD,O2D,no,N,85,,141700,26582,CYC
86,,SING,O2D,H2D,no,N,86,,141700,26582,CYC
1,,DOUB,PA,O1A,no,N,1,,141719,26583,NAP
2,,SING,PA,O2A,no,N,2,,141719,26583,NAP
3,,SING,PA,O5B,no,N,3,,141719,26583,NAP
4,,SING,PA,O3,no,N,4,,141719,26583,NAP
5,,SING,O2A,HOA2,no,N,5,,141719,26583,NAP
6,,SING,O5B,C5B,no,N,6,,141719,26583,NAP
7,,SING,C5B,C4B,no,N,7,,141719,26583,NAP
8,,SING,C5B,H51A,no,N,8,,141719,26583,NAP
9,,SING,C5B,H52A,no,N,9,,141719,26583,NAP
10,,SING,C4B,O4B,no,N,10,,141719,26583,NAP
11,,SING,C4B,C3B,no,N,11,,141719,26583,NAP
12,,SING,C4B,H4B,no,N,12,,141719,26583,NAP
13,,SING,O4B,C1B,no,N,13,,141719,26583,NAP
14,,SING,C3B,O3B,no,N,14,,141719,26583,NAP
15,,SING,C3B,C2B,no,N,15,,141719,26583,NAP
16,,SING,C3B,H3B,no,N,16,,141719,26583,NAP
17,,SING,O3B,HO3A,no,N,17,,141719,26583,NAP
18,,SING,C2B,O2B,no,N,18,,141719,26583,NAP
19,,SING,C2B,C1B,no,N,19,,141719,26583,NAP
20,,SING,C2B,H2B,no,N,20,,141719,26583,NAP
21,,SING,O2B,P2B,no,N,21,,141719,26583,NAP
22,,SING,C1B,N9A,no,N,22,,141719,26583,NAP
23,,SING,C1B,H1B,no,N,23,,141719,26583,NAP
24,,SING,N9A,C8A,yes,N,24,,141719,26583,NAP
25,,SING,N9A,C4A,yes,N,25,,141719,26583,NAP
26,,DOUB,C8A,N7A,yes,N,26,,141719,26583,NAP
27,,SING,C8A,H8A,no,N,27,,141719,26583,NAP
28,,SING,N7A,C5A,yes,N,28,,141719,26583,NAP
29,,SING,C5A,C6A,yes,N,29,,141719,26583,NAP
30,,DOUB,C5A,C4A,yes,N,30,,141719,26583,NAP
31,,SING,C6A,N6A,no,N,31,,141719,26583,NAP
32,,DOUB,C6A,N1A,yes,N,32,,141719,26583,NAP
33,,SING,N6A,H61A,no,N,33,,141719,26583,NAP
34,,SING,N6A,H62A,no,N,34,,141719,26583,NAP
35,,SING,N1A,C2A,yes,N,35,,141719,26583,NAP
36,,DOUB,C2A,N3A,yes,N,36,,141719,26583,NAP
37,,SING,C2A,H2A,no,N,37,,141719,26583,NAP
38,,SING,N3A,C4A,yes,N,38,,141719,26583,NAP
39,,SING,O3,PN,no,N,39,,141719,26583,NAP
40,,DOUB,PN,O1N,no,N,40,,141719,26583,NAP
41,,SING,PN,O2N,no,N,41,,141719,26583,NAP
42,,SING,PN,O5D,no,N,42,,141719,26583,NAP
43,,SING,O5D,C5D,no,N,43,,141719,26583,NAP
44,,SING,C5D,C4D,no,N,44,,141719,26583,NAP
45,,SING,C5D,H51N,no,N,45,,141719,26583,NAP
46,,SING,C5D,H52N,no,N,46,,141719,26583,NAP
47,,SING,C4D,O4D,no,N,47,,141719,26583,NAP
48,,SING,C4D,C3D,no,N,48,,141719,26583,NAP
49,,SING,C4D,H4D,no,N,49,,141719,26583,NAP
50,,SING,O4D,C1D,no,N,50,,141719,26583,NAP
51,,SING,C3D,O3D,no,N,51,,141719,26583,NAP
52,,SING,C3D,C2D,no,N,52,,141719,26583,NAP
53,,SING,C3D,H3D,no,N,53,,141719,26583,NAP
54,,SING,O3D,HO3N,no,N,54,,141719,26583,NAP
55,,SING,C2D,O2D,no,N,55,,141719,26583,NAP
56,,SING,C2D,C1D,no,N,56,,141719,26583,NAP
57,,SING,C2D,H2D,no,N,57,,141719,26583,NAP
58,,SING,O2D,HO2N,no,N,58,,141719,26583,NAP
59,,SING,C1D,N1N,no,N,59,,141719,26583,NAP
60,,SING,C1D,H1D,no,N,60,,141719,26583,NAP
61,,SING,N1N,C2N,yes,N,61,,141719,26583,NAP
62,,DOUB,N1N,C6N,yes,N,62,,141719,26583,NAP
63,,DOUB,C2N,C3N,yes,N,63,,141719,26583,NAP
64,,SING,C2N,H2N,no,N,64,,141719,26583,NAP
65,,SING,C3N,C7N,no,N,65,,141719,26583,NAP
66,,SING,C3N,C4N,yes,N,66,,141719,26583,NAP
67,,DOUB,C7N,O7N,no,N,67,,141719,26583,NAP
68,,SING,C7N,N7N,no,N,68,,141719,26583,NAP
69,,SING,N7N,H71N,no,N,69,,141719,26583,NAP
70,,SING,N7N,H72N,no,N,70,,141719,26583,NAP
71,,DOUB,C4N,C5N,yes,N,71,,141719,26583,NAP
72,,SING,C4N,H4N,no,N,72,,141719,26583,NAP
73,,SING,C5N,C6N,yes,N,73,,141719,26583,NAP
74,,SING,C5N,H5N,no,N,74,,141719,26583,NAP
75,,SING,C6N,H6N,no,N,75,,141719,26583,NAP
76,,DOUB,P2B,O1X,no,N,76,,141719,26583,NAP
77,,SING,P2B,O2X,no,N,77,,141719,26583,NAP
78,,SING,P2B,O3X,no,N,78,,141719,26583,NAP
79,,SING,O2X,HOP2,no,N,79,,141719,26583,NAP
80,,SING,O3X,HOP3,no,N,80,,141719,26583,NAP
1,,SING,N3,C2,yes,N,1,,141720,26583,THG
2,,SING,N3,C4,yes,N,2,,141720,26583,THG
3,,SING,N3,HN3,no,N,3,,141720,26583,THG
4,,DOUB,C2,N1,yes,N,4,,141720,26583,THG
5,,SING,C2,N2,no,N,5,,141720,26583,THG
6,,SING,N1,C8A,yes,N,6,,141720,26583,THG
7,,DOUB,C8A,C4A,yes,N,7,,141720,26583,THG
8,,SING,C8A,N8,no,N,8,,141720,26583,THG
9,,SING,C4A,C4,yes,N,9,,141720,26583,THG
10,,SING,C4A,N5,no,N,10,,141720,26583,THG
11,,DOUB,C4,O4,no,N,11,,141720,26583,THG
12,,SING,N8,C7,no,N,12,,141720,26583,THG
13,,SING,N8,HN8,no,N,13,,141720,26583,THG
14,,SING,C7,C6,no,N,14,,141720,26583,THG
15,,SING,C7,HC71,no,N,15,,141720,26583,THG
16,,SING,C7,HC72,no,N,16,,141720,26583,THG
17,,SING,C6,N5,no,N,17,,141720,26583,THG
18,,SING,C6,C9,no,N,18,,141720,26583,THG
19,,SING,C6,HC6,no,N,19,,141720,26583,THG
20,,SING,N5,HN5,no,N,20,,141720,26583,THG
21,,SING,C9,N10,no,N,21,,141720,26583,THG
22,,SING,C9,HC91,no,N,22,,141720,26583,THG
23,,SING,C9,HC92,no,N,23,,141720,26583,THG
24,,SING,N10,C4',no,N,24,,141720,26583,THG
25,,SING,N10,H10,no,N,25,,141720,26583,THG
26,,DOUB,C4',C3',yes,N,26,,141720,26583,THG
27,,SING,C4',C5',yes,N,27,,141720,26583,THG
28,,SING,C3',C2',yes,N,28,,141720,26583,THG
29,,SING,C3',HC3,no,N,29,,141720,26583,THG
30,,DOUB,C2',C1',yes,N,30,,141720,26583,THG
31,,SING,C2',HC2,no,N,31,,141720,26583,THG
32,,SING,C1',C6',yes,N,32,,141720,26583,THG
33,,SING,C1',C11,no,N,33,,141720,26583,THG
34,,DOUB,C6',C5',yes,N,34,,141720,26583,THG
35,,SING,C6',HC61,no,N,35,,141720,26583,THG
36,,SING,C5',HC5,no,N,36,,141720,26583,THG
37,,SING,C11,N,no,N,37,,141720,26583,THG
38,,DOUB,C11,O11,no,N,38,,141720,26583,THG
39,,SING,N,CA,no,N,39,,141720,26583,THG
40,,SING,N,HN,no,N,40,,141720,26583,THG
41,,SING,CA,C,no,N,41,,141720,26583,THG
42,,SING,CA,CB,no,N,42,,141720,26583,THG
43,,SING,CA,HCA,no,N,43,,141720,26583,THG
44,,SING,C,OX2,no,N,44,,141720,26583,THG
45,,DOUB,C,OX1,no,N,45,,141720,26583,THG
46,,SING,OX2,HX2,no,N,46,,141720,26583,THG
47,,SING,CB,CG,no,N,47,,141720,26583,THG
48,,SING,CB,HCB1,no,N,48,,141720,26583,THG
49,,SING,CB,HCB2,no,N,49,,141720,26583,THG
50,,SING,CG,CD,no,N,50,,141720,26583,THG
51,,SING,CG,HCG1,no,N,51,,141720,26583,THG
52,,SING,CG,HCG2,no,N,52,,141720,26583,THG
53,,DOUB,CD,OE1,no,N,53,,141720,26583,THG
54,,SING,CD,OE2,no,N,54,,141720,26583,THG
55,,SING,OE2,HE2,no,N,55,,141720,26583,THG
56,,SING,N2,HN21,no,N,56,,141720,26583,THG
57,,SING,N2,HN22,no,N,57,,141720,26583,THG
1,,DOUB,PA,O1A,no,N,1,,141738,26584,NAP
2,,SING,PA,O2A,no,N,2,,141738,26584,NAP
3,,SING,PA,O5B,no,N,3,,141738,26584,NAP
4,,SING,PA,O3,no,N,4,,141738,26584,NAP
5,,SING,O2A,HOA2,no,N,5,,141738,26584,NAP
6,,SING,O5B,C5B,no,N,6,,141738,26584,NAP
7,,SING,C5B,C4B,no,N,7,,141738,26584,NAP
8,,SING,C5B,H51A,no,N,8,,141738,26584,NAP
9,,SING,C5B,H52A,no,N,9,,141738,26584,NAP
10,,SING,C4B,O4B,no,N,10,,141738,26584,NAP
11,,SING,C4B,C3B,no,N,11,,141738,26584,NAP
12,,SING,C4B,H4B,no,N,12,,141738,26584,NAP
13,,SING,O4B,C1B,no,N,13,,141738,26584,NAP
14,,SING,C3B,O3B,no,N,14,,141738,26584,NAP
15,,SING,C3B,C2B,no,N,15,,141738,26584,NAP
16,,SING,C3B,H3B,no,N,16,,141738,26584,NAP
17,,SING,O3B,HO3A,no,N,17,,141738,26584,NAP
18,,SING,C2B,O2B,no,N,18,,141738,26584,NAP
19,,SING,C2B,C1B,no,N,19,,141738,26584,NAP
20,,SING,C2B,H2B,no,N,20,,141738,26584,NAP
21,,SING,O2B,P2B,no,N,21,,141738,26584,NAP
22,,SING,C1B,N9A,no,N,22,,141738,26584,NAP
23,,SING,C1B,H1B,no,N,23,,141738,26584,NAP
24,,SING,N9A,C8A,yes,N,24,,141738,26584,NAP
25,,SING,N9A,C4A,yes,N,25,,141738,26584,NAP
26,,DOUB,C8A,N7A,yes,N,26,,141738,26584,NAP
27,,SING,C8A,H8A,no,N,27,,141738,26584,NAP
28,,SING,N7A,C5A,yes,N,28,,141738,26584,NAP
29,,SING,C5A,C6A,yes,N,29,,141738,26584,NAP
30,,DOUB,C5A,C4A,yes,N,30,,141738,26584,NAP
31,,SING,C6A,N6A,no,N,31,,141738,26584,NAP
32,,DOUB,C6A,N1A,yes,N,32,,141738,26584,NAP
33,,SING,N6A,H61A,no,N,33,,141738,26584,NAP
34,,SING,N6A,H62A,no,N,34,,141738,26584,NAP
35,,SING,N1A,C2A,yes,N,35,,141738,26584,NAP
36,,DOUB,C2A,N3A,yes,N,36,,141738,26584,NAP
37,,SING,C2A,H2A,no,N,37,,141738,26584,NAP
38,,SING,N3A,C4A,yes,N,38,,141738,26584,NAP
39,,SING,O3,PN,no,N,39,,141738,26584,NAP
40,,DOUB,PN,O1N,no,N,40,,141738,26584,NAP
41,,SING,PN,O2N,no,N,41,,141738,26584,NAP
42,,SING,PN,O5D,no,N,42,,141738,26584,NAP
43,,SING,O5D,C5D,no,N,43,,141738,26584,NAP
44,,SING,C5D,C4D,no,N,44,,141738,26584,NAP
45,,SING,C5D,H51N,no,N,45,,141738,26584,NAP
46,,SING,C5D,H52N,no,N,46,,141738,26584,NAP
47,,SING,C4D,O4D,no,N,47,,141738,26584,NAP
48,,SING,C4D,C3D,no,N,48,,141738,26584,NAP
49,,SING,C4D,H4D,no,N,49,,141738,26584,NAP
50,,SING,O4D,C1D,no,N,50,,141738,26584,NAP
51,,SING,C3D,O3D,no,N,51,,141738,26584,NAP
52,,SING,C3D,C2D,no,N,52,,141738,26584,NAP
53,,SING,C3D,H3D,no,N,53,,141738,26584,NAP
54,,SING,O3D,HO3N,no,N,54,,141738,26584,NAP
55,,SING,C2D,O2D,no,N,55,,141738,26584,NAP
56,,SING,C2D,C1D,no,N,56,,141738,26584,NAP
57,,SING,C2D,H2D,no,N,57,,141738,26584,NAP
58,,SING,O2D,HO2N,no,N,58,,141738,26584,NAP
59,,SING,C1D,N1N,no,N,59,,141738,26584,NAP
60,,SING,C1D,H1D,no,N,60,,141738,26584,NAP
5,,SING,CA,C,,,,,240396,6146,MLN_2
61,,SING,N1N,C2N,yes,N,61,,141738,26584,NAP
62,,DOUB,N1N,C6N,yes,N,62,,141738,26584,NAP
63,,DOUB,C2N,C3N,yes,N,63,,141738,26584,NAP
64,,SING,C2N,H2N,no,N,64,,141738,26584,NAP
65,,SING,C3N,C7N,no,N,65,,141738,26584,NAP
66,,SING,C3N,C4N,yes,N,66,,141738,26584,NAP
67,,DOUB,C7N,O7N,no,N,67,,141738,26584,NAP
68,,SING,C7N,N7N,no,N,68,,141738,26584,NAP
69,,SING,N7N,H71N,no,N,69,,141738,26584,NAP
70,,SING,N7N,H72N,no,N,70,,141738,26584,NAP
71,,DOUB,C4N,C5N,yes,N,71,,141738,26584,NAP
72,,SING,C4N,H4N,no,N,72,,141738,26584,NAP
73,,SING,C5N,C6N,yes,N,73,,141738,26584,NAP
74,,SING,C5N,H5N,no,N,74,,141738,26584,NAP
75,,SING,C6N,H6N,no,N,75,,141738,26584,NAP
76,,DOUB,P2B,O1X,no,N,76,,141738,26584,NAP
77,,SING,P2B,O2X,no,N,77,,141738,26584,NAP
78,,SING,P2B,O3X,no,N,78,,141738,26584,NAP
79,,SING,O2X,HOP2,no,N,79,,141738,26584,NAP
80,,SING,O3X,HOP3,no,N,80,,141738,26584,NAP
1,,SING,N1,C2,yes,N,1,,141739,26584,FOL
2,,SING,N1,C8A,yes,N,2,,141739,26584,FOL
3,,SING,N1,HN1,no,N,3,,141739,26584,FOL
4,,SING,C2,NA2,no,N,4,,141739,26584,FOL
5,,DOUB,C2,N3,yes,N,5,,141739,26584,FOL
6,,SING,NA2,HN21,no,N,6,,141739,26584,FOL
7,,SING,NA2,HN22,no,N,7,,141739,26584,FOL
8,,SING,N3,C4,yes,N,8,,141739,26584,FOL
9,,DOUB,C4,O4,no,N,9,,141739,26584,FOL
10,,SING,C4,C4A,yes,N,10,,141739,26584,FOL
11,,SING,C4A,N5,yes,N,11,,141739,26584,FOL
12,,DOUB,C4A,C8A,yes,N,12,,141739,26584,FOL
13,,DOUB,N5,C6,yes,N,13,,141739,26584,FOL
14,,SING,C6,C7,yes,N,14,,141739,26584,FOL
15,,SING,C6,C9,no,N,15,,141739,26584,FOL
16,,DOUB,C7,N8,yes,N,16,,141739,26584,FOL
17,,SING,C7,H7,no,N,17,,141739,26584,FOL
18,,SING,N8,C8A,yes,N,18,,141739,26584,FOL
19,,SING,C9,N10,no,N,19,,141739,26584,FOL
20,,SING,C9,H91,no,N,20,,141739,26584,FOL
21,,SING,C9,H92,no,N,21,,141739,26584,FOL
22,,SING,N10,C14,no,N,22,,141739,26584,FOL
23,,SING,N10,HN0,no,N,23,,141739,26584,FOL
24,,DOUB,C11,C12,yes,N,24,,141739,26584,FOL
25,,SING,C11,C16,yes,N,25,,141739,26584,FOL
26,,SING,C11,C,no,N,26,,141739,26584,FOL
27,,SING,C12,C13,yes,N,27,,141739,26584,FOL
28,,SING,C12,H12,no,N,28,,141739,26584,FOL
29,,DOUB,C13,C14,yes,N,29,,141739,26584,FOL
30,,SING,C13,H13,no,N,30,,141739,26584,FOL
31,,SING,C14,C15,yes,N,31,,141739,26584,FOL
32,,DOUB,C15,C16,yes,N,32,,141739,26584,FOL
33,,SING,C15,H15,no,N,33,,141739,26584,FOL
34,,SING,C16,H16,no,N,34,,141739,26584,FOL
35,,DOUB,C,O,no,N,35,,141739,26584,FOL
36,,SING,C,N,no,N,36,,141739,26584,FOL
37,,SING,N,CA,no,N,37,,141739,26584,FOL
38,,SING,N,HN,no,N,38,,141739,26584,FOL
39,,SING,CA,CB,no,N,39,,141739,26584,FOL
40,,SING,CA,CT,no,N,40,,141739,26584,FOL
41,,SING,CA,HA,no,N,41,,141739,26584,FOL
42,,SING,CB,CG,no,N,42,,141739,26584,FOL
43,,SING,CB,HB1,no,N,43,,141739,26584,FOL
44,,SING,CB,HB2,no,N,44,,141739,26584,FOL
45,,SING,CG,CD,no,N,45,,141739,26584,FOL
46,,SING,CG,HG1,no,N,46,,141739,26584,FOL
47,,SING,CG,HG2,no,N,47,,141739,26584,FOL
48,,DOUB,CD,OE1,no,N,48,,141739,26584,FOL
49,,SING,CD,OE2,no,N,49,,141739,26584,FOL
50,,SING,OE2,HOE2,no,N,50,,141739,26584,FOL
51,,DOUB,CT,O1,no,N,51,,141739,26584,FOL
52,,SING,CT,O2,no,N,52,,141739,26584,FOL
53,,SING,O2,HO2,no,N,53,,141739,26584,FOL
1,,DOUB,PA,O1A,no,N,1,,141756,26585,NDP
2,,SING,PA,O2A,no,N,2,,141756,26585,NDP
3,,SING,PA,O5B,no,N,3,,141756,26585,NDP
4,,SING,PA,O3,no,N,4,,141756,26585,NDP
5,,SING,O2A,HOA2,no,N,5,,141756,26585,NDP
6,,SING,O5B,C5B,no,N,6,,141756,26585,NDP
7,,SING,C5B,C4B,no,N,7,,141756,26585,NDP
8,,SING,C5B,H51A,no,N,8,,141756,26585,NDP
9,,SING,C5B,H52A,no,N,9,,141756,26585,NDP
10,,SING,C4B,O4B,no,N,10,,141756,26585,NDP
11,,SING,C4B,C3B,no,N,11,,141756,26585,NDP
12,,SING,C4B,H4B,no,N,12,,141756,26585,NDP
13,,SING,O4B,C1B,no,N,13,,141756,26585,NDP
14,,SING,C3B,O3B,no,N,14,,141756,26585,NDP
15,,SING,C3B,C2B,no,N,15,,141756,26585,NDP
16,,SING,C3B,H3B,no,N,16,,141756,26585,NDP
17,,SING,O3B,HO3A,no,N,17,,141756,26585,NDP
18,,SING,C2B,O2B,no,N,18,,141756,26585,NDP
19,,SING,C2B,C1B,no,N,19,,141756,26585,NDP
20,,SING,C2B,H2B,no,N,20,,141756,26585,NDP
21,,SING,O2B,P2B,no,N,21,,141756,26585,NDP
22,,SING,C1B,N9A,no,N,22,,141756,26585,NDP
23,,SING,C1B,H1B,no,N,23,,141756,26585,NDP
24,,SING,N9A,C8A,yes,N,24,,141756,26585,NDP
25,,SING,N9A,C4A,yes,N,25,,141756,26585,NDP
26,,DOUB,C8A,N7A,yes,N,26,,141756,26585,NDP
27,,SING,C8A,H8A,no,N,27,,141756,26585,NDP
28,,SING,N7A,C5A,yes,N,28,,141756,26585,NDP
29,,SING,C5A,C6A,yes,N,29,,141756,26585,NDP
30,,DOUB,C5A,C4A,yes,N,30,,141756,26585,NDP
31,,SING,C6A,N6A,no,N,31,,141756,26585,NDP
32,,DOUB,C6A,N1A,yes,N,32,,141756,26585,NDP
33,,SING,N6A,H61A,no,N,33,,141756,26585,NDP
34,,SING,N6A,H62A,no,N,34,,141756,26585,NDP
35,,SING,N1A,C2A,yes,N,35,,141756,26585,NDP
36,,DOUB,C2A,N3A,yes,N,36,,141756,26585,NDP
37,,SING,C2A,H2A,no,N,37,,141756,26585,NDP
38,,SING,N3A,C4A,yes,N,38,,141756,26585,NDP
39,,SING,O3,PN,no,N,39,,141756,26585,NDP
40,,DOUB,PN,O1N,no,N,40,,141756,26585,NDP
41,,SING,PN,O2N,no,N,41,,141756,26585,NDP
42,,SING,PN,O5D,no,N,42,,141756,26585,NDP
43,,SING,O2N,H21N,no,N,43,,141756,26585,NDP
44,,SING,O5D,C5D,no,N,44,,141756,26585,NDP
45,,SING,C5D,C4D,no,N,45,,141756,26585,NDP
46,,SING,C5D,H51N,no,N,46,,141756,26585,NDP
47,,SING,C5D,H52N,no,N,47,,141756,26585,NDP
48,,SING,C4D,O4D,no,N,48,,141756,26585,NDP
49,,SING,C4D,C3D,no,N,49,,141756,26585,NDP
50,,SING,C4D,H4D,no,N,50,,141756,26585,NDP
51,,SING,O4D,C1D,no,N,51,,141756,26585,NDP
52,,SING,C3D,O3D,no,N,52,,141756,26585,NDP
53,,SING,C3D,C2D,no,N,53,,141756,26585,NDP
54,,SING,C3D,H3D,no,N,54,,141756,26585,NDP
55,,SING,O3D,HO3N,no,N,55,,141756,26585,NDP
56,,SING,C2D,O2D,no,N,56,,141756,26585,NDP
57,,SING,C2D,C1D,no,N,57,,141756,26585,NDP
58,,SING,C2D,H2D,no,N,58,,141756,26585,NDP
59,,SING,O2D,HO2N,no,N,59,,141756,26585,NDP
60,,SING,C1D,N1N,no,N,60,,141756,26585,NDP
61,,SING,C1D,H1D,no,N,61,,141756,26585,NDP
62,,SING,N1N,C2N,no,N,62,,141756,26585,NDP
63,,SING,N1N,C6N,no,N,63,,141756,26585,NDP
64,,DOUB,C2N,C3N,no,N,64,,141756,26585,NDP
65,,SING,C2N,H2N,no,N,65,,141756,26585,NDP
66,,SING,C3N,C7N,no,N,66,,141756,26585,NDP
67,,SING,C3N,C4N,no,N,67,,141756,26585,NDP
68,,DOUB,C7N,O7N,no,N,68,,141756,26585,NDP
69,,SING,C7N,N7N,no,N,69,,141756,26585,NDP
70,,SING,N7N,H71N,no,N,70,,141756,26585,NDP
71,,SING,N7N,H72N,no,N,71,,141756,26585,NDP
72,,SING,C4N,C5N,no,N,72,,141756,26585,NDP
73,,SING,C4N,H41N,no,N,73,,141756,26585,NDP
74,,SING,C4N,H42N,no,N,74,,141756,26585,NDP
75,,DOUB,C5N,C6N,no,N,75,,141756,26585,NDP
76,,SING,C5N,H5N,no,N,76,,141756,26585,NDP
77,,SING,C6N,H6N,no,N,77,,141756,26585,NDP
78,,DOUB,P2B,O1X,no,N,78,,141756,26585,NDP
79,,SING,P2B,O2X,no,N,79,,141756,26585,NDP
80,,SING,P2B,O3X,no,N,80,,141756,26585,NDP
81,,SING,O2X,HOP2,no,N,81,,141756,26585,NDP
82,,SING,O3X,HOP3,no,N,82,,141756,26585,NDP
1,,SING,C1,C2,no,N,1,,141939,26598,1YM
2,,SING,C2,N3,no,N,2,,141939,26598,1YM
3,,SING,N3,C4,no,N,3,,141939,26598,1YM
4,,DOUB,C4,O5,no,N,4,,141939,26598,1YM
5,,SING,C4,N6,no,N,5,,141939,26598,1YM
6,,SING,N6,C7,no,N,6,,141939,26598,1YM
7,,DOUB,C7,C8,yes,N,7,,141939,26598,1YM
8,,SING,C7,N12,yes,N,8,,141939,26598,1YM
9,,SING,C8,C9,yes,N,9,,141939,26598,1YM
10,,DOUB,N12,C11,yes,N,10,,141939,26598,1YM
11,,SING,S26,C22,yes,N,11,,141939,26598,1YM
12,,SING,S26,C25,yes,N,12,,141939,26598,1YM
13,,SING,C9,C22,no,N,13,,141939,26598,1YM
14,,DOUB,C9,C10,yes,N,14,,141939,26598,1YM
15,,SING,C11,C10,yes,N,15,,141939,26598,1YM
16,,DOUB,C22,N23,yes,N,16,,141939,26598,1YM
17,,SING,C10,C13,no,N,17,,141939,26598,1YM
18,,DOUB,C25,C24,yes,N,18,,141939,26598,1YM
19,,DOUB,O20,C19,no,N,19,,141939,26598,1YM
20,,DOUB,C14,C13,yes,N,20,,141939,26598,1YM
21,,SING,C14,C15,yes,N,21,,141939,26598,1YM
22,,SING,C13,C18,yes,N,22,,141939,26598,1YM
23,,SING,N23,C24,yes,N,23,,141939,26598,1YM
24,,SING,C24,C27,no,N,24,,141939,26598,1YM
25,,SING,C19,C15,no,N,25,,141939,26598,1YM
26,,SING,C19,O21,no,N,26,,141939,26598,1YM
27,,DOUB,C15,C16,yes,N,27,,141939,26598,1YM
28,,DOUB,C18,N17,yes,N,28,,141939,26598,1YM
29,,SING,F29,C27,no,N,29,,141939,26598,1YM
30,,SING,C27,F30,no,N,30,,141939,26598,1YM
31,,SING,C27,F28,no,N,31,,141939,26598,1YM
32,,SING,C16,N17,yes,N,32,,141939,26598,1YM
33,,SING,C1,H1,no,N,33,,141939,26598,1YM
34,,SING,C1,H2,no,N,34,,141939,26598,1YM
35,,SING,C1,H3,no,N,35,,141939,26598,1YM
36,,SING,C2,H4,no,N,36,,141939,26598,1YM
37,,SING,C2,H5,no,N,37,,141939,26598,1YM
38,,SING,N6,H6,no,N,38,,141939,26598,1YM
39,,SING,C8,H7,no,N,39,,141939,26598,1YM
40,,SING,C11,H8,no,N,40,,141939,26598,1YM
41,,SING,C14,H9,no,N,41,,141939,26598,1YM
42,,SING,C16,H10,no,N,42,,141939,26598,1YM
43,,SING,N3,H11,no,N,43,,141939,26598,1YM
44,,SING,C18,H12,no,N,44,,141939,26598,1YM
45,,SING,O21,H13,no,N,45,,141939,26598,1YM
46,,SING,C25,H14,no,N,46,,141939,26598,1YM
1,,SING,C1,C2,no,N,1,,142099,26609,1YM
2,,SING,C2,N3,no,N,2,,142099,26609,1YM
3,,SING,N3,C4,no,N,3,,142099,26609,1YM
4,,DOUB,C4,O5,no,N,4,,142099,26609,1YM
5,,SING,C4,N6,no,N,5,,142099,26609,1YM
6,,SING,N6,C7,no,N,6,,142099,26609,1YM
7,,DOUB,C7,C8,yes,N,7,,142099,26609,1YM
8,,SING,C7,N12,yes,N,8,,142099,26609,1YM
9,,SING,C8,C9,yes,N,9,,142099,26609,1YM
10,,DOUB,N12,C11,yes,N,10,,142099,26609,1YM
11,,SING,S26,C22,yes,N,11,,142099,26609,1YM
12,,SING,S26,C25,yes,N,12,,142099,26609,1YM
13,,SING,C9,C22,no,N,13,,142099,26609,1YM
14,,DOUB,C9,C10,yes,N,14,,142099,26609,1YM
15,,SING,C11,C10,yes,N,15,,142099,26609,1YM
16,,DOUB,C22,N23,yes,N,16,,142099,26609,1YM
17,,SING,C10,C13,no,N,17,,142099,26609,1YM
18,,DOUB,C25,C24,yes,N,18,,142099,26609,1YM
19,,DOUB,O20,C19,no,N,19,,142099,26609,1YM
20,,DOUB,C14,C13,yes,N,20,,142099,26609,1YM
21,,SING,C14,C15,yes,N,21,,142099,26609,1YM
22,,SING,C13,C18,yes,N,22,,142099,26609,1YM
23,,SING,N23,C24,yes,N,23,,142099,26609,1YM
24,,SING,C24,C27,no,N,24,,142099,26609,1YM
25,,SING,C19,C15,no,N,25,,142099,26609,1YM
26,,SING,C19,O21,no,N,26,,142099,26609,1YM
27,,DOUB,C15,C16,yes,N,27,,142099,26609,1YM
28,,DOUB,C18,N17,yes,N,28,,142099,26609,1YM
29,,SING,F29,C27,no,N,29,,142099,26609,1YM
30,,SING,C27,F30,no,N,30,,142099,26609,1YM
31,,SING,C27,F28,no,N,31,,142099,26609,1YM
32,,SING,C16,N17,yes,N,32,,142099,26609,1YM
33,,SING,C1,H1,no,N,33,,142099,26609,1YM
34,,SING,C1,H2,no,N,34,,142099,26609,1YM
35,,SING,C1,H3,no,N,35,,142099,26609,1YM
36,,SING,C2,H4,no,N,36,,142099,26609,1YM
37,,SING,C2,H5,no,N,37,,142099,26609,1YM
38,,SING,N6,H6,no,N,38,,142099,26609,1YM
39,,SING,C8,H7,no,N,39,,142099,26609,1YM
40,,SING,C11,H8,no,N,40,,142099,26609,1YM
41,,SING,C14,H9,no,N,41,,142099,26609,1YM
42,,SING,C16,H10,no,N,42,,142099,26609,1YM
43,,SING,N3,H11,no,N,43,,142099,26609,1YM
44,,SING,C18,H12,no,N,44,,142099,26609,1YM
45,,SING,O21,H13,no,N,45,,142099,26609,1YM
46,,SING,C25,H14,no,N,46,,142099,26609,1YM
1,,SING,C1,C2,no,N,1,,142129,26611,1YM
2,,SING,C2,N3,no,N,2,,142129,26611,1YM
3,,SING,N3,C4,no,N,3,,142129,26611,1YM
4,,DOUB,C4,O5,no,N,4,,142129,26611,1YM
5,,SING,C4,N6,no,N,5,,142129,26611,1YM
6,,SING,N6,C7,no,N,6,,142129,26611,1YM
7,,DOUB,C7,C8,yes,N,7,,142129,26611,1YM
8,,SING,C7,N12,yes,N,8,,142129,26611,1YM
9,,SING,C8,C9,yes,N,9,,142129,26611,1YM
10,,DOUB,N12,C11,yes,N,10,,142129,26611,1YM
11,,SING,S26,C22,yes,N,11,,142129,26611,1YM
12,,SING,S26,C25,yes,N,12,,142129,26611,1YM
13,,SING,C9,C22,no,N,13,,142129,26611,1YM
14,,DOUB,C9,C10,yes,N,14,,142129,26611,1YM
15,,SING,C11,C10,yes,N,15,,142129,26611,1YM
16,,DOUB,C22,N23,yes,N,16,,142129,26611,1YM
17,,SING,C10,C13,no,N,17,,142129,26611,1YM
18,,DOUB,C25,C24,yes,N,18,,142129,26611,1YM
19,,DOUB,O20,C19,no,N,19,,142129,26611,1YM
20,,DOUB,C14,C13,yes,N,20,,142129,26611,1YM
21,,SING,C14,C15,yes,N,21,,142129,26611,1YM
22,,SING,C13,C18,yes,N,22,,142129,26611,1YM
23,,SING,N23,C24,yes,N,23,,142129,26611,1YM
24,,SING,C24,C27,no,N,24,,142129,26611,1YM
25,,SING,C19,C15,no,N,25,,142129,26611,1YM
26,,SING,C19,O21,no,N,26,,142129,26611,1YM
27,,DOUB,C15,C16,yes,N,27,,142129,26611,1YM
28,,DOUB,C18,N17,yes,N,28,,142129,26611,1YM
29,,SING,F29,C27,no,N,29,,142129,26611,1YM
30,,SING,C27,F30,no,N,30,,142129,26611,1YM
31,,SING,C27,F28,no,N,31,,142129,26611,1YM
32,,SING,C16,N17,yes,N,32,,142129,26611,1YM
33,,SING,C1,H1,no,N,33,,142129,26611,1YM
34,,SING,C1,H2,no,N,34,,142129,26611,1YM
35,,SING,C1,H3,no,N,35,,142129,26611,1YM
36,,SING,C2,H4,no,N,36,,142129,26611,1YM
37,,SING,C2,H5,no,N,37,,142129,26611,1YM
38,,SING,N6,H6,no,N,38,,142129,26611,1YM
39,,SING,C8,H7,no,N,39,,142129,26611,1YM
40,,SING,C11,H8,no,N,40,,142129,26611,1YM
41,,SING,C14,H9,no,N,41,,142129,26611,1YM
42,,SING,C16,H10,no,N,42,,142129,26611,1YM
43,,SING,N3,H11,no,N,43,,142129,26611,1YM
44,,SING,C18,H12,no,N,44,,142129,26611,1YM
45,,SING,O21,H13,no,N,45,,142129,26611,1YM
46,,SING,C25,H14,no,N,46,,142129,26611,1YM
1,,SING,C1,C2,no,N,1,,142894,26660,LAT
2,,SING,C1,O1,no,N,2,,142894,26660,LAT
3,,SING,C1,O5,no,N,3,,142894,26660,LAT
4,,SING,C1,H1,no,N,4,,142894,26660,LAT
5,,SING,C2,C3,no,N,5,,142894,26660,LAT
6,,SING,C2,O2,no,N,6,,142894,26660,LAT
7,,SING,C2,H2,no,N,7,,142894,26660,LAT
8,,SING,C3,C4,no,N,8,,142894,26660,LAT
6,,SING,CB,HB2,,,,,240396,6146,MLN_2
9,,SING,C3,O3,no,N,9,,142894,26660,LAT
10,,SING,C3,H3,no,N,10,,142894,26660,LAT
11,,SING,C4,C5,no,N,11,,142894,26660,LAT
12,,SING,C4,O4,no,N,12,,142894,26660,LAT
13,,SING,C4,H4,no,N,13,,142894,26660,LAT
14,,SING,C5,C6,no,N,14,,142894,26660,LAT
15,,SING,C5,O5,no,N,15,,142894,26660,LAT
16,,SING,C5,H5,no,N,16,,142894,26660,LAT
17,,SING,C6,O6,no,N,17,,142894,26660,LAT
18,,SING,C6,H61,no,N,18,,142894,26660,LAT
19,,SING,C6,H62,no,N,19,,142894,26660,LAT
20,,SING,O1,C4',no,N,20,,142894,26660,LAT
21,,SING,O2,HO2,no,N,21,,142894,26660,LAT
22,,SING,O3,HO3,no,N,22,,142894,26660,LAT
23,,SING,O4,HO4,no,N,23,,142894,26660,LAT
24,,SING,O6,HO6,no,N,24,,142894,26660,LAT
25,,SING,C1',C2',no,N,25,,142894,26660,LAT
26,,SING,C1',O1',no,N,26,,142894,26660,LAT
27,,SING,C1',O5',no,N,27,,142894,26660,LAT
28,,SING,C1',H1',no,N,28,,142894,26660,LAT
29,,SING,C2',C3',no,N,29,,142894,26660,LAT
30,,SING,C2',O2',no,N,30,,142894,26660,LAT
31,,SING,C2',H2',no,N,31,,142894,26660,LAT
32,,SING,C3',C4',no,N,32,,142894,26660,LAT
33,,SING,C3',O3',no,N,33,,142894,26660,LAT
34,,SING,C3',H3',no,N,34,,142894,26660,LAT
35,,SING,C4',C5',no,N,35,,142894,26660,LAT
36,,SING,C4',H4',no,N,36,,142894,26660,LAT
37,,SING,C5',C6',no,N,37,,142894,26660,LAT
38,,SING,C5',O5',no,N,38,,142894,26660,LAT
39,,SING,C5',H5',no,N,39,,142894,26660,LAT
40,,SING,C6',O6',no,N,40,,142894,26660,LAT
41,,SING,C6',H6'1,no,N,41,,142894,26660,LAT
42,,SING,C6',H6'2,no,N,42,,142894,26660,LAT
43,,SING,O1',HO1',no,N,43,,142894,26660,LAT
44,,SING,O2',HO2',no,N,44,,142894,26660,LAT
45,,SING,O3',HO3',no,N,45,,142894,26660,LAT
46,,SING,O6',HO6',no,N,46,,142894,26660,LAT
1,,SING,N,CA,no,N,1,,143028,26674,HYP
2,,SING,N,CD,no,N,2,,143028,26674,HYP
3,,SING,N,H,no,N,3,,143028,26674,HYP
4,,SING,CA,C,no,N,4,,143028,26674,HYP
5,,SING,CA,CB,no,N,5,,143028,26674,HYP
6,,SING,CA,HA,no,N,6,,143028,26674,HYP
7,,DOUB,C,O,no,N,7,,143028,26674,HYP
8,,SING,C,OXT,no,N,8,,143028,26674,HYP
9,,SING,CB,CG,no,N,9,,143028,26674,HYP
10,,SING,CB,HB2,no,N,10,,143028,26674,HYP
11,,SING,CB,HB3,no,N,11,,143028,26674,HYP
12,,SING,CG,CD,no,N,12,,143028,26674,HYP
13,,SING,CG,OD1,no,N,13,,143028,26674,HYP
14,,SING,CG,HG,no,N,14,,143028,26674,HYP
15,,SING,CD,HD22,no,N,15,,143028,26674,HYP
16,,SING,CD,HD23,no,N,16,,143028,26674,HYP
17,,SING,OD1,HD1,no,N,17,,143028,26674,HYP
18,,SING,OXT,HXT,no,N,18,,143028,26674,HYP
1,,SING,N,CA,no,N,1,,143044,26675,HYP
2,,SING,N,CD,no,N,2,,143044,26675,HYP
3,,SING,N,H,no,N,3,,143044,26675,HYP
4,,SING,CA,C,no,N,4,,143044,26675,HYP
5,,SING,CA,CB,no,N,5,,143044,26675,HYP
6,,SING,CA,HA,no,N,6,,143044,26675,HYP
7,,DOUB,C,O,no,N,7,,143044,26675,HYP
8,,SING,C,OXT,no,N,8,,143044,26675,HYP
9,,SING,CB,CG,no,N,9,,143044,26675,HYP
10,,SING,CB,HB2,no,N,10,,143044,26675,HYP
11,,SING,CB,HB3,no,N,11,,143044,26675,HYP
12,,SING,CG,CD,no,N,12,,143044,26675,HYP
13,,SING,CG,OD1,no,N,13,,143044,26675,HYP
14,,SING,CG,HG,no,N,14,,143044,26675,HYP
15,,SING,CD,HD22,no,N,15,,143044,26675,HYP
16,,SING,CD,HD23,no,N,16,,143044,26675,HYP
17,,SING,OD1,HD1,no,N,17,,143044,26675,HYP
18,,SING,OXT,HXT,no,N,18,,143044,26675,HYP
1,,SING,N,CB,no,N,1,,143076,26677,BAL
2,,SING,N,H,no,N,2,,143076,26677,BAL
3,,SING,N,H2,no,N,3,,143076,26677,BAL
4,,SING,CB,CA,no,N,4,,143076,26677,BAL
5,,SING,CB,HB3,no,N,5,,143076,26677,BAL
6,,SING,CB,HB2,no,N,6,,143076,26677,BAL
7,,SING,CA,C,no,N,7,,143076,26677,BAL
8,,SING,CA,HA1,no,N,8,,143076,26677,BAL
9,,SING,CA,HA2,no,N,9,,143076,26677,BAL
10,,DOUB,C,O,no,N,10,,143076,26677,BAL
11,,SING,C,OXT,no,N,11,,143076,26677,BAL
12,,SING,OXT,HXT,no,N,12,,143076,26677,BAL
1,,SING,N,CA,no,N,1,,143108,26679,PCA
2,,SING,N,CD,no,N,2,,143108,26679,PCA
3,,SING,N,H,no,N,3,,143108,26679,PCA
4,,SING,CA,CB,no,N,4,,143108,26679,PCA
5,,SING,CA,C,no,N,5,,143108,26679,PCA
6,,SING,CA,HA,no,N,6,,143108,26679,PCA
7,,SING,CB,CG,no,N,7,,143108,26679,PCA
8,,SING,CB,HB2,no,N,8,,143108,26679,PCA
9,,SING,CB,HB3,no,N,9,,143108,26679,PCA
10,,SING,CG,CD,no,N,10,,143108,26679,PCA
11,,SING,CG,HG2,no,N,11,,143108,26679,PCA
12,,SING,CG,HG3,no,N,12,,143108,26679,PCA
13,,DOUB,CD,OE,no,N,13,,143108,26679,PCA
14,,DOUB,C,O,no,N,14,,143108,26679,PCA
15,,SING,C,OXT,no,N,15,,143108,26679,PCA
16,,SING,OXT,HXT,no,N,16,,143108,26679,PCA
1,,SING,N,CA,no,N,1,,143124,26680,PCA
2,,SING,N,CD,no,N,2,,143124,26680,PCA
3,,SING,N,H,no,N,3,,143124,26680,PCA
4,,SING,CA,CB,no,N,4,,143124,26680,PCA
5,,SING,CA,C,no,N,5,,143124,26680,PCA
6,,SING,CA,HA,no,N,6,,143124,26680,PCA
7,,SING,CB,CG,no,N,7,,143124,26680,PCA
8,,SING,CB,HB2,no,N,8,,143124,26680,PCA
9,,SING,CB,HB3,no,N,9,,143124,26680,PCA
10,,SING,CG,CD,no,N,10,,143124,26680,PCA
11,,SING,CG,HG2,no,N,11,,143124,26680,PCA
12,,SING,CG,HG3,no,N,12,,143124,26680,PCA
13,,DOUB,CD,OE,no,N,13,,143124,26680,PCA
14,,DOUB,C,O,no,N,14,,143124,26680,PCA
15,,SING,C,OXT,no,N,15,,143124,26680,PCA
16,,SING,OXT,HXT,no,N,16,,143124,26680,PCA
1,,DOUB,C1,O1,no,N,1,,143249,26688,MYR
2,,SING,C1,O2,no,N,2,,143249,26688,MYR
3,,SING,C1,C2,no,N,3,,143249,26688,MYR
4,,SING,O2,HO2,no,N,4,,143249,26688,MYR
5,,SING,C2,C3,no,N,5,,143249,26688,MYR
6,,SING,C2,H21,no,N,6,,143249,26688,MYR
7,,SING,C2,H22,no,N,7,,143249,26688,MYR
8,,SING,C3,C4,no,N,8,,143249,26688,MYR
9,,SING,C3,H31,no,N,9,,143249,26688,MYR
10,,SING,C3,H32,no,N,10,,143249,26688,MYR
11,,SING,C4,C5,no,N,11,,143249,26688,MYR
12,,SING,C4,H41,no,N,12,,143249,26688,MYR
13,,SING,C4,H42,no,N,13,,143249,26688,MYR
14,,SING,C5,C6,no,N,14,,143249,26688,MYR
15,,SING,C5,H51,no,N,15,,143249,26688,MYR
16,,SING,C5,H52,no,N,16,,143249,26688,MYR
17,,SING,C6,C7,no,N,17,,143249,26688,MYR
18,,SING,C6,H61,no,N,18,,143249,26688,MYR
19,,SING,C6,H62,no,N,19,,143249,26688,MYR
20,,SING,C7,C8,no,N,20,,143249,26688,MYR
21,,SING,C7,H71,no,N,21,,143249,26688,MYR
22,,SING,C7,H72,no,N,22,,143249,26688,MYR
23,,SING,C8,C9,no,N,23,,143249,26688,MYR
24,,SING,C8,H81,no,N,24,,143249,26688,MYR
25,,SING,C8,H82,no,N,25,,143249,26688,MYR
26,,SING,C9,C10,no,N,26,,143249,26688,MYR
27,,SING,C9,H91,no,N,27,,143249,26688,MYR
28,,SING,C9,H92,no,N,28,,143249,26688,MYR
29,,SING,C10,C11,no,N,29,,143249,26688,MYR
30,,SING,C10,H101,no,N,30,,143249,26688,MYR
31,,SING,C10,H102,no,N,31,,143249,26688,MYR
32,,SING,C11,C12,no,N,32,,143249,26688,MYR
33,,SING,C11,H111,no,N,33,,143249,26688,MYR
34,,SING,C11,H112,no,N,34,,143249,26688,MYR
35,,SING,C12,C13,no,N,35,,143249,26688,MYR
36,,SING,C12,H121,no,N,36,,143249,26688,MYR
37,,SING,C12,H122,no,N,37,,143249,26688,MYR
38,,SING,C13,C14,no,N,38,,143249,26688,MYR
39,,SING,C13,H131,no,N,39,,143249,26688,MYR
40,,SING,C13,H132,no,N,40,,143249,26688,MYR
41,,SING,C14,H141,no,N,41,,143249,26688,MYR
42,,SING,C14,H142,no,N,42,,143249,26688,MYR
43,,SING,C14,H143,no,N,43,,143249,26688,MYR
1,,DOUB,PA,O1A,no,N,1,,143338,26694,NDP
2,,SING,PA,O2A,no,N,2,,143338,26694,NDP
3,,SING,PA,O5B,no,N,3,,143338,26694,NDP
4,,SING,PA,O3,no,N,4,,143338,26694,NDP
5,,SING,O2A,HOA2,no,N,5,,143338,26694,NDP
6,,SING,O5B,C5B,no,N,6,,143338,26694,NDP
7,,SING,C5B,C4B,no,N,7,,143338,26694,NDP
8,,SING,C5B,H51A,no,N,8,,143338,26694,NDP
9,,SING,C5B,H52A,no,N,9,,143338,26694,NDP
10,,SING,C4B,O4B,no,N,10,,143338,26694,NDP
11,,SING,C4B,C3B,no,N,11,,143338,26694,NDP
12,,SING,C4B,H4B,no,N,12,,143338,26694,NDP
13,,SING,O4B,C1B,no,N,13,,143338,26694,NDP
14,,SING,C3B,O3B,no,N,14,,143338,26694,NDP
15,,SING,C3B,C2B,no,N,15,,143338,26694,NDP
16,,SING,C3B,H3B,no,N,16,,143338,26694,NDP
17,,SING,O3B,HO3A,no,N,17,,143338,26694,NDP
18,,SING,C2B,O2B,no,N,18,,143338,26694,NDP
19,,SING,C2B,C1B,no,N,19,,143338,26694,NDP
20,,SING,C2B,H2B,no,N,20,,143338,26694,NDP
21,,SING,O2B,P2B,no,N,21,,143338,26694,NDP
22,,SING,C1B,N9A,no,N,22,,143338,26694,NDP
23,,SING,C1B,H1B,no,N,23,,143338,26694,NDP
24,,SING,N9A,C8A,yes,N,24,,143338,26694,NDP
25,,SING,N9A,C4A,yes,N,25,,143338,26694,NDP
26,,DOUB,C8A,N7A,yes,N,26,,143338,26694,NDP
27,,SING,C8A,H8A,no,N,27,,143338,26694,NDP
28,,SING,N7A,C5A,yes,N,28,,143338,26694,NDP
29,,SING,C5A,C6A,yes,N,29,,143338,26694,NDP
30,,DOUB,C5A,C4A,yes,N,30,,143338,26694,NDP
31,,SING,C6A,N6A,no,N,31,,143338,26694,NDP
32,,DOUB,C6A,N1A,yes,N,32,,143338,26694,NDP
33,,SING,N6A,H61A,no,N,33,,143338,26694,NDP
34,,SING,N6A,H62A,no,N,34,,143338,26694,NDP
35,,SING,N1A,C2A,yes,N,35,,143338,26694,NDP
36,,DOUB,C2A,N3A,yes,N,36,,143338,26694,NDP
37,,SING,C2A,H2A,no,N,37,,143338,26694,NDP
38,,SING,N3A,C4A,yes,N,38,,143338,26694,NDP
39,,SING,O3,PN,no,N,39,,143338,26694,NDP
40,,DOUB,PN,O1N,no,N,40,,143338,26694,NDP
41,,SING,PN,O2N,no,N,41,,143338,26694,NDP
42,,SING,PN,O5D,no,N,42,,143338,26694,NDP
43,,SING,O2N,H21N,no,N,43,,143338,26694,NDP
44,,SING,O5D,C5D,no,N,44,,143338,26694,NDP
45,,SING,C5D,C4D,no,N,45,,143338,26694,NDP
46,,SING,C5D,H51N,no,N,46,,143338,26694,NDP
47,,SING,C5D,H52N,no,N,47,,143338,26694,NDP
48,,SING,C4D,O4D,no,N,48,,143338,26694,NDP
49,,SING,C4D,C3D,no,N,49,,143338,26694,NDP
50,,SING,C4D,H4D,no,N,50,,143338,26694,NDP
51,,SING,O4D,C1D,no,N,51,,143338,26694,NDP
52,,SING,C3D,O3D,no,N,52,,143338,26694,NDP
53,,SING,C3D,C2D,no,N,53,,143338,26694,NDP
54,,SING,C3D,H3D,no,N,54,,143338,26694,NDP
55,,SING,O3D,HO3N,no,N,55,,143338,26694,NDP
56,,SING,C2D,O2D,no,N,56,,143338,26694,NDP
57,,SING,C2D,C1D,no,N,57,,143338,26694,NDP
58,,SING,C2D,H2D,no,N,58,,143338,26694,NDP
59,,SING,O2D,HO2N,no,N,59,,143338,26694,NDP
60,,SING,C1D,N1N,no,N,60,,143338,26694,NDP
61,,SING,C1D,H1D,no,N,61,,143338,26694,NDP
62,,SING,N1N,C2N,no,N,62,,143338,26694,NDP
63,,SING,N1N,C6N,no,N,63,,143338,26694,NDP
64,,DOUB,C2N,C3N,no,N,64,,143338,26694,NDP
65,,SING,C2N,H2N,no,N,65,,143338,26694,NDP
66,,SING,C3N,C7N,no,N,66,,143338,26694,NDP
67,,SING,C3N,C4N,no,N,67,,143338,26694,NDP
68,,DOUB,C7N,O7N,no,N,68,,143338,26694,NDP
69,,SING,C7N,N7N,no,N,69,,143338,26694,NDP
70,,SING,N7N,H71N,no,N,70,,143338,26694,NDP
71,,SING,N7N,H72N,no,N,71,,143338,26694,NDP
72,,SING,C4N,C5N,no,N,72,,143338,26694,NDP
73,,SING,C4N,H41N,no,N,73,,143338,26694,NDP
74,,SING,C4N,H42N,no,N,74,,143338,26694,NDP
75,,DOUB,C5N,C6N,no,N,75,,143338,26694,NDP
76,,SING,C5N,H5N,no,N,76,,143338,26694,NDP
77,,SING,C6N,H6N,no,N,77,,143338,26694,NDP
78,,DOUB,P2B,O1X,no,N,78,,143338,26694,NDP
79,,SING,P2B,O2X,no,N,79,,143338,26694,NDP
80,,SING,P2B,O3X,no,N,80,,143338,26694,NDP
81,,SING,O2X,HOP2,no,N,81,,143338,26694,NDP
82,,SING,O3X,HOP3,no,N,82,,143338,26694,NDP
1,,DOUB,C1,N2,yes,N,1,,143339,26694,TOP
2,,SING,C1,C8,yes,N,2,,143339,26694,TOP
3,,SING,C1,H1,no,N,3,,143339,26694,TOP
4,,SING,N2,C3,yes,N,4,,143339,26694,TOP
5,,SING,C3,N4,no,N,5,,143339,26694,TOP
6,,DOUB,C3,N5,yes,N,6,,143339,26694,TOP
7,,SING,N4,HN41,no,N,7,,143339,26694,TOP
8,,SING,N4,HN42,no,N,8,,143339,26694,TOP
9,,SING,N5,C6,yes,N,9,,143339,26694,TOP
10,,SING,C6,N7,no,N,10,,143339,26694,TOP
11,,DOUB,C6,C8,yes,N,11,,143339,26694,TOP
12,,SING,N7,HN71,no,N,12,,143339,26694,TOP
13,,SING,N7,HN72,no,N,13,,143339,26694,TOP
14,,SING,C8,C9,no,N,14,,143339,26694,TOP
15,,SING,C9,C10,no,N,15,,143339,26694,TOP
16,,SING,C9,H91,no,N,16,,143339,26694,TOP
17,,SING,C9,H92,no,N,17,,143339,26694,TOP
18,,DOUB,C10,C11,yes,N,18,,143339,26694,TOP
19,,SING,C10,C21,yes,N,19,,143339,26694,TOP
20,,SING,C11,C12,yes,N,20,,143339,26694,TOP
21,,SING,C11,H11,no,N,21,,143339,26694,TOP
22,,SING,C12,O13,no,N,22,,143339,26694,TOP
23,,DOUB,C12,C15,yes,N,23,,143339,26694,TOP
24,,SING,O13,C14,no,N,24,,143339,26694,TOP
25,,SING,C14,H141,no,N,25,,143339,26694,TOP
26,,SING,C14,H142,no,N,26,,143339,26694,TOP
27,,SING,C14,H143,no,N,27,,143339,26694,TOP
28,,SING,C15,O16,no,N,28,,143339,26694,TOP
29,,SING,C15,C18,yes,N,29,,143339,26694,TOP
30,,SING,O16,C17,no,N,30,,143339,26694,TOP
31,,SING,C17,H171,no,N,31,,143339,26694,TOP
32,,SING,C17,H172,no,N,32,,143339,26694,TOP
33,,SING,C17,H173,no,N,33,,143339,26694,TOP
34,,SING,C18,O19,no,N,34,,143339,26694,TOP
35,,DOUB,C18,C21,yes,N,35,,143339,26694,TOP
36,,SING,O19,C20,no,N,36,,143339,26694,TOP
37,,SING,C20,H201,no,N,37,,143339,26694,TOP
38,,SING,C20,H202,no,N,38,,143339,26694,TOP
39,,SING,C20,H203,no,N,39,,143339,26694,TOP
40,,SING,C21,H21,no,N,40,,143339,26694,TOP
1,,DOUB,PA,O1A,no,N,1,,143358,26695,NDP
2,,SING,PA,O2A,no,N,2,,143358,26695,NDP
3,,SING,PA,O5B,no,N,3,,143358,26695,NDP
4,,SING,PA,O3,no,N,4,,143358,26695,NDP
5,,SING,O2A,HOA2,no,N,5,,143358,26695,NDP
6,,SING,O5B,C5B,no,N,6,,143358,26695,NDP
7,,SING,C5B,C4B,no,N,7,,143358,26695,NDP
8,,SING,C5B,H51A,no,N,8,,143358,26695,NDP
9,,SING,C5B,H52A,no,N,9,,143358,26695,NDP
10,,SING,C4B,O4B,no,N,10,,143358,26695,NDP
11,,SING,C4B,C3B,no,N,11,,143358,26695,NDP
12,,SING,C4B,H4B,no,N,12,,143358,26695,NDP
13,,SING,O4B,C1B,no,N,13,,143358,26695,NDP
14,,SING,C3B,O3B,no,N,14,,143358,26695,NDP
15,,SING,C3B,C2B,no,N,15,,143358,26695,NDP
16,,SING,C3B,H3B,no,N,16,,143358,26695,NDP
17,,SING,O3B,HO3A,no,N,17,,143358,26695,NDP
18,,SING,C2B,O2B,no,N,18,,143358,26695,NDP
19,,SING,C2B,C1B,no,N,19,,143358,26695,NDP
20,,SING,C2B,H2B,no,N,20,,143358,26695,NDP
21,,SING,O2B,P2B,no,N,21,,143358,26695,NDP
22,,SING,C1B,N9A,no,N,22,,143358,26695,NDP
23,,SING,C1B,H1B,no,N,23,,143358,26695,NDP
24,,SING,N9A,C8A,yes,N,24,,143358,26695,NDP
25,,SING,N9A,C4A,yes,N,25,,143358,26695,NDP
26,,DOUB,C8A,N7A,yes,N,26,,143358,26695,NDP
27,,SING,C8A,H8A,no,N,27,,143358,26695,NDP
28,,SING,N7A,C5A,yes,N,28,,143358,26695,NDP
29,,SING,C5A,C6A,yes,N,29,,143358,26695,NDP
30,,DOUB,C5A,C4A,yes,N,30,,143358,26695,NDP
31,,SING,C6A,N6A,no,N,31,,143358,26695,NDP
32,,DOUB,C6A,N1A,yes,N,32,,143358,26695,NDP
33,,SING,N6A,H61A,no,N,33,,143358,26695,NDP
34,,SING,N6A,H62A,no,N,34,,143358,26695,NDP
35,,SING,N1A,C2A,yes,N,35,,143358,26695,NDP
36,,DOUB,C2A,N3A,yes,N,36,,143358,26695,NDP
37,,SING,C2A,H2A,no,N,37,,143358,26695,NDP
38,,SING,N3A,C4A,yes,N,38,,143358,26695,NDP
39,,SING,O3,PN,no,N,39,,143358,26695,NDP
40,,DOUB,PN,O1N,no,N,40,,143358,26695,NDP
41,,SING,PN,O2N,no,N,41,,143358,26695,NDP
42,,SING,PN,O5D,no,N,42,,143358,26695,NDP
43,,SING,O2N,H21N,no,N,43,,143358,26695,NDP
44,,SING,O5D,C5D,no,N,44,,143358,26695,NDP
45,,SING,C5D,C4D,no,N,45,,143358,26695,NDP
46,,SING,C5D,H51N,no,N,46,,143358,26695,NDP
47,,SING,C5D,H52N,no,N,47,,143358,26695,NDP
48,,SING,C4D,O4D,no,N,48,,143358,26695,NDP
49,,SING,C4D,C3D,no,N,49,,143358,26695,NDP
50,,SING,C4D,H4D,no,N,50,,143358,26695,NDP
51,,SING,O4D,C1D,no,N,51,,143358,26695,NDP
52,,SING,C3D,O3D,no,N,52,,143358,26695,NDP
53,,SING,C3D,C2D,no,N,53,,143358,26695,NDP
54,,SING,C3D,H3D,no,N,54,,143358,26695,NDP
55,,SING,O3D,HO3N,no,N,55,,143358,26695,NDP
56,,SING,C2D,O2D,no,N,56,,143358,26695,NDP
57,,SING,C2D,C1D,no,N,57,,143358,26695,NDP
58,,SING,C2D,H2D,no,N,58,,143358,26695,NDP
59,,SING,O2D,HO2N,no,N,59,,143358,26695,NDP
60,,SING,C1D,N1N,no,N,60,,143358,26695,NDP
61,,SING,C1D,H1D,no,N,61,,143358,26695,NDP
62,,SING,N1N,C2N,no,N,62,,143358,26695,NDP
63,,SING,N1N,C6N,no,N,63,,143358,26695,NDP
64,,DOUB,C2N,C3N,no,N,64,,143358,26695,NDP
65,,SING,C2N,H2N,no,N,65,,143358,26695,NDP
66,,SING,C3N,C7N,no,N,66,,143358,26695,NDP
67,,SING,C3N,C4N,no,N,67,,143358,26695,NDP
68,,DOUB,C7N,O7N,no,N,68,,143358,26695,NDP
69,,SING,C7N,N7N,no,N,69,,143358,26695,NDP
70,,SING,N7N,H71N,no,N,70,,143358,26695,NDP
71,,SING,N7N,H72N,no,N,71,,143358,26695,NDP
72,,SING,C4N,C5N,no,N,72,,143358,26695,NDP
73,,SING,C4N,H41N,no,N,73,,143358,26695,NDP
74,,SING,C4N,H42N,no,N,74,,143358,26695,NDP
75,,DOUB,C5N,C6N,no,N,75,,143358,26695,NDP
76,,SING,C5N,H5N,no,N,76,,143358,26695,NDP
77,,SING,C6N,H6N,no,N,77,,143358,26695,NDP
78,,DOUB,P2B,O1X,no,N,78,,143358,26695,NDP
79,,SING,P2B,O2X,no,N,79,,143358,26695,NDP
80,,SING,P2B,O3X,no,N,80,,143358,26695,NDP
81,,SING,O2X,HOP2,no,N,81,,143358,26695,NDP
82,,SING,O3X,HOP3,no,N,82,,143358,26695,NDP
1,,SING,N,CA,no,N,1,,143439,26702,SEP
2,,SING,N,H,no,N,2,,143439,26702,SEP
3,,SING,N,H2,no,N,3,,143439,26702,SEP
4,,SING,CA,CB,no,N,4,,143439,26702,SEP
5,,SING,CA,C,no,N,5,,143439,26702,SEP
6,,SING,CA,HA,no,N,6,,143439,26702,SEP
7,,SING,CB,OG,no,N,7,,143439,26702,SEP
8,,SING,CB,HB2,no,N,8,,143439,26702,SEP
9,,SING,CB,HB3,no,N,9,,143439,26702,SEP
10,,SING,OG,P,no,N,10,,143439,26702,SEP
11,,DOUB,C,O,no,N,11,,143439,26702,SEP
12,,SING,C,OXT,no,N,12,,143439,26702,SEP
13,,SING,OXT,HXT,no,N,13,,143439,26702,SEP
14,,DOUB,P,O1P,no,N,14,,143439,26702,SEP
15,,SING,P,O2P,no,N,15,,143439,26702,SEP
16,,SING,P,O3P,no,N,16,,143439,26702,SEP
17,,SING,O2P,HOP2,no,N,17,,143439,26702,SEP
18,,SING,O3P,HOP3,no,N,18,,143439,26702,SEP
1,,SING,N,CA,no,N,1,,143440,26702,TPO
2,,SING,N,H,no,N,2,,143440,26702,TPO
3,,SING,N,H2,no,N,3,,143440,26702,TPO
4,,SING,CA,CB,no,N,4,,143440,26702,TPO
5,,SING,CA,C,no,N,5,,143440,26702,TPO
6,,SING,CA,HA,no,N,6,,143440,26702,TPO
7,,SING,CB,CG2,no,N,7,,143440,26702,TPO
8,,SING,CB,OG1,no,N,8,,143440,26702,TPO
9,,SING,CB,HB,no,N,9,,143440,26702,TPO
10,,SING,CG2,HG21,no,N,10,,143440,26702,TPO
11,,SING,CG2,HG22,no,N,11,,143440,26702,TPO
12,,SING,CG2,HG23,no,N,12,,143440,26702,TPO
13,,SING,OG1,P,no,N,13,,143440,26702,TPO
14,,DOUB,P,O1P,no,N,14,,143440,26702,TPO
15,,SING,P,O2P,no,N,15,,143440,26702,TPO
16,,SING,P,O3P,no,N,16,,143440,26702,TPO
17,,SING,O2P,HOP2,no,N,17,,143440,26702,TPO
18,,SING,O3P,HOP3,no,N,18,,143440,26702,TPO
19,,DOUB,C,O,no,N,19,,143440,26702,TPO
20,,SING,C,OXT,no,N,20,,143440,26702,TPO
21,,SING,OXT,HXT,no,N,21,,143440,26702,TPO
1,,DOUB,C1,O1,no,N,1,,144126,26741,AKG
2,,SING,C1,O2,no,N,2,,144126,26741,AKG
3,,SING,C1,C2,no,N,3,,144126,26741,AKG
4,,SING,O2,HO2,no,N,4,,144126,26741,AKG
5,,DOUB,C2,O5,no,N,5,,144126,26741,AKG
6,,SING,C2,C3,no,N,6,,144126,26741,AKG
7,,SING,C3,C4,no,N,7,,144126,26741,AKG
8,,SING,C3,H31,no,N,8,,144126,26741,AKG
9,,SING,C3,H32,no,N,9,,144126,26741,AKG
10,,SING,C4,C5,no,N,10,,144126,26741,AKG
11,,SING,C4,H41,no,N,11,,144126,26741,AKG
12,,SING,C4,H42,no,N,12,,144126,26741,AKG
13,,DOUB,C5,O3,no,N,13,,144126,26741,AKG
14,,SING,C5,O4,no,N,14,,144126,26741,AKG
15,,SING,O4,HO4,no,N,15,,144126,26741,AKG
1,,DOUB,C1,O1,no,N,1,,144152,26742,AKG
2,,SING,C1,O2,no,N,2,,144152,26742,AKG
3,,SING,C1,C2,no,N,3,,144152,26742,AKG
4,,SING,O2,HO2,no,N,4,,144152,26742,AKG
5,,DOUB,C2,O5,no,N,5,,144152,26742,AKG
6,,SING,C2,C3,no,N,6,,144152,26742,AKG
7,,SING,C3,C4,no,N,7,,144152,26742,AKG
8,,SING,C3,H31,no,N,8,,144152,26742,AKG
9,,SING,C3,H32,no,N,9,,144152,26742,AKG
10,,SING,C4,C5,no,N,10,,144152,26742,AKG
11,,SING,C4,H41,no,N,11,,144152,26742,AKG
12,,SING,C4,H42,no,N,12,,144152,26742,AKG
13,,DOUB,C5,O3,no,N,13,,144152,26742,AKG
14,,SING,C5,O4,no,N,14,,144152,26742,AKG
15,,SING,O4,HO4,no,N,15,,144152,26742,AKG
1,,SING,N,CA,no,N,1,,144174,26743,BTR
2,,SING,N,H,no,N,2,,144174,26743,BTR
3,,SING,N,H2,no,N,3,,144174,26743,BTR
4,,SING,CA,C,no,N,4,,144174,26743,BTR
5,,SING,CA,CB,no,N,5,,144174,26743,BTR
6,,SING,CA,HA,no,N,6,,144174,26743,BTR
7,,DOUB,C,O,no,N,7,,144174,26743,BTR
8,,SING,C,OXT,no,N,8,,144174,26743,BTR
9,,SING,OXT,HXT,no,N,9,,144174,26743,BTR
10,,SING,CB,CG,no,N,10,,144174,26743,BTR
11,,SING,CB,HB2,no,N,11,,144174,26743,BTR
12,,SING,CB,HB3,no,N,12,,144174,26743,BTR
13,,DOUB,CG,CD1,yes,N,13,,144174,26743,BTR
14,,SING,CG,CD2,yes,N,14,,144174,26743,BTR
15,,SING,CD1,NE1,yes,N,15,,144174,26743,BTR
16,,SING,CD1,HD1,no,N,16,,144174,26743,BTR
17,,SING,NE1,CE2,yes,N,17,,144174,26743,BTR
18,,SING,NE1,HE1,no,N,18,,144174,26743,BTR
19,,DOUB,CE2,CD2,yes,N,19,,144174,26743,BTR
20,,SING,CE2,CZ2,yes,N,20,,144174,26743,BTR
21,,SING,CD2,CE3,yes,N,21,,144174,26743,BTR
22,,DOUB,CE3,CZ3,yes,N,22,,144174,26743,BTR
23,,SING,CE3,HE3,no,N,23,,144174,26743,BTR
24,,SING,CZ3,CH2,yes,N,24,,144174,26743,BTR
25,,SING,CZ3,HZ3,no,N,25,,144174,26743,BTR
26,,SING,CH2,BR2,no,N,26,,144174,26743,BTR
27,,DOUB,CH2,CZ2,yes,N,27,,144174,26743,BTR
28,,SING,CZ2,HZ2,no,N,28,,144174,26743,BTR
1,,SING,CHA,C1A,no,N,1,,144263,26750,HEM
2,,DOUB,CHA,C4D,no,N,2,,144263,26750,HEM
3,,SING,CHA,HHA,no,N,3,,144263,26750,HEM
4,,SING,CHB,C4A,no,N,4,,144263,26750,HEM
5,,DOUB,CHB,C1B,no,N,5,,144263,26750,HEM
6,,SING,CHB,HHB,no,N,6,,144263,26750,HEM
7,,SING,CHC,C4B,no,N,7,,144263,26750,HEM
8,,DOUB,CHC,C1C,no,N,8,,144263,26750,HEM
9,,SING,CHC,HHC,no,N,9,,144263,26750,HEM
10,,DOUB,CHD,C4C,no,N,10,,144263,26750,HEM
11,,SING,CHD,C1D,no,N,11,,144263,26750,HEM
12,,SING,CHD,HHD,no,N,12,,144263,26750,HEM
13,,DOUB,C1A,C2A,yes,N,13,,144263,26750,HEM
14,,SING,C1A,NA,yes,N,14,,144263,26750,HEM
15,,SING,C2A,C3A,yes,N,15,,144263,26750,HEM
16,,SING,C2A,CAA,no,N,16,,144263,26750,HEM
17,,DOUB,C3A,C4A,yes,N,17,,144263,26750,HEM
18,,SING,C3A,CMA,no,N,18,,144263,26750,HEM
19,,SING,C4A,NA,yes,N,19,,144263,26750,HEM
20,,SING,CMA,HMA,no,N,20,,144263,26750,HEM
21,,SING,CMA,HMAA,no,N,21,,144263,26750,HEM
22,,SING,CMA,HMAB,no,N,22,,144263,26750,HEM
23,,SING,CAA,CBA,no,N,23,,144263,26750,HEM
24,,SING,CAA,HAA,no,N,24,,144263,26750,HEM
25,,SING,CAA,HAAA,no,N,25,,144263,26750,HEM
26,,SING,CBA,CGA,no,N,26,,144263,26750,HEM
27,,SING,CBA,HBA,no,N,27,,144263,26750,HEM
28,,SING,CBA,HBAA,no,N,28,,144263,26750,HEM
29,,DOUB,CGA,O1A,no,N,29,,144263,26750,HEM
30,,SING,CGA,O2A,no,N,30,,144263,26750,HEM
31,,SING,C1B,C2B,no,N,31,,144263,26750,HEM
32,,SING,C1B,NB,no,N,32,,144263,26750,HEM
33,,DOUB,C2B,C3B,no,N,33,,144263,26750,HEM
34,,SING,C2B,CMB,no,N,34,,144263,26750,HEM
35,,SING,C3B,C4B,no,N,35,,144263,26750,HEM
36,,SING,C3B,CAB,no,N,36,,144263,26750,HEM
37,,DOUB,C4B,NB,no,N,37,,144263,26750,HEM
38,,SING,CMB,HMB,no,N,38,,144263,26750,HEM
39,,SING,CMB,HMBA,no,N,39,,144263,26750,HEM
40,,SING,CMB,HMBB,no,N,40,,144263,26750,HEM
41,,DOUB,CAB,CBB,no,N,41,,144263,26750,HEM
42,,SING,CAB,HAB,no,N,42,,144263,26750,HEM
43,,SING,CBB,HBB,no,N,43,,144263,26750,HEM
44,,SING,CBB,HBBA,no,N,44,,144263,26750,HEM
45,,SING,C1C,C2C,yes,N,45,,144263,26750,HEM
46,,SING,C1C,NC,yes,N,46,,144263,26750,HEM
47,,DOUB,C2C,C3C,yes,N,47,,144263,26750,HEM
48,,SING,C2C,CMC,no,N,48,,144263,26750,HEM
49,,SING,C3C,C4C,yes,N,49,,144263,26750,HEM
50,,SING,C3C,CAC,no,N,50,,144263,26750,HEM
51,,SING,C4C,NC,yes,N,51,,144263,26750,HEM
52,,SING,CMC,HMC,no,N,52,,144263,26750,HEM
53,,SING,CMC,HMCA,no,N,53,,144263,26750,HEM
54,,SING,CMC,HMCB,no,N,54,,144263,26750,HEM
55,,DOUB,CAC,CBC,no,N,55,,144263,26750,HEM
56,,SING,CAC,HAC,no,N,56,,144263,26750,HEM
57,,SING,CBC,HBC,no,N,57,,144263,26750,HEM
58,,SING,CBC,HBCA,no,N,58,,144263,26750,HEM
59,,SING,C1D,C2D,no,N,59,,144263,26750,HEM
60,,DOUB,C1D,ND,no,N,60,,144263,26750,HEM
61,,DOUB,C2D,C3D,no,N,61,,144263,26750,HEM
62,,SING,C2D,CMD,no,N,62,,144263,26750,HEM
63,,SING,C3D,C4D,no,N,63,,144263,26750,HEM
64,,SING,C3D,CAD,no,N,64,,144263,26750,HEM
65,,SING,C4D,ND,no,N,65,,144263,26750,HEM
66,,SING,CMD,HMD,no,N,66,,144263,26750,HEM
67,,SING,CMD,HMDA,no,N,67,,144263,26750,HEM
68,,SING,CMD,HMDB,no,N,68,,144263,26750,HEM
69,,SING,CAD,CBD,no,N,69,,144263,26750,HEM
70,,SING,CAD,HAD,no,N,70,,144263,26750,HEM
71,,SING,CAD,HADA,no,N,71,,144263,26750,HEM
72,,SING,CBD,CGD,no,N,72,,144263,26750,HEM
73,,SING,CBD,HBD,no,N,73,,144263,26750,HEM
74,,SING,CBD,HBDA,no,N,74,,144263,26750,HEM
75,,DOUB,CGD,O1D,no,N,75,,144263,26750,HEM
76,,SING,CGD,O2D,no,N,76,,144263,26750,HEM
77,,SING,O2A,H2A,no,N,77,,144263,26750,HEM
78,,SING,O2D,H2D,no,N,78,,144263,26750,HEM
79,,SING,FE,NA,no,N,79,,144263,26750,HEM
80,,SING,FE,NB,no,N,80,,144263,26750,HEM
81,,SING,FE,NC,no,N,81,,144263,26750,HEM
82,,SING,FE,ND,no,N,82,,144263,26750,HEM
1,,DOUB,O5,C24,no,N,1,,144264,26750,MIV
2,,SING,C24,C23,no,N,2,,144264,26750,MIV
3,,SING,C24,O6,no,N,3,,144264,26750,MIV
4,,DOUB,C23,C22,no,E,4,,144264,26750,MIV
5,,SING,C22,C20,no,N,5,,144264,26750,MIV
6,,SING,C20,C21,no,N,6,,144264,26750,MIV
7,,SING,C20,C11,no,N,7,,144264,26750,MIV
8,,SING,C11,O2,no,N,8,,144264,26750,MIV
9,,SING,C11,C9,no,N,9,,144264,26750,MIV
10,,SING,O2,C12,no,N,10,,144264,26750,MIV
11,,SING,C12,O4,no,N,11,,144264,26750,MIV
12,,SING,C12,C13,no,N,12,,144264,26750,MIV
13,,SING,O4,C18,no,N,13,,144264,26750,MIV
14,,SING,C18,C19,no,N,14,,144264,26750,MIV
15,,SING,C18,C17,no,N,15,,144264,26750,MIV
16,,SING,C17,C14,no,N,16,,144264,26750,MIV
17,,SING,C14,N,no,N,17,,144264,26750,MIV
18,,SING,C14,C13,no,N,18,,144264,26750,MIV
19,,SING,N,C16,no,N,19,,144264,26750,MIV
20,,SING,N,C15,no,N,20,,144264,26750,MIV
21,,SING,C13,O3,no,N,21,,144264,26750,MIV
22,,SING,C9,C10,no,N,22,,144264,26750,MIV
23,,SING,C9,C8,no,N,23,,144264,26750,MIV
24,,SING,C8,C6,no,N,24,,144264,26750,MIV
25,,SING,C6,C7,no,N,25,,144264,26750,MIV
26,,SING,C6,C5,no,N,26,,144264,26750,MIV
27,,DOUB,C5,O1,no,N,27,,144264,26750,MIV
28,,SING,C5,C4,no,N,28,,144264,26750,MIV
29,,DOUB,C4,C3,no,N,29,,144264,26750,MIV
30,,SING,C3,C2,no,N,30,,144264,26750,MIV
31,,DOUB,C2,C1,no,N,31,,144264,26750,MIV
32,,SING,C1,C28,no,N,32,,144264,26750,MIV
33,,SING,O6,C25,no,N,33,,144264,26750,MIV
34,,SING,C25,C26,no,N,34,,144264,26750,MIV
35,,SING,C25,C28,no,N,35,,144264,26750,MIV
36,,SING,C26,C27,no,N,36,,144264,26750,MIV
37,,SING,C28,C29,no,N,37,,144264,26750,MIV
38,,SING,C29,O7,no,N,38,,144264,26750,MIV
39,,SING,O7,C30,no,N,39,,144264,26750,MIV
40,,SING,C30,O11,no,N,40,,144264,26750,MIV
41,,SING,C30,C31,no,N,41,,144264,26750,MIV
42,,SING,O11,C36,no,N,42,,144264,26750,MIV
43,,SING,C36,C37,no,N,43,,144264,26750,MIV
44,,SING,C36,C35,no,N,44,,144264,26750,MIV
45,,SING,C35,O10,no,N,45,,144264,26750,MIV
46,,SING,C35,C33,no,N,46,,144264,26750,MIV
47,,SING,C33,O9,no,N,47,,144264,26750,MIV
48,,SING,C33,C31,no,N,48,,144264,26750,MIV
49,,SING,O9,C34,no,N,49,,144264,26750,MIV
50,,SING,C31,O8,no,N,50,,144264,26750,MIV
51,,SING,O8,C32,no,N,51,,144264,26750,MIV
52,,SING,C23,H23,no,N,52,,144264,26750,MIV
53,,SING,C22,H22,no,N,53,,144264,26750,MIV
54,,SING,C20,H20,no,N,54,,144264,26750,MIV
55,,SING,C21,H211,no,N,55,,144264,26750,MIV
56,,SING,C21,H212,no,N,56,,144264,26750,MIV
57,,SING,C21,H213,no,N,57,,144264,26750,MIV
58,,SING,C11,H11,no,N,58,,144264,26750,MIV
59,,SING,C9,H9,no,N,59,,144264,26750,MIV
60,,SING,C12,H12,no,N,60,,144264,26750,MIV
61,,SING,C13,H13,no,N,61,,144264,26750,MIV
62,,SING,C18,H18,no,E,62,,144264,26750,MIV
63,,SING,C19,H191,no,N,63,,144264,26750,MIV
64,,SING,C19,H192,no,N,64,,144264,26750,MIV
65,,SING,C19,H193,no,N,65,,144264,26750,MIV
66,,SING,C17,H171,no,E,66,,144264,26750,MIV
67,,SING,C17,H172,no,N,67,,144264,26750,MIV
68,,SING,C14,H14,no,N,68,,144264,26750,MIV
69,,SING,C16,H161,no,N,69,,144264,26750,MIV
70,,SING,C16,H162,no,N,70,,144264,26750,MIV
71,,SING,C16,H163,no,N,71,,144264,26750,MIV
72,,SING,C15,H151,no,N,72,,144264,26750,MIV
73,,SING,C15,H152,no,N,73,,144264,26750,MIV
74,,SING,C15,H153,no,N,74,,144264,26750,MIV
75,,SING,O3,H3,no,N,75,,144264,26750,MIV
76,,SING,C10,H101,no,N,76,,144264,26750,MIV
77,,SING,C10,H102,no,N,77,,144264,26750,MIV
78,,SING,C10,H103,no,N,78,,144264,26750,MIV
79,,SING,C8,H81C,no,N,79,,144264,26750,MIV
80,,SING,C8,H82C,no,N,80,,144264,26750,MIV
81,,SING,C6,H6,no,N,81,,144264,26750,MIV
82,,SING,C7,H71C,no,N,82,,144264,26750,MIV
83,,SING,C7,H72C,no,N,83,,144264,26750,MIV
84,,SING,C7,H73C,no,N,84,,144264,26750,MIV
85,,SING,C4,H4,no,N,85,,144264,26750,MIV
86,,SING,C3,HA,no,N,86,,144264,26750,MIV
87,,SING,C2,H2,no,N,87,,144264,26750,MIV
88,,SING,C1,H1,no,N,88,,144264,26750,MIV
89,,SING,C28,H28,no,N,89,,144264,26750,MIV
90,,SING,C25,H25,no,N,90,,144264,26750,MIV
91,,SING,C26,H261,no,N,91,,144264,26750,MIV
92,,SING,C26,H262,no,N,92,,144264,26750,MIV
93,,SING,C27,H271,no,N,93,,144264,26750,MIV
94,,SING,C27,H272,no,N,94,,144264,26750,MIV
95,,SING,C27,H273,no,N,95,,144264,26750,MIV
96,,SING,C29,H291,no,N,96,,144264,26750,MIV
97,,SING,C29,H292,no,N,97,,144264,26750,MIV
98,,SING,C30,H30,no,N,98,,144264,26750,MIV
99,,SING,C31,H31,no,N,99,,144264,26750,MIV
100,,SING,C36,H36,no,N,100,,144264,26750,MIV
101,,SING,C37,H371,no,N,101,,144264,26750,MIV
102,,SING,C37,H372,no,N,102,,144264,26750,MIV
103,,SING,C37,H373,no,N,103,,144264,26750,MIV
104,,SING,C35,H35,no,N,104,,144264,26750,MIV
105,,SING,O10,H10,no,N,105,,144264,26750,MIV
106,,SING,C33,H33,no,N,106,,144264,26750,MIV
107,,SING,C34,H341,no,N,107,,144264,26750,MIV
108,,SING,C34,H342,no,N,108,,144264,26750,MIV
109,,SING,C34,H343,no,N,109,,144264,26750,MIV
110,,SING,C32,H321,no,N,110,,144264,26750,MIV
111,,SING,C32,H322,no,N,111,,144264,26750,MIV
112,,SING,C32,H323,no,N,112,,144264,26750,MIV
1,,SING,N1,C2,yes,N,1,,144318,26753,APR
2,,DOUB,N1,C6,yes,N,2,,144318,26753,APR
3,,DOUB,C2,N3,yes,N,3,,144318,26753,APR
4,,SING,C2,H2,no,N,4,,144318,26753,APR
5,,SING,N3,C4,yes,N,5,,144318,26753,APR
6,,DOUB,C4,C5,yes,N,6,,144318,26753,APR
7,,SING,C4,N9,yes,N,7,,144318,26753,APR
8,,SING,C5,C6,yes,N,8,,144318,26753,APR
9,,SING,C5,N7,yes,N,9,,144318,26753,APR
10,,SING,C6,N6,no,N,10,,144318,26753,APR
11,,SING,N6,H61,no,N,11,,144318,26753,APR
12,,SING,N6,H62,no,N,12,,144318,26753,APR
13,,DOUB,N7,C8,yes,N,13,,144318,26753,APR
14,,SING,C8,N9,yes,N,14,,144318,26753,APR
15,,SING,C8,H8,no,N,15,,144318,26753,APR
16,,SING,N9,C1',no,N,16,,144318,26753,APR
17,,SING,C1',C2',no,N,17,,144318,26753,APR
18,,SING,C1',O4',no,N,18,,144318,26753,APR
19,,SING,C1',H'1,no,N,19,,144318,26753,APR
20,,SING,C2',O2',no,N,20,,144318,26753,APR
21,,SING,C2',C3',no,N,21,,144318,26753,APR
22,,SING,C2',H'2,no,N,22,,144318,26753,APR
23,,SING,O2',HO'2,no,N,23,,144318,26753,APR
24,,SING,C3',O3',no,N,24,,144318,26753,APR
25,,SING,C3',C4',no,N,25,,144318,26753,APR
26,,SING,C3',H'3,no,N,26,,144318,26753,APR
27,,SING,O3',HO'3,no,N,27,,144318,26753,APR
28,,SING,O4',C4',no,N,28,,144318,26753,APR
29,,SING,C4',C5',no,N,29,,144318,26753,APR
30,,SING,C4',H'4,no,N,30,,144318,26753,APR
31,,SING,C5',O5',no,N,31,,144318,26753,APR
32,,SING,C5',H5'1,no,N,32,,144318,26753,APR
33,,SING,C5',H5'2,no,N,33,,144318,26753,APR
34,,SING,O5',PA,no,N,34,,144318,26753,APR
35,,DOUB,PA,O1A,no,N,35,,144318,26753,APR
36,,SING,PA,O2A,no,N,36,,144318,26753,APR
37,,SING,PA,O3A,no,N,37,,144318,26753,APR
38,,SING,O2A,HOA2,no,N,38,,144318,26753,APR
39,,SING,O3A,PB,no,N,39,,144318,26753,APR
40,,DOUB,PB,O1B,no,N,40,,144318,26753,APR
41,,SING,PB,O2B,no,N,41,,144318,26753,APR
42,,SING,PB,O5D,no,N,42,,144318,26753,APR
43,,SING,O2B,HOB2,no,N,43,,144318,26753,APR
44,,SING,O5D,C5D,no,N,44,,144318,26753,APR
45,,SING,C5D,C4D,no,N,45,,144318,26753,APR
46,,SING,C5D,H5R1,no,N,46,,144318,26753,APR
47,,SING,C5D,H5R2,no,N,47,,144318,26753,APR
48,,SING,O4D,C1D,no,N,48,,144318,26753,APR
49,,SING,O4D,C4D,no,N,49,,144318,26753,APR
50,,SING,O1D,C1D,no,N,50,,144318,26753,APR
51,,SING,O1D,HOR1,no,N,51,,144318,26753,APR
52,,SING,C1D,C2D,no,N,52,,144318,26753,APR
53,,SING,C1D,HR'1,no,N,53,,144318,26753,APR
54,,SING,O2D,C2D,no,N,54,,144318,26753,APR
55,,SING,O2D,HOR2,no,N,55,,144318,26753,APR
56,,SING,C2D,C3D,no,N,56,,144318,26753,APR
57,,SING,C2D,HR'2,no,N,57,,144318,26753,APR
58,,SING,O3D,C3D,no,N,58,,144318,26753,APR
59,,SING,O3D,HOR3,no,N,59,,144318,26753,APR
60,,SING,C3D,C4D,no,N,60,,144318,26753,APR
61,,SING,C3D,HR'3,no,N,61,,144318,26753,APR
62,,SING,C4D,HR'4,no,N,62,,144318,26753,APR
1,,DOUB,C1,C2,no,N,1,,144370,26756,DEX
2,,SING,C1,C10,no,N,2,,144370,26756,DEX
3,,SING,C1,H1,no,N,3,,144370,26756,DEX
4,,SING,C2,C3,no,N,4,,144370,26756,DEX
5,,SING,C2,H2,no,N,5,,144370,26756,DEX
6,,SING,C3,C4,no,N,6,,144370,26756,DEX
7,,DOUB,C3,O1,no,N,7,,144370,26756,DEX
8,,DOUB,C4,C5,no,N,8,,144370,26756,DEX
9,,SING,C4,H4,no,N,9,,144370,26756,DEX
10,,SING,C5,C6,no,N,10,,144370,26756,DEX
11,,SING,C5,C10,no,N,11,,144370,26756,DEX
12,,SING,C6,C7,no,N,12,,144370,26756,DEX
13,,SING,C6,H61,no,N,13,,144370,26756,DEX
14,,SING,C6,H62,no,N,14,,144370,26756,DEX
15,,SING,C7,C8,no,N,15,,144370,26756,DEX
16,,SING,C7,H71,no,N,16,,144370,26756,DEX
17,,SING,C7,H72,no,N,17,,144370,26756,DEX
18,,SING,C8,C9,no,N,18,,144370,26756,DEX
19,,SING,C8,C14,no,N,19,,144370,26756,DEX
20,,SING,C8,H8,no,N,20,,144370,26756,DEX
21,,SING,C9,C10,no,N,21,,144370,26756,DEX
22,,SING,C9,C11,no,N,22,,144370,26756,DEX
23,,SING,C9,F1,no,N,23,,144370,26756,DEX
24,,SING,C10,C19,no,N,24,,144370,26756,DEX
25,,SING,C11,C12,no,N,25,,144370,26756,DEX
26,,SING,C11,O2,no,N,26,,144370,26756,DEX
27,,SING,C11,H11,no,N,27,,144370,26756,DEX
28,,SING,C12,C13,no,N,28,,144370,26756,DEX
29,,SING,C12,H211,no,N,29,,144370,26756,DEX
30,,SING,C12,H221,no,N,30,,144370,26756,DEX
31,,SING,C13,C14,no,N,31,,144370,26756,DEX
32,,SING,C13,C17,no,N,32,,144370,26756,DEX
33,,SING,C13,C18,no,N,33,,144370,26756,DEX
34,,SING,C14,C15,no,N,34,,144370,26756,DEX
35,,SING,C14,H14,no,N,35,,144370,26756,DEX
36,,SING,C15,C16,no,N,36,,144370,26756,DEX
37,,SING,C15,H511,no,N,37,,144370,26756,DEX
38,,SING,C15,H521,no,N,38,,144370,26756,DEX
39,,SING,C16,C17,no,N,39,,144370,26756,DEX
40,,SING,C16,C22,no,N,40,,144370,26756,DEX
41,,SING,C16,H16,no,N,41,,144370,26756,DEX
42,,SING,C17,C20,no,N,42,,144370,26756,DEX
43,,SING,C17,O3,no,N,43,,144370,26756,DEX
44,,SING,C18,H811,no,N,44,,144370,26756,DEX
45,,SING,C18,H821,no,N,45,,144370,26756,DEX
46,,SING,C18,H831,no,N,46,,144370,26756,DEX
47,,SING,C19,H911,no,N,47,,144370,26756,DEX
48,,SING,C19,H921,no,N,48,,144370,26756,DEX
49,,SING,C19,H931,no,N,49,,144370,26756,DEX
50,,SING,C20,C21,no,N,50,,144370,26756,DEX
51,,DOUB,C20,O4,no,N,51,,144370,26756,DEX
52,,SING,C21,O5,no,N,52,,144370,26756,DEX
53,,SING,C21,H112,no,N,53,,144370,26756,DEX
54,,SING,C21,H122,no,N,54,,144370,26756,DEX
55,,SING,C22,H212,no,N,55,,144370,26756,DEX
56,,SING,C22,H222,no,N,56,,144370,26756,DEX
57,,SING,C22,H232,no,N,57,,144370,26756,DEX
58,,SING,O2,HO2,no,N,58,,144370,26756,DEX
59,,SING,O3,H3,no,N,59,,144370,26756,DEX
60,,SING,O5,H5,no,N,60,,144370,26756,DEX
1,,SING,C1,C2,no,N,1,,144371,26756,CPS
2,,SING,C1,C12,no,N,2,,144371,26756,CPS
3,,SING,C2,C11,no,N,3,,144371,26756,CPS
4,,SING,C2,C15,no,N,4,,144371,26756,CPS
5,,SING,C2,C19,no,N,5,,144371,26756,CPS
6,,SING,C3,C4,no,N,6,,144371,26756,CPS
7,,SING,C3,C19,no,N,7,,144371,26756,CPS
8,,SING,C4,C5,no,N,8,,144371,26756,CPS
9,,SING,C4,O4,no,N,9,,144371,26756,CPS
10,,SING,C5,C6,no,N,10,,144371,26756,CPS
11,,SING,C5,C9,no,N,11,,144371,26756,CPS
12,,SING,C5,C10,no,N,12,,144371,26756,CPS
13,,SING,C6,C7,no,N,13,,144371,26756,CPS
14,,SING,C6,C18,no,N,14,,144371,26756,CPS
15,,SING,C7,C8,no,N,15,,144371,26756,CPS
16,,SING,C8,C9,no,N,16,,144371,26756,CPS
17,,SING,C9,C20,no,N,17,,144371,26756,CPS
18,,SING,C12,C13,no,N,18,,144371,26756,CPS
19,,SING,C13,C14,no,N,19,,144371,26756,CPS
20,,SING,C13,O2,no,N,20,,144371,26756,CPS
21,,SING,C14,C15,no,N,21,,144371,26756,CPS
22,,SING,C15,C16,no,N,22,,144371,26756,CPS
23,,SING,C16,C17,no,N,23,,144371,26756,CPS
24,,SING,C17,C18,no,N,24,,144371,26756,CPS
25,,SING,C17,O3,no,N,25,,144371,26756,CPS
26,,SING,C18,C19,no,N,26,,144371,26756,CPS
27,,SING,C20,C21,no,N,27,,144371,26756,CPS
28,,SING,C20,C22,no,N,28,,144371,26756,CPS
29,,SING,C22,C23,no,N,29,,144371,26756,CPS
30,,SING,C23,C24,no,N,30,,144371,26756,CPS
31,,SING,C24,N1,no,N,31,,144371,26756,CPS
32,,DOUB,C24,O1,no,N,32,,144371,26756,CPS
33,,SING,C25,C26,no,N,33,,144371,26756,CPS
34,,SING,C25,N1,no,N,34,,144371,26756,CPS
35,,SING,C26,C27,no,N,35,,144371,26756,CPS
36,,SING,C27,N2,no,N,36,,144371,26756,CPS
37,,SING,C28,N2,no,N,37,,144371,26756,CPS
38,,SING,C29,N2,no,N,38,,144371,26756,CPS
39,,SING,C30,C31,no,N,39,,144371,26756,CPS
40,,SING,C30,N2,no,N,40,,144371,26756,CPS
41,,SING,C31,C32,no,N,41,,144371,26756,CPS
42,,SING,C32,S,no,N,42,,144371,26756,CPS
43,,SING,O2S,S,no,N,43,,144371,26756,CPS
44,,DOUB,O3S,S,no,N,44,,144371,26756,CPS
45,,DOUB,O1S,S,no,N,45,,144371,26756,CPS
46,,SING,C1,H1,no,N,46,,144371,26756,CPS
47,,SING,C1,H1A,no,N,47,,144371,26756,CPS
48,,SING,C3,H3,no,N,48,,144371,26756,CPS
49,,SING,C3,H3A,no,N,49,,144371,26756,CPS
50,,SING,C4,H4,no,N,50,,144371,26756,CPS
51,,SING,C6,H6,no,N,51,,144371,26756,CPS
52,,SING,C7,H7,no,N,52,,144371,26756,CPS
53,,SING,C7,H7A,no,N,53,,144371,26756,CPS
54,,SING,C8,H8,no,N,54,,144371,26756,CPS
55,,SING,C8,H8A,no,N,55,,144371,26756,CPS
56,,SING,C9,H9,no,N,56,,144371,26756,CPS
57,,SING,C10,H10,no,N,57,,144371,26756,CPS
58,,SING,C10,H10A,no,N,58,,144371,26756,CPS
59,,SING,C10,H10B,no,N,59,,144371,26756,CPS
60,,SING,C11,H11,no,N,60,,144371,26756,CPS
61,,SING,C11,H11A,no,N,61,,144371,26756,CPS
62,,SING,C11,H11B,no,N,62,,144371,26756,CPS
63,,SING,C12,H12,no,N,63,,144371,26756,CPS
64,,SING,C12,H12A,no,N,64,,144371,26756,CPS
65,,SING,C13,H13,no,N,65,,144371,26756,CPS
66,,SING,C14,H14,no,N,66,,144371,26756,CPS
67,,SING,C14,H14A,no,N,67,,144371,26756,CPS
68,,SING,C15,H15,no,N,68,,144371,26756,CPS
69,,SING,C16,H16,no,N,69,,144371,26756,CPS
70,,SING,C16,H16A,no,N,70,,144371,26756,CPS
71,,SING,C17,H17,no,N,71,,144371,26756,CPS
72,,SING,C18,H18,no,N,72,,144371,26756,CPS
73,,SING,C19,H19,no,N,73,,144371,26756,CPS
74,,SING,C20,H20,no,N,74,,144371,26756,CPS
75,,SING,C21,H21,no,N,75,,144371,26756,CPS
76,,SING,C21,H21A,no,N,76,,144371,26756,CPS
77,,SING,C21,H21B,no,N,77,,144371,26756,CPS
78,,SING,C22,H22,no,N,78,,144371,26756,CPS
79,,SING,C22,H22A,no,N,79,,144371,26756,CPS
80,,SING,C23,H23,no,N,80,,144371,26756,CPS
81,,SING,C23,H23A,no,N,81,,144371,26756,CPS
82,,SING,C25,H25,no,N,82,,144371,26756,CPS
83,,SING,C25,H25A,no,N,83,,144371,26756,CPS
84,,SING,C26,H261,no,N,84,,144371,26756,CPS
85,,SING,C27,H271,no,N,85,,144371,26756,CPS
86,,SING,C28,H28,no,N,86,,144371,26756,CPS
87,,SING,C28,H28A,no,N,87,,144371,26756,CPS
88,,SING,C28,H28B,no,N,88,,144371,26756,CPS
89,,SING,C29,H29,no,N,89,,144371,26756,CPS
90,,SING,C29,H29A,no,N,90,,144371,26756,CPS
91,,SING,C29,H29B,no,N,91,,144371,26756,CPS
92,,SING,C30,H30,no,N,92,,144371,26756,CPS
93,,SING,C30,H30A,no,N,93,,144371,26756,CPS
94,,SING,C31,H31,no,N,94,,144371,26756,CPS
95,,SING,C31,H31A,no,N,95,,144371,26756,CPS
96,,SING,C32,H32,no,N,96,,144371,26756,CPS
97,,SING,C32,H32A,no,N,97,,144371,26756,CPS
98,,SING,N1,HN1,no,N,98,,144371,26756,CPS
99,,SING,O2,HO2,no,N,99,,144371,26756,CPS
100,,SING,O3,HO3,no,N,100,,144371,26756,CPS
101,,SING,O4,HO4,no,N,101,,144371,26756,CPS
102,,SING,C26,H262,no,N,102,,144371,26756,CPS
103,,SING,C27,H272,no,N,103,,144371,26756,CPS
1,,DOUB,C1,C2,no,N,1,,144392,26757,DEX
2,,SING,C1,C10,no,N,2,,144392,26757,DEX
3,,SING,C1,H1,no,N,3,,144392,26757,DEX
4,,SING,C2,C3,no,N,4,,144392,26757,DEX
5,,SING,C2,H2,no,N,5,,144392,26757,DEX
6,,SING,C3,C4,no,N,6,,144392,26757,DEX
7,,DOUB,C3,O1,no,N,7,,144392,26757,DEX
8,,DOUB,C4,C5,no,N,8,,144392,26757,DEX
9,,SING,C4,H4,no,N,9,,144392,26757,DEX
10,,SING,C5,C6,no,N,10,,144392,26757,DEX
11,,SING,C5,C10,no,N,11,,144392,26757,DEX
12,,SING,C6,C7,no,N,12,,144392,26757,DEX
13,,SING,C6,H61,no,N,13,,144392,26757,DEX
14,,SING,C6,H62,no,N,14,,144392,26757,DEX
15,,SING,C7,C8,no,N,15,,144392,26757,DEX
16,,SING,C7,H71,no,N,16,,144392,26757,DEX
17,,SING,C7,H72,no,N,17,,144392,26757,DEX
18,,SING,C8,C9,no,N,18,,144392,26757,DEX
19,,SING,C8,C14,no,N,19,,144392,26757,DEX
20,,SING,C8,H8,no,N,20,,144392,26757,DEX
21,,SING,C9,C10,no,N,21,,144392,26757,DEX
22,,SING,C9,C11,no,N,22,,144392,26757,DEX
23,,SING,C9,F1,no,N,23,,144392,26757,DEX
24,,SING,C10,C19,no,N,24,,144392,26757,DEX
25,,SING,C11,C12,no,N,25,,144392,26757,DEX
26,,SING,C11,O2,no,N,26,,144392,26757,DEX
27,,SING,C11,H11,no,N,27,,144392,26757,DEX
28,,SING,C12,C13,no,N,28,,144392,26757,DEX
29,,SING,C12,H211,no,N,29,,144392,26757,DEX
30,,SING,C12,H221,no,N,30,,144392,26757,DEX
31,,SING,C13,C14,no,N,31,,144392,26757,DEX
32,,SING,C13,C17,no,N,32,,144392,26757,DEX
33,,SING,C13,C18,no,N,33,,144392,26757,DEX
34,,SING,C14,C15,no,N,34,,144392,26757,DEX
35,,SING,C14,H14,no,N,35,,144392,26757,DEX
36,,SING,C15,C16,no,N,36,,144392,26757,DEX
37,,SING,C15,H511,no,N,37,,144392,26757,DEX
38,,SING,C15,H521,no,N,38,,144392,26757,DEX
39,,SING,C16,C17,no,N,39,,144392,26757,DEX
40,,SING,C16,C22,no,N,40,,144392,26757,DEX
41,,SING,C16,H16,no,N,41,,144392,26757,DEX
42,,SING,C17,C20,no,N,42,,144392,26757,DEX
43,,SING,C17,O3,no,N,43,,144392,26757,DEX
44,,SING,C18,H811,no,N,44,,144392,26757,DEX
45,,SING,C18,H821,no,N,45,,144392,26757,DEX
46,,SING,C18,H831,no,N,46,,144392,26757,DEX
47,,SING,C19,H911,no,N,47,,144392,26757,DEX
48,,SING,C19,H921,no,N,48,,144392,26757,DEX
49,,SING,C19,H931,no,N,49,,144392,26757,DEX
50,,SING,C20,C21,no,N,50,,144392,26757,DEX
51,,DOUB,C20,O4,no,N,51,,144392,26757,DEX
52,,SING,C21,O5,no,N,52,,144392,26757,DEX
53,,SING,C21,H112,no,N,53,,144392,26757,DEX
54,,SING,C21,H122,no,N,54,,144392,26757,DEX
55,,SING,C22,H212,no,N,55,,144392,26757,DEX
56,,SING,C22,H222,no,N,56,,144392,26757,DEX
57,,SING,C22,H232,no,N,57,,144392,26757,DEX
58,,SING,O2,HO2,no,N,58,,144392,26757,DEX
59,,SING,O3,H3,no,N,59,,144392,26757,DEX
60,,SING,O5,H5,no,N,60,,144392,26757,DEX
1,,SING,C1,C2,no,N,1,,144393,26757,CPS
2,,SING,C1,C12,no,N,2,,144393,26757,CPS
3,,SING,C2,C11,no,N,3,,144393,26757,CPS
4,,SING,C2,C15,no,N,4,,144393,26757,CPS
5,,SING,C2,C19,no,N,5,,144393,26757,CPS
6,,SING,C3,C4,no,N,6,,144393,26757,CPS
7,,SING,C3,C19,no,N,7,,144393,26757,CPS
8,,SING,C4,C5,no,N,8,,144393,26757,CPS
9,,SING,C4,O4,no,N,9,,144393,26757,CPS
10,,SING,C5,C6,no,N,10,,144393,26757,CPS
11,,SING,C5,C9,no,N,11,,144393,26757,CPS
12,,SING,C5,C10,no,N,12,,144393,26757,CPS
13,,SING,C6,C7,no,N,13,,144393,26757,CPS
14,,SING,C6,C18,no,N,14,,144393,26757,CPS
15,,SING,C7,C8,no,N,15,,144393,26757,CPS
16,,SING,C8,C9,no,N,16,,144393,26757,CPS
17,,SING,C9,C20,no,N,17,,144393,26757,CPS
18,,SING,C12,C13,no,N,18,,144393,26757,CPS
19,,SING,C13,C14,no,N,19,,144393,26757,CPS
20,,SING,C13,O2,no,N,20,,144393,26757,CPS
21,,SING,C14,C15,no,N,21,,144393,26757,CPS
22,,SING,C15,C16,no,N,22,,144393,26757,CPS
23,,SING,C16,C17,no,N,23,,144393,26757,CPS
24,,SING,C17,C18,no,N,24,,144393,26757,CPS
25,,SING,C17,O3,no,N,25,,144393,26757,CPS
26,,SING,C18,C19,no,N,26,,144393,26757,CPS
27,,SING,C20,C21,no,N,27,,144393,26757,CPS
28,,SING,C20,C22,no,N,28,,144393,26757,CPS
29,,SING,C22,C23,no,N,29,,144393,26757,CPS
30,,SING,C23,C24,no,N,30,,144393,26757,CPS
31,,SING,C24,N1,no,N,31,,144393,26757,CPS
32,,DOUB,C24,O1,no,N,32,,144393,26757,CPS
33,,SING,C25,C26,no,N,33,,144393,26757,CPS
34,,SING,C25,N1,no,N,34,,144393,26757,CPS
35,,SING,C26,C27,no,N,35,,144393,26757,CPS
36,,SING,C27,N2,no,N,36,,144393,26757,CPS
37,,SING,C28,N2,no,N,37,,144393,26757,CPS
38,,SING,C29,N2,no,N,38,,144393,26757,CPS
39,,SING,C30,C31,no,N,39,,144393,26757,CPS
40,,SING,C30,N2,no,N,40,,144393,26757,CPS
41,,SING,C31,C32,no,N,41,,144393,26757,CPS
42,,SING,C32,S,no,N,42,,144393,26757,CPS
43,,SING,O2S,S,no,N,43,,144393,26757,CPS
44,,DOUB,O3S,S,no,N,44,,144393,26757,CPS
45,,DOUB,O1S,S,no,N,45,,144393,26757,CPS
46,,SING,C1,H1,no,N,46,,144393,26757,CPS
47,,SING,C1,H1A,no,N,47,,144393,26757,CPS
48,,SING,C3,H3,no,N,48,,144393,26757,CPS
49,,SING,C3,H3A,no,N,49,,144393,26757,CPS
50,,SING,C4,H4,no,N,50,,144393,26757,CPS
51,,SING,C6,H6,no,N,51,,144393,26757,CPS
52,,SING,C7,H7,no,N,52,,144393,26757,CPS
53,,SING,C7,H7A,no,N,53,,144393,26757,CPS
54,,SING,C8,H8,no,N,54,,144393,26757,CPS
55,,SING,C8,H8A,no,N,55,,144393,26757,CPS
56,,SING,C9,H9,no,N,56,,144393,26757,CPS
57,,SING,C10,H10,no,N,57,,144393,26757,CPS
58,,SING,C10,H10A,no,N,58,,144393,26757,CPS
59,,SING,C10,H10B,no,N,59,,144393,26757,CPS
60,,SING,C11,H11,no,N,60,,144393,26757,CPS
61,,SING,C11,H11A,no,N,61,,144393,26757,CPS
62,,SING,C11,H11B,no,N,62,,144393,26757,CPS
63,,SING,C12,H12,no,N,63,,144393,26757,CPS
64,,SING,C12,H12A,no,N,64,,144393,26757,CPS
65,,SING,C13,H13,no,N,65,,144393,26757,CPS
66,,SING,C14,H14,no,N,66,,144393,26757,CPS
67,,SING,C14,H14A,no,N,67,,144393,26757,CPS
68,,SING,C15,H15,no,N,68,,144393,26757,CPS
69,,SING,C16,H16,no,N,69,,144393,26757,CPS
70,,SING,C16,H16A,no,N,70,,144393,26757,CPS
71,,SING,C17,H17,no,N,71,,144393,26757,CPS
72,,SING,C18,H18,no,N,72,,144393,26757,CPS
73,,SING,C19,H19,no,N,73,,144393,26757,CPS
74,,SING,C20,H20,no,N,74,,144393,26757,CPS
75,,SING,C21,H21,no,N,75,,144393,26757,CPS
76,,SING,C21,H21A,no,N,76,,144393,26757,CPS
77,,SING,C21,H21B,no,N,77,,144393,26757,CPS
78,,SING,C22,H22,no,N,78,,144393,26757,CPS
79,,SING,C22,H22A,no,N,79,,144393,26757,CPS
80,,SING,C23,H23,no,N,80,,144393,26757,CPS
81,,SING,C23,H23A,no,N,81,,144393,26757,CPS
82,,SING,C25,H25,no,N,82,,144393,26757,CPS
83,,SING,C25,H25A,no,N,83,,144393,26757,CPS
84,,SING,C26,H261,no,N,84,,144393,26757,CPS
85,,SING,C27,H271,no,N,85,,144393,26757,CPS
86,,SING,C28,H28,no,N,86,,144393,26757,CPS
87,,SING,C28,H28A,no,N,87,,144393,26757,CPS
88,,SING,C28,H28B,no,N,88,,144393,26757,CPS
89,,SING,C29,H29,no,N,89,,144393,26757,CPS
90,,SING,C29,H29A,no,N,90,,144393,26757,CPS
91,,SING,C29,H29B,no,N,91,,144393,26757,CPS
92,,SING,C30,H30,no,N,92,,144393,26757,CPS
93,,SING,C30,H30A,no,N,93,,144393,26757,CPS
94,,SING,C31,H31,no,N,94,,144393,26757,CPS
95,,SING,C31,H31A,no,N,95,,144393,26757,CPS
96,,SING,C32,H32,no,N,96,,144393,26757,CPS
97,,SING,C32,H32A,no,N,97,,144393,26757,CPS
98,,SING,N1,HN1,no,N,98,,144393,26757,CPS
99,,SING,O2,HO2,no,N,99,,144393,26757,CPS
100,,SING,O3,HO3,no,N,100,,144393,26757,CPS
101,,SING,O4,HO4,no,N,101,,144393,26757,CPS
102,,SING,C26,H262,no,N,102,,144393,26757,CPS
103,,SING,C27,H272,no,N,103,,144393,26757,CPS
1,,SING,C1,C2,no,N,1,,144493,26763,TES
2,,SING,C1,C10,no,N,2,,144493,26763,TES
3,,SING,C1,H11,no,N,3,,144493,26763,TES
4,,SING,C1,H12,no,N,4,,144493,26763,TES
5,,SING,C2,C3,no,N,5,,144493,26763,TES
6,,SING,C2,H21,no,N,6,,144493,26763,TES
7,,SING,C2,H22,no,N,7,,144493,26763,TES
8,,DOUB,C3,O3,no,N,8,,144493,26763,TES
9,,SING,C3,C4,no,N,9,,144493,26763,TES
10,,DOUB,C4,C5,no,N,10,,144493,26763,TES
11,,SING,C4,H4,no,N,11,,144493,26763,TES
12,,SING,C5,C6,no,N,12,,144493,26763,TES
13,,SING,C5,C10,no,N,13,,144493,26763,TES
14,,SING,C6,C7,no,N,14,,144493,26763,TES
15,,SING,C6,H61,no,N,15,,144493,26763,TES
16,,SING,C6,H62,no,N,16,,144493,26763,TES
17,,SING,C7,C8,no,N,17,,144493,26763,TES
18,,SING,C7,H71,no,N,18,,144493,26763,TES
19,,SING,C7,H72,no,N,19,,144493,26763,TES
20,,SING,C8,C9,no,N,20,,144493,26763,TES
21,,SING,C8,C14,no,N,21,,144493,26763,TES
22,,SING,C8,H8,no,N,22,,144493,26763,TES
23,,SING,C9,C10,no,N,23,,144493,26763,TES
24,,SING,C9,C11,no,N,24,,144493,26763,TES
25,,SING,C9,H9,no,N,25,,144493,26763,TES
26,,SING,C10,C19,no,N,26,,144493,26763,TES
27,,SING,C11,C12,no,N,27,,144493,26763,TES
28,,SING,C11,H111,no,N,28,,144493,26763,TES
29,,SING,C11,H112,no,N,29,,144493,26763,TES
30,,SING,C12,C13,no,N,30,,144493,26763,TES
31,,SING,C12,H121,no,N,31,,144493,26763,TES
32,,SING,C12,H122,no,N,32,,144493,26763,TES
33,,SING,C13,C14,no,N,33,,144493,26763,TES
34,,SING,C13,C17,no,N,34,,144493,26763,TES
35,,SING,C13,C18,no,N,35,,144493,26763,TES
36,,SING,C14,C15,no,N,36,,144493,26763,TES
37,,SING,C14,H14,no,N,37,,144493,26763,TES
38,,SING,C15,C16,no,N,38,,144493,26763,TES
39,,SING,C15,H151,no,N,39,,144493,26763,TES
40,,SING,C15,H152,no,N,40,,144493,26763,TES
41,,SING,C16,C17,no,N,41,,144493,26763,TES
42,,SING,C16,H161,no,N,42,,144493,26763,TES
43,,SING,C16,H162,no,N,43,,144493,26763,TES
44,,SING,C17,O17,no,N,44,,144493,26763,TES
45,,SING,C17,H17,no,N,45,,144493,26763,TES
46,,SING,O17,HO7,no,N,46,,144493,26763,TES
47,,SING,C18,H181,no,N,47,,144493,26763,TES
48,,SING,C18,H182,no,N,48,,144493,26763,TES
49,,SING,C18,H183,no,N,49,,144493,26763,TES
50,,SING,C19,H191,no,N,50,,144493,26763,TES
51,,SING,C19,H192,no,N,51,,144493,26763,TES
52,,SING,C19,H193,no,N,52,,144493,26763,TES
1,,SING,BE,F1,no,N,1,,144715,26776,BEF
2,,SING,BE,F2,no,N,2,,144715,26776,BEF
3,,SING,BE,F3,no,N,3,,144715,26776,BEF
1,,SING,BE,F1,no,N,1,,144737,26777,BEF
2,,SING,BE,F2,no,N,2,,144737,26777,BEF
3,,SING,BE,F3,no,N,3,,144737,26777,BEF
1,,SING,N,CA,no,N,1,,144879,26786,SEP
2,,SING,N,H,no,N,2,,144879,26786,SEP
3,,SING,N,H2,no,N,3,,144879,26786,SEP
4,,SING,CA,CB,no,N,4,,144879,26786,SEP
5,,SING,CA,C,no,N,5,,144879,26786,SEP
6,,SING,CA,HA,no,N,6,,144879,26786,SEP
7,,SING,CB,OG,no,N,7,,144879,26786,SEP
8,,SING,CB,HB2,no,N,8,,144879,26786,SEP
9,,SING,CB,HB3,no,N,9,,144879,26786,SEP
10,,SING,OG,P,no,N,10,,144879,26786,SEP
11,,DOUB,C,O,no,N,11,,144879,26786,SEP
12,,SING,C,OXT,no,N,12,,144879,26786,SEP
13,,SING,OXT,HXT,no,N,13,,144879,26786,SEP
14,,DOUB,P,O1P,no,N,14,,144879,26786,SEP
15,,SING,P,O2P,no,N,15,,144879,26786,SEP
16,,SING,P,O3P,no,N,16,,144879,26786,SEP
17,,SING,O2P,HOP2,no,N,17,,144879,26786,SEP
18,,SING,O3P,HOP3,no,N,18,,144879,26786,SEP
1,,SING,N,CA,no,N,1,,144880,26786,TPO
2,,SING,N,H,no,N,2,,144880,26786,TPO
3,,SING,N,H2,no,N,3,,144880,26786,TPO
4,,SING,CA,CB,no,N,4,,144880,26786,TPO
5,,SING,CA,C,no,N,5,,144880,26786,TPO
6,,SING,CA,HA,no,N,6,,144880,26786,TPO
7,,SING,CB,CG2,no,N,7,,144880,26786,TPO
8,,SING,CB,OG1,no,N,8,,144880,26786,TPO
9,,SING,CB,HB,no,N,9,,144880,26786,TPO
10,,SING,CG2,HG21,no,N,10,,144880,26786,TPO
11,,SING,CG2,HG22,no,N,11,,144880,26786,TPO
12,,SING,CG2,HG23,no,N,12,,144880,26786,TPO
13,,SING,OG1,P,no,N,13,,144880,26786,TPO
14,,DOUB,P,O1P,no,N,14,,144880,26786,TPO
15,,SING,P,O2P,no,N,15,,144880,26786,TPO
16,,SING,P,O3P,no,N,16,,144880,26786,TPO
17,,SING,O2P,HOP2,no,N,17,,144880,26786,TPO
18,,SING,O3P,HOP3,no,N,18,,144880,26786,TPO
19,,DOUB,C,O,no,N,19,,144880,26786,TPO
20,,SING,C,OXT,no,N,20,,144880,26786,TPO
21,,SING,OXT,HXT,no,N,21,,144880,26786,TPO
1,,DOUB,PB,O1B,no,N,1,,144898,26787,GDP
2,,SING,PB,O2B,no,N,2,,144898,26787,GDP
3,,SING,PB,O3B,no,N,3,,144898,26787,GDP
4,,SING,PB,O3A,no,N,4,,144898,26787,GDP
5,,SING,O2B,HOB2,no,N,5,,144898,26787,GDP
6,,SING,O3B,HOB3,no,N,6,,144898,26787,GDP
7,,SING,O3A,PA,no,N,7,,144898,26787,GDP
8,,DOUB,PA,O1A,no,N,8,,144898,26787,GDP
9,,SING,PA,O2A,no,N,9,,144898,26787,GDP
10,,SING,PA,O5',no,N,10,,144898,26787,GDP
11,,SING,O2A,HOA2,no,N,11,,144898,26787,GDP
12,,SING,O5',C5',no,N,12,,144898,26787,GDP
13,,SING,C5',C4',no,N,13,,144898,26787,GDP
14,,SING,C5',H5',no,N,14,,144898,26787,GDP
15,,SING,C5',H5'',no,N,15,,144898,26787,GDP
16,,SING,C4',O4',no,N,16,,144898,26787,GDP
17,,SING,C4',C3',no,N,17,,144898,26787,GDP
18,,SING,C4',H4',no,N,18,,144898,26787,GDP
19,,SING,O4',C1',no,N,19,,144898,26787,GDP
20,,SING,C3',O3',no,N,20,,144898,26787,GDP
21,,SING,C3',C2',no,N,21,,144898,26787,GDP
22,,SING,C3',H3',no,N,22,,144898,26787,GDP
23,,SING,O3',HO3',no,N,23,,144898,26787,GDP
24,,SING,C2',O2',no,N,24,,144898,26787,GDP
25,,SING,C2',C1',no,N,25,,144898,26787,GDP
26,,SING,C2',H2',no,N,26,,144898,26787,GDP
27,,SING,O2',HO2',no,N,27,,144898,26787,GDP
28,,SING,C1',N9,no,N,28,,144898,26787,GDP
29,,SING,C1',H1',no,N,29,,144898,26787,GDP
30,,SING,N9,C8,yes,N,30,,144898,26787,GDP
31,,SING,N9,C4,yes,N,31,,144898,26787,GDP
32,,DOUB,C8,N7,yes,N,32,,144898,26787,GDP
33,,SING,C8,H8,no,N,33,,144898,26787,GDP
34,,SING,N7,C5,yes,N,34,,144898,26787,GDP
35,,SING,C5,C6,no,N,35,,144898,26787,GDP
36,,DOUB,C5,C4,yes,N,36,,144898,26787,GDP
37,,DOUB,C6,O6,no,N,37,,144898,26787,GDP
38,,SING,C6,N1,no,N,38,,144898,26787,GDP
39,,SING,N1,C2,no,N,39,,144898,26787,GDP
40,,SING,N1,HN1,no,N,40,,144898,26787,GDP
41,,SING,C2,N2,no,N,41,,144898,26787,GDP
42,,DOUB,C2,N3,no,N,42,,144898,26787,GDP
43,,SING,N2,HN21,no,N,43,,144898,26787,GDP
44,,SING,N2,HN22,no,N,44,,144898,26787,GDP
45,,SING,N3,C4,no,N,45,,144898,26787,GDP
1,,SING,N,CA,no,N,1,,144954,26790,PCA
2,,SING,N,CD,no,N,2,,144954,26790,PCA
3,,SING,N,H,no,N,3,,144954,26790,PCA
4,,SING,CA,CB,no,N,4,,144954,26790,PCA
5,,SING,CA,C,no,N,5,,144954,26790,PCA
6,,SING,CA,HA,no,N,6,,144954,26790,PCA
7,,SING,CB,CG,no,N,7,,144954,26790,PCA
8,,SING,CB,HB2,no,N,8,,144954,26790,PCA
9,,SING,CB,HB3,no,N,9,,144954,26790,PCA
10,,SING,CG,CD,no,N,10,,144954,26790,PCA
11,,SING,CG,HG2,no,N,11,,144954,26790,PCA
12,,SING,CG,HG3,no,N,12,,144954,26790,PCA
13,,DOUB,CD,OE,no,N,13,,144954,26790,PCA
14,,DOUB,C,O,no,N,14,,144954,26790,PCA
15,,SING,C,OXT,no,N,15,,144954,26790,PCA
16,,SING,OXT,HXT,no,N,16,,144954,26790,PCA
1,,SING,N,CA,no,N,1,,145038,26794,DTR
2,,SING,N,H,no,N,2,,145038,26794,DTR
3,,SING,N,HN2,no,N,3,,145038,26794,DTR
4,,SING,CA,CB,no,N,4,,145038,26794,DTR
5,,SING,CA,C,no,N,5,,145038,26794,DTR
6,,SING,CA,HA,no,N,6,,145038,26794,DTR
7,,SING,CB,CG,no,N,7,,145038,26794,DTR
8,,SING,CB,HB2,no,N,8,,145038,26794,DTR
9,,SING,CB,HB3,no,N,9,,145038,26794,DTR
10,,DOUB,CG,CD1,yes,N,10,,145038,26794,DTR
11,,SING,CG,CD2,yes,N,11,,145038,26794,DTR
12,,SING,CD1,NE1,yes,N,12,,145038,26794,DTR
13,,SING,CD1,HD1,no,N,13,,145038,26794,DTR
14,,SING,NE1,CE2,yes,N,14,,145038,26794,DTR
15,,SING,NE1,HE1,no,N,15,,145038,26794,DTR
16,,DOUB,CE2,CZ2,yes,N,16,,145038,26794,DTR
17,,SING,CE2,CD2,yes,N,17,,145038,26794,DTR
18,,SING,CZ2,CH2,yes,N,18,,145038,26794,DTR
19,,SING,CZ2,HZ2,no,N,19,,145038,26794,DTR
20,,DOUB,CH2,CZ3,yes,N,20,,145038,26794,DTR
21,,SING,CH2,HH2,no,N,21,,145038,26794,DTR
22,,SING,CZ3,CE3,yes,N,22,,145038,26794,DTR
23,,SING,CZ3,HZ3,no,N,23,,145038,26794,DTR
24,,DOUB,CE3,CD2,yes,N,24,,145038,26794,DTR
25,,SING,CE3,HE3,no,N,25,,145038,26794,DTR
26,,DOUB,C,O,no,N,26,,145038,26794,DTR
27,,SING,C,OXT,no,N,27,,145038,26794,DTR
28,,SING,OXT,HXT,no,N,28,,145038,26794,DTR
1,,DOUB,C,O,no,N,1,,145039,26794,WFP
2,,SING,C,CA,no,N,2,,145039,26794,WFP
3,,SING,C,OXT,no,N,3,,145039,26794,WFP
4,,SING,N,CA,no,N,4,,145039,26794,WFP
5,,SING,F1,CE1,no,N,5,,145039,26794,WFP
6,,SING,F2,CE2,no,N,6,,145039,26794,WFP
7,,SING,CA,CB,no,N,7,,145039,26794,WFP
8,,SING,CB,CG,no,N,8,,145039,26794,WFP
9,,DOUB,CG,CD1,yes,N,9,,145039,26794,WFP
10,,SING,CG,CD2,yes,N,10,,145039,26794,WFP
11,,DOUB,CZ,CE1,yes,N,11,,145039,26794,WFP
12,,SING,CZ,CE2,yes,N,12,,145039,26794,WFP
13,,SING,CD1,CE1,yes,N,13,,145039,26794,WFP
14,,DOUB,CD2,CE2,yes,N,14,,145039,26794,WFP
15,,SING,N,H,no,N,15,,145039,26794,WFP
16,,SING,N,H2,no,N,16,,145039,26794,WFP
17,,SING,CA,HA,no,N,17,,145039,26794,WFP
18,,SING,CB,HB2,no,N,18,,145039,26794,WFP
19,,SING,CB,HB3,no,N,19,,145039,26794,WFP
20,,SING,CZ,HZ,no,N,20,,145039,26794,WFP
21,,SING,CD1,HD1,no,N,21,,145039,26794,WFP
22,,SING,CD2,HD2,no,N,22,,145039,26794,WFP
23,,SING,OXT,HXT,no,N,23,,145039,26794,WFP
1,,SING,N,CA,no,N,1,,145057,26795,DTR
2,,SING,N,H,no,N,2,,145057,26795,DTR
3,,SING,N,HN2,no,N,3,,145057,26795,DTR
4,,SING,CA,CB,no,N,4,,145057,26795,DTR
5,,SING,CA,C,no,N,5,,145057,26795,DTR
6,,SING,CA,HA,no,N,6,,145057,26795,DTR
7,,SING,CB,CG,no,N,7,,145057,26795,DTR
8,,SING,CB,HB2,no,N,8,,145057,26795,DTR
9,,SING,CB,HB3,no,N,9,,145057,26795,DTR
10,,DOUB,CG,CD1,yes,N,10,,145057,26795,DTR
11,,SING,CG,CD2,yes,N,11,,145057,26795,DTR
12,,SING,CD1,NE1,yes,N,12,,145057,26795,DTR
13,,SING,CD1,HD1,no,N,13,,145057,26795,DTR
14,,SING,NE1,CE2,yes,N,14,,145057,26795,DTR
15,,SING,NE1,HE1,no,N,15,,145057,26795,DTR
16,,DOUB,CE2,CZ2,yes,N,16,,145057,26795,DTR
17,,SING,CE2,CD2,yes,N,17,,145057,26795,DTR
18,,SING,CZ2,CH2,yes,N,18,,145057,26795,DTR
19,,SING,CZ2,HZ2,no,N,19,,145057,26795,DTR
20,,DOUB,CH2,CZ3,yes,N,20,,145057,26795,DTR
21,,SING,CH2,HH2,no,N,21,,145057,26795,DTR
22,,SING,CZ3,CE3,yes,N,22,,145057,26795,DTR
23,,SING,CZ3,HZ3,no,N,23,,145057,26795,DTR
24,,DOUB,CE3,CD2,yes,N,24,,145057,26795,DTR
25,,SING,CE3,HE3,no,N,25,,145057,26795,DTR
26,,DOUB,C,O,no,N,26,,145057,26795,DTR
27,,SING,C,OXT,no,N,27,,145057,26795,DTR
28,,SING,OXT,HXT,no,N,28,,145057,26795,DTR
1,,DOUB,C,O,no,N,1,,145058,26795,WFP
2,,SING,C,CA,no,N,2,,145058,26795,WFP
3,,SING,C,OXT,no,N,3,,145058,26795,WFP
4,,SING,N,CA,no,N,4,,145058,26795,WFP
5,,SING,F1,CE1,no,N,5,,145058,26795,WFP
6,,SING,F2,CE2,no,N,6,,145058,26795,WFP
7,,SING,CA,CB,no,N,7,,145058,26795,WFP
8,,SING,CB,CG,no,N,8,,145058,26795,WFP
9,,DOUB,CG,CD1,yes,N,9,,145058,26795,WFP
10,,SING,CG,CD2,yes,N,10,,145058,26795,WFP
11,,DOUB,CZ,CE1,yes,N,11,,145058,26795,WFP
12,,SING,CZ,CE2,yes,N,12,,145058,26795,WFP
13,,SING,CD1,CE1,yes,N,13,,145058,26795,WFP
14,,DOUB,CD2,CE2,yes,N,14,,145058,26795,WFP
15,,SING,N,H,no,N,15,,145058,26795,WFP
16,,SING,N,H2,no,N,16,,145058,26795,WFP
17,,SING,CA,HA,no,N,17,,145058,26795,WFP
18,,SING,CB,HB2,no,N,18,,145058,26795,WFP
19,,SING,CB,HB3,no,N,19,,145058,26795,WFP
20,,SING,CZ,HZ,no,N,20,,145058,26795,WFP
21,,SING,CD1,HD1,no,N,21,,145058,26795,WFP
22,,SING,CD2,HD2,no,N,22,,145058,26795,WFP
23,,SING,OXT,HXT,no,N,23,,145058,26795,WFP
1,,SING,N,CA,no,N,1,,145076,26796,DTR
2,,SING,N,H,no,N,2,,145076,26796,DTR
3,,SING,N,HN2,no,N,3,,145076,26796,DTR
4,,SING,CA,CB,no,N,4,,145076,26796,DTR
5,,SING,CA,C,no,N,5,,145076,26796,DTR
6,,SING,CA,HA,no,N,6,,145076,26796,DTR
7,,SING,CB,CG,no,N,7,,145076,26796,DTR
8,,SING,CB,HB2,no,N,8,,145076,26796,DTR
9,,SING,CB,HB3,no,N,9,,145076,26796,DTR
10,,DOUB,CG,CD1,yes,N,10,,145076,26796,DTR
11,,SING,CG,CD2,yes,N,11,,145076,26796,DTR
12,,SING,CD1,NE1,yes,N,12,,145076,26796,DTR
13,,SING,CD1,HD1,no,N,13,,145076,26796,DTR
14,,SING,NE1,CE2,yes,N,14,,145076,26796,DTR
15,,SING,NE1,HE1,no,N,15,,145076,26796,DTR
16,,DOUB,CE2,CZ2,yes,N,16,,145076,26796,DTR
17,,SING,CE2,CD2,yes,N,17,,145076,26796,DTR
18,,SING,CZ2,CH2,yes,N,18,,145076,26796,DTR
19,,SING,CZ2,HZ2,no,N,19,,145076,26796,DTR
20,,DOUB,CH2,CZ3,yes,N,20,,145076,26796,DTR
21,,SING,CH2,HH2,no,N,21,,145076,26796,DTR
22,,SING,CZ3,CE3,yes,N,22,,145076,26796,DTR
23,,SING,CZ3,HZ3,no,N,23,,145076,26796,DTR
24,,DOUB,CE3,CD2,yes,N,24,,145076,26796,DTR
25,,SING,CE3,HE3,no,N,25,,145076,26796,DTR
26,,DOUB,C,O,no,N,26,,145076,26796,DTR
27,,SING,C,OXT,no,N,27,,145076,26796,DTR
28,,SING,OXT,HXT,no,N,28,,145076,26796,DTR
1,,DOUB,C,O,no,N,1,,145077,26796,WFP
2,,SING,C,CA,no,N,2,,145077,26796,WFP
3,,SING,C,OXT,no,N,3,,145077,26796,WFP
4,,SING,N,CA,no,N,4,,145077,26796,WFP
5,,SING,F1,CE1,no,N,5,,145077,26796,WFP
6,,SING,F2,CE2,no,N,6,,145077,26796,WFP
7,,SING,CA,CB,no,N,7,,145077,26796,WFP
8,,SING,CB,CG,no,N,8,,145077,26796,WFP
9,,DOUB,CG,CD1,yes,N,9,,145077,26796,WFP
10,,SING,CG,CD2,yes,N,10,,145077,26796,WFP
11,,DOUB,CZ,CE1,yes,N,11,,145077,26796,WFP
12,,SING,CZ,CE2,yes,N,12,,145077,26796,WFP
13,,SING,CD1,CE1,yes,N,13,,145077,26796,WFP
14,,DOUB,CD2,CE2,yes,N,14,,145077,26796,WFP
15,,SING,N,H,no,N,15,,145077,26796,WFP
16,,SING,N,H2,no,N,16,,145077,26796,WFP
17,,SING,CA,HA,no,N,17,,145077,26796,WFP
18,,SING,CB,HB2,no,N,18,,145077,26796,WFP
19,,SING,CB,HB3,no,N,19,,145077,26796,WFP
20,,SING,CZ,HZ,no,N,20,,145077,26796,WFP
21,,SING,CD1,HD1,no,N,21,,145077,26796,WFP
22,,SING,CD2,HD2,no,N,22,,145077,26796,WFP
23,,SING,OXT,HXT,no,N,23,,145077,26796,WFP
1,,SING,N,CA,no,N,1,,145095,26797,DTR
2,,SING,N,H,no,N,2,,145095,26797,DTR
3,,SING,N,HN2,no,N,3,,145095,26797,DTR
4,,SING,CA,CB,no,N,4,,145095,26797,DTR
5,,SING,CA,C,no,N,5,,145095,26797,DTR
6,,SING,CA,HA,no,N,6,,145095,26797,DTR
7,,SING,CB,CG,no,N,7,,145095,26797,DTR
8,,SING,CB,HB2,no,N,8,,145095,26797,DTR
9,,SING,CB,HB3,no,N,9,,145095,26797,DTR
10,,DOUB,CG,CD1,yes,N,10,,145095,26797,DTR
11,,SING,CG,CD2,yes,N,11,,145095,26797,DTR
12,,SING,CD1,NE1,yes,N,12,,145095,26797,DTR
13,,SING,CD1,HD1,no,N,13,,145095,26797,DTR
14,,SING,NE1,CE2,yes,N,14,,145095,26797,DTR
15,,SING,NE1,HE1,no,N,15,,145095,26797,DTR
16,,DOUB,CE2,CZ2,yes,N,16,,145095,26797,DTR
17,,SING,CE2,CD2,yes,N,17,,145095,26797,DTR
18,,SING,CZ2,CH2,yes,N,18,,145095,26797,DTR
19,,SING,CZ2,HZ2,no,N,19,,145095,26797,DTR
20,,DOUB,CH2,CZ3,yes,N,20,,145095,26797,DTR
21,,SING,CH2,HH2,no,N,21,,145095,26797,DTR
22,,SING,CZ3,CE3,yes,N,22,,145095,26797,DTR
23,,SING,CZ3,HZ3,no,N,23,,145095,26797,DTR
24,,DOUB,CE3,CD2,yes,N,24,,145095,26797,DTR
25,,SING,CE3,HE3,no,N,25,,145095,26797,DTR
26,,DOUB,C,O,no,N,26,,145095,26797,DTR
27,,SING,C,OXT,no,N,27,,145095,26797,DTR
28,,SING,OXT,HXT,no,N,28,,145095,26797,DTR
1,,DOUB,C,O,no,N,1,,145096,26797,WFP
2,,SING,C,CA,no,N,2,,145096,26797,WFP
3,,SING,C,OXT,no,N,3,,145096,26797,WFP
4,,SING,N,CA,no,N,4,,145096,26797,WFP
5,,SING,F1,CE1,no,N,5,,145096,26797,WFP
6,,SING,F2,CE2,no,N,6,,145096,26797,WFP
7,,SING,CA,CB,no,N,7,,145096,26797,WFP
8,,SING,CB,CG,no,N,8,,145096,26797,WFP
9,,DOUB,CG,CD1,yes,N,9,,145096,26797,WFP
10,,SING,CG,CD2,yes,N,10,,145096,26797,WFP
11,,DOUB,CZ,CE1,yes,N,11,,145096,26797,WFP
12,,SING,CZ,CE2,yes,N,12,,145096,26797,WFP
13,,SING,CD1,CE1,yes,N,13,,145096,26797,WFP
14,,DOUB,CD2,CE2,yes,N,14,,145096,26797,WFP
15,,SING,N,H,no,N,15,,145096,26797,WFP
16,,SING,N,H2,no,N,16,,145096,26797,WFP
17,,SING,CA,HA,no,N,17,,145096,26797,WFP
18,,SING,CB,HB2,no,N,18,,145096,26797,WFP
19,,SING,CB,HB3,no,N,19,,145096,26797,WFP
20,,SING,CZ,HZ,no,N,20,,145096,26797,WFP
21,,SING,CD1,HD1,no,N,21,,145096,26797,WFP
22,,SING,CD2,HD2,no,N,22,,145096,26797,WFP
23,,SING,OXT,HXT,no,N,23,,145096,26797,WFP
1,,SING,N,CA,no,N,1,,145114,26798,DTR
2,,SING,N,H,no,N,2,,145114,26798,DTR
3,,SING,N,HN2,no,N,3,,145114,26798,DTR
4,,SING,CA,CB,no,N,4,,145114,26798,DTR
5,,SING,CA,C,no,N,5,,145114,26798,DTR
6,,SING,CA,HA,no,N,6,,145114,26798,DTR
7,,SING,CB,CG,no,N,7,,145114,26798,DTR
8,,SING,CB,HB2,no,N,8,,145114,26798,DTR
9,,SING,CB,HB3,no,N,9,,145114,26798,DTR
10,,DOUB,CG,CD1,yes,N,10,,145114,26798,DTR
11,,SING,CG,CD2,yes,N,11,,145114,26798,DTR
12,,SING,CD1,NE1,yes,N,12,,145114,26798,DTR
13,,SING,CD1,HD1,no,N,13,,145114,26798,DTR
14,,SING,NE1,CE2,yes,N,14,,145114,26798,DTR
15,,SING,NE1,HE1,no,N,15,,145114,26798,DTR
16,,DOUB,CE2,CZ2,yes,N,16,,145114,26798,DTR
17,,SING,CE2,CD2,yes,N,17,,145114,26798,DTR
18,,SING,CZ2,CH2,yes,N,18,,145114,26798,DTR
19,,SING,CZ2,HZ2,no,N,19,,145114,26798,DTR
20,,DOUB,CH2,CZ3,yes,N,20,,145114,26798,DTR
21,,SING,CH2,HH2,no,N,21,,145114,26798,DTR
22,,SING,CZ3,CE3,yes,N,22,,145114,26798,DTR
23,,SING,CZ3,HZ3,no,N,23,,145114,26798,DTR
24,,DOUB,CE3,CD2,yes,N,24,,145114,26798,DTR
25,,SING,CE3,HE3,no,N,25,,145114,26798,DTR
26,,DOUB,C,O,no,N,26,,145114,26798,DTR
27,,SING,C,OXT,no,N,27,,145114,26798,DTR
28,,SING,OXT,HXT,no,N,28,,145114,26798,DTR
1,,DOUB,C,O,no,N,1,,145115,26798,WFP
2,,SING,C,CA,no,N,2,,145115,26798,WFP
3,,SING,C,OXT,no,N,3,,145115,26798,WFP
4,,SING,N,CA,no,N,4,,145115,26798,WFP
5,,SING,F1,CE1,no,N,5,,145115,26798,WFP
6,,SING,F2,CE2,no,N,6,,145115,26798,WFP
7,,SING,CA,CB,no,N,7,,145115,26798,WFP
8,,SING,CB,CG,no,N,8,,145115,26798,WFP
9,,DOUB,CG,CD1,yes,N,9,,145115,26798,WFP
10,,SING,CG,CD2,yes,N,10,,145115,26798,WFP
11,,DOUB,CZ,CE1,yes,N,11,,145115,26798,WFP
12,,SING,CZ,CE2,yes,N,12,,145115,26798,WFP
13,,SING,CD1,CE1,yes,N,13,,145115,26798,WFP
14,,DOUB,CD2,CE2,yes,N,14,,145115,26798,WFP
15,,SING,N,H,no,N,15,,145115,26798,WFP
16,,SING,N,H2,no,N,16,,145115,26798,WFP
17,,SING,CA,HA,no,N,17,,145115,26798,WFP
18,,SING,CB,HB2,no,N,18,,145115,26798,WFP
19,,SING,CB,HB3,no,N,19,,145115,26798,WFP
20,,SING,CZ,HZ,no,N,20,,145115,26798,WFP
21,,SING,CD1,HD1,no,N,21,,145115,26798,WFP
22,,SING,CD2,HD2,no,N,22,,145115,26798,WFP
23,,SING,OXT,HXT,no,N,23,,145115,26798,WFP
1,,SING,N,CA,no,N,1,,145133,26799,DTR
2,,SING,N,H,no,N,2,,145133,26799,DTR
3,,SING,N,HN2,no,N,3,,145133,26799,DTR
4,,SING,CA,CB,no,N,4,,145133,26799,DTR
5,,SING,CA,C,no,N,5,,145133,26799,DTR
6,,SING,CA,HA,no,N,6,,145133,26799,DTR
7,,SING,CB,CG,no,N,7,,145133,26799,DTR
8,,SING,CB,HB2,no,N,8,,145133,26799,DTR
9,,SING,CB,HB3,no,N,9,,145133,26799,DTR
10,,DOUB,CG,CD1,yes,N,10,,145133,26799,DTR
11,,SING,CG,CD2,yes,N,11,,145133,26799,DTR
12,,SING,CD1,NE1,yes,N,12,,145133,26799,DTR
13,,SING,CD1,HD1,no,N,13,,145133,26799,DTR
14,,SING,NE1,CE2,yes,N,14,,145133,26799,DTR
15,,SING,NE1,HE1,no,N,15,,145133,26799,DTR
16,,DOUB,CE2,CZ2,yes,N,16,,145133,26799,DTR
17,,SING,CE2,CD2,yes,N,17,,145133,26799,DTR
18,,SING,CZ2,CH2,yes,N,18,,145133,26799,DTR
19,,SING,CZ2,HZ2,no,N,19,,145133,26799,DTR
20,,DOUB,CH2,CZ3,yes,N,20,,145133,26799,DTR
21,,SING,CH2,HH2,no,N,21,,145133,26799,DTR
22,,SING,CZ3,CE3,yes,N,22,,145133,26799,DTR
23,,SING,CZ3,HZ3,no,N,23,,145133,26799,DTR
24,,DOUB,CE3,CD2,yes,N,24,,145133,26799,DTR
25,,SING,CE3,HE3,no,N,25,,145133,26799,DTR
26,,DOUB,C,O,no,N,26,,145133,26799,DTR
27,,SING,C,OXT,no,N,27,,145133,26799,DTR
28,,SING,OXT,HXT,no,N,28,,145133,26799,DTR
1,,DOUB,C,O,no,N,1,,145134,26799,WFP
2,,SING,C,CA,no,N,2,,145134,26799,WFP
3,,SING,C,OXT,no,N,3,,145134,26799,WFP
4,,SING,N,CA,no,N,4,,145134,26799,WFP
5,,SING,F1,CE1,no,N,5,,145134,26799,WFP
6,,SING,F2,CE2,no,N,6,,145134,26799,WFP
7,,SING,CA,CB,no,N,7,,145134,26799,WFP
8,,SING,CB,CG,no,N,8,,145134,26799,WFP
9,,DOUB,CG,CD1,yes,N,9,,145134,26799,WFP
10,,SING,CG,CD2,yes,N,10,,145134,26799,WFP
11,,DOUB,CZ,CE1,yes,N,11,,145134,26799,WFP
12,,SING,CZ,CE2,yes,N,12,,145134,26799,WFP
13,,SING,CD1,CE1,yes,N,13,,145134,26799,WFP
14,,DOUB,CD2,CE2,yes,N,14,,145134,26799,WFP
15,,SING,N,H,no,N,15,,145134,26799,WFP
16,,SING,N,H2,no,N,16,,145134,26799,WFP
17,,SING,CA,HA,no,N,17,,145134,26799,WFP
18,,SING,CB,HB2,no,N,18,,145134,26799,WFP
19,,SING,CB,HB3,no,N,19,,145134,26799,WFP
20,,SING,CZ,HZ,no,N,20,,145134,26799,WFP
21,,SING,CD1,HD1,no,N,21,,145134,26799,WFP
22,,SING,CD2,HD2,no,N,22,,145134,26799,WFP
23,,SING,OXT,HXT,no,N,23,,145134,26799,WFP
1,,SING,C1,C2,no,N,1,,145366,26812,RET
2,,SING,C1,C6,no,N,2,,145366,26812,RET
3,,SING,C1,C16,no,N,3,,145366,26812,RET
4,,SING,C1,C17,no,N,4,,145366,26812,RET
5,,SING,C2,C3,no,N,5,,145366,26812,RET
6,,SING,C2,H21,no,N,6,,145366,26812,RET
7,,SING,C2,H22,no,N,7,,145366,26812,RET
8,,SING,C3,C4,no,N,8,,145366,26812,RET
9,,SING,C3,H31,no,N,9,,145366,26812,RET
10,,SING,C3,H32,no,N,10,,145366,26812,RET
11,,SING,C4,C5,no,N,11,,145366,26812,RET
12,,SING,C4,H41,no,N,12,,145366,26812,RET
13,,SING,C4,H42,no,N,13,,145366,26812,RET
14,,DOUB,C5,C6,no,N,14,,145366,26812,RET
15,,SING,C5,C18,no,N,15,,145366,26812,RET
16,,SING,C6,C7,no,N,16,,145366,26812,RET
17,,DOUB,C7,C8,no,E,17,,145366,26812,RET
18,,SING,C7,H7,no,N,18,,145366,26812,RET
19,,SING,C8,C9,no,N,19,,145366,26812,RET
20,,SING,C8,H8,no,N,20,,145366,26812,RET
21,,DOUB,C9,C10,no,E,21,,145366,26812,RET
22,,SING,C9,C19,no,N,22,,145366,26812,RET
23,,SING,C10,C11,no,N,23,,145366,26812,RET
24,,SING,C10,H10,no,N,24,,145366,26812,RET
25,,DOUB,C11,C12,no,E,25,,145366,26812,RET
26,,SING,C11,H11,no,N,26,,145366,26812,RET
27,,SING,C12,C13,no,N,27,,145366,26812,RET
28,,SING,C12,H12,no,N,28,,145366,26812,RET
29,,DOUB,C13,C14,no,E,29,,145366,26812,RET
30,,SING,C13,C20,no,N,30,,145366,26812,RET
31,,SING,C14,C15,no,N,31,,145366,26812,RET
32,,SING,C14,H14,no,N,32,,145366,26812,RET
33,,DOUB,C15,O1,no,N,33,,145366,26812,RET
34,,SING,C15,H15,no,N,34,,145366,26812,RET
35,,SING,C16,H161,no,N,35,,145366,26812,RET
36,,SING,C16,H162,no,N,36,,145366,26812,RET
37,,SING,C16,H163,no,N,37,,145366,26812,RET
38,,SING,C17,H171,no,N,38,,145366,26812,RET
39,,SING,C17,H172,no,N,39,,145366,26812,RET
40,,SING,C17,H173,no,N,40,,145366,26812,RET
41,,SING,C18,H181,no,N,41,,145366,26812,RET
42,,SING,C18,H182,no,N,42,,145366,26812,RET
43,,SING,C18,H183,no,N,43,,145366,26812,RET
44,,SING,C19,H191,no,N,44,,145366,26812,RET
45,,SING,C19,H192,no,N,45,,145366,26812,RET
46,,SING,C19,H193,no,N,46,,145366,26812,RET
47,,SING,C20,H201,no,N,47,,145366,26812,RET
48,,SING,C20,H202,no,N,48,,145366,26812,RET
49,,SING,C20,H203,no,N,49,,145366,26812,RET
1,,SING,C1,C2,no,N,1,,145382,26813,RET
2,,SING,C1,C6,no,N,2,,145382,26813,RET
3,,SING,C1,C16,no,N,3,,145382,26813,RET
4,,SING,C1,C17,no,N,4,,145382,26813,RET
5,,SING,C2,C3,no,N,5,,145382,26813,RET
6,,SING,C2,H21,no,N,6,,145382,26813,RET
7,,SING,C2,H22,no,N,7,,145382,26813,RET
8,,SING,C3,C4,no,N,8,,145382,26813,RET
9,,SING,C3,H31,no,N,9,,145382,26813,RET
10,,SING,C3,H32,no,N,10,,145382,26813,RET
11,,SING,C4,C5,no,N,11,,145382,26813,RET
12,,SING,C4,H41,no,N,12,,145382,26813,RET
13,,SING,C4,H42,no,N,13,,145382,26813,RET
14,,DOUB,C5,C6,no,N,14,,145382,26813,RET
15,,SING,C5,C18,no,N,15,,145382,26813,RET
16,,SING,C6,C7,no,N,16,,145382,26813,RET
17,,DOUB,C7,C8,no,E,17,,145382,26813,RET
18,,SING,C7,H7,no,N,18,,145382,26813,RET
19,,SING,C8,C9,no,N,19,,145382,26813,RET
20,,SING,C8,H8,no,N,20,,145382,26813,RET
21,,DOUB,C9,C10,no,E,21,,145382,26813,RET
22,,SING,C9,C19,no,N,22,,145382,26813,RET
23,,SING,C10,C11,no,N,23,,145382,26813,RET
24,,SING,C10,H10,no,N,24,,145382,26813,RET
25,,DOUB,C11,C12,no,E,25,,145382,26813,RET
26,,SING,C11,H11,no,N,26,,145382,26813,RET
27,,SING,C12,C13,no,N,27,,145382,26813,RET
28,,SING,C12,H12,no,N,28,,145382,26813,RET
29,,DOUB,C13,C14,no,E,29,,145382,26813,RET
30,,SING,C13,C20,no,N,30,,145382,26813,RET
31,,SING,C14,C15,no,N,31,,145382,26813,RET
32,,SING,C14,H14,no,N,32,,145382,26813,RET
33,,DOUB,C15,O1,no,N,33,,145382,26813,RET
34,,SING,C15,H15,no,N,34,,145382,26813,RET
35,,SING,C16,H161,no,N,35,,145382,26813,RET
36,,SING,C16,H162,no,N,36,,145382,26813,RET
37,,SING,C16,H163,no,N,37,,145382,26813,RET
38,,SING,C17,H171,no,N,38,,145382,26813,RET
39,,SING,C17,H172,no,N,39,,145382,26813,RET
40,,SING,C17,H173,no,N,40,,145382,26813,RET
41,,SING,C18,H181,no,N,41,,145382,26813,RET
42,,SING,C18,H182,no,N,42,,145382,26813,RET
43,,SING,C18,H183,no,N,43,,145382,26813,RET
44,,SING,C19,H191,no,N,44,,145382,26813,RET
45,,SING,C19,H192,no,N,45,,145382,26813,RET
46,,SING,C19,H193,no,N,46,,145382,26813,RET
47,,SING,C20,H201,no,N,47,,145382,26813,RET
48,,SING,C20,H202,no,N,48,,145382,26813,RET
49,,SING,C20,H203,no,N,49,,145382,26813,RET
1,,DOUB,PB,O1B,no,N,1,,145418,26815,ADP
2,,SING,PB,O2B,no,N,2,,145418,26815,ADP
3,,SING,PB,O3B,no,N,3,,145418,26815,ADP
4,,SING,PB,O3A,no,N,4,,145418,26815,ADP
5,,SING,O2B,HOB2,no,N,5,,145418,26815,ADP
6,,SING,O3B,HOB3,no,N,6,,145418,26815,ADP
7,,DOUB,PA,O1A,no,N,7,,145418,26815,ADP
8,,SING,PA,O2A,no,N,8,,145418,26815,ADP
9,,SING,PA,O3A,no,N,9,,145418,26815,ADP
10,,SING,PA,O5',no,N,10,,145418,26815,ADP
11,,SING,O2A,HOA2,no,N,11,,145418,26815,ADP
12,,SING,O5',C5',no,N,12,,145418,26815,ADP
13,,SING,C5',C4',no,N,13,,145418,26815,ADP
14,,SING,C5',H5'1,no,N,14,,145418,26815,ADP
15,,SING,C5',H5'2,no,N,15,,145418,26815,ADP
16,,SING,C4',O4',no,N,16,,145418,26815,ADP
17,,SING,C4',C3',no,N,17,,145418,26815,ADP
18,,SING,C4',H4',no,N,18,,145418,26815,ADP
19,,SING,O4',C1',no,N,19,,145418,26815,ADP
20,,SING,C3',O3',no,N,20,,145418,26815,ADP
21,,SING,C3',C2',no,N,21,,145418,26815,ADP
22,,SING,C3',H3',no,N,22,,145418,26815,ADP
23,,SING,O3',HO3',no,N,23,,145418,26815,ADP
24,,SING,C2',O2',no,N,24,,145418,26815,ADP
25,,SING,C2',C1',no,N,25,,145418,26815,ADP
26,,SING,C2',H2',no,N,26,,145418,26815,ADP
27,,SING,O2',HO2',no,N,27,,145418,26815,ADP
28,,SING,C1',N9,no,N,28,,145418,26815,ADP
29,,SING,C1',H1',no,N,29,,145418,26815,ADP
30,,SING,N9,C8,yes,N,30,,145418,26815,ADP
31,,SING,N9,C4,yes,N,31,,145418,26815,ADP
32,,DOUB,C8,N7,yes,N,32,,145418,26815,ADP
33,,SING,C8,H8,no,N,33,,145418,26815,ADP
34,,SING,N7,C5,yes,N,34,,145418,26815,ADP
35,,SING,C5,C6,yes,N,35,,145418,26815,ADP
36,,DOUB,C5,C4,yes,N,36,,145418,26815,ADP
37,,SING,C6,N6,no,N,37,,145418,26815,ADP
38,,DOUB,C6,N1,yes,N,38,,145418,26815,ADP
39,,SING,N6,HN61,no,N,39,,145418,26815,ADP
40,,SING,N6,HN62,no,N,40,,145418,26815,ADP
41,,SING,N1,C2,yes,N,41,,145418,26815,ADP
42,,DOUB,C2,N3,yes,N,42,,145418,26815,ADP
43,,SING,C2,H2,no,N,43,,145418,26815,ADP
44,,SING,N3,C4,yes,N,44,,145418,26815,ADP
1,,SING,N1,C2,no,N,1,,145801,26838,OTA
2,,SING,N1,C6,no,N,2,,145801,26838,OTA
3,,SING,N1,H1,no,N,3,,145801,26838,OTA
4,,SING,C2,C3,no,N,4,,145801,26838,OTA
5,,SING,C2,H21,no,N,5,,145801,26838,OTA
6,,SING,C2,H22A,no,N,6,,145801,26838,OTA
7,,DOUB,C3,C4,yes,N,7,,145801,26838,OTA
8,,SING,C3,S13,yes,N,8,,145801,26838,OTA
9,,SING,C4,C5,no,N,9,,145801,26838,OTA
10,,SING,C4,C15,yes,N,10,,145801,26838,OTA
11,,SING,C5,C6,no,N,11,,145801,26838,OTA
12,,SING,C5,H51,no,N,12,,145801,26838,OTA
13,,SING,C5,H52,no,N,13,,145801,26838,OTA
14,,SING,C6,H61,no,N,14,,145801,26838,OTA
15,,SING,C6,H62,no,N,15,,145801,26838,OTA
16,,SING,S13,C14,yes,N,16,,145801,26838,OTA
17,,DOUB,C14,C15,yes,N,17,,145801,26838,OTA
18,,SING,C14,N19,no,N,18,,145801,26838,OTA
19,,SING,C15,C16,no,N,19,,145801,26838,OTA
20,,SING,C16,O17,no,N,20,,145801,26838,OTA
21,,DOUB,C16,O18,no,N,21,,145801,26838,OTA
22,,SING,O17,H17,no,N,22,,145801,26838,OTA
23,,SING,N19,C20,no,N,23,,145801,26838,OTA
24,,SING,N19,H19,no,N,24,,145801,26838,OTA
25,,SING,C20,C21,no,N,25,,145801,26838,OTA
26,,DOUB,C20,O24,no,N,26,,145801,26838,OTA
27,,SING,C21,O22,no,N,27,,145801,26838,OTA
28,,DOUB,C21,O23,no,N,28,,145801,26838,OTA
29,,SING,O22,H22,no,N,29,,145801,26838,OTA
1,,SING,N1,C2,no,N,1,,145969,26847,OTA
2,,SING,N1,C6,no,N,2,,145969,26847,OTA
3,,SING,N1,H1,no,N,3,,145969,26847,OTA
4,,SING,C2,C3,no,N,4,,145969,26847,OTA
5,,SING,C2,H21,no,N,5,,145969,26847,OTA
6,,SING,C2,H22A,no,N,6,,145969,26847,OTA
7,,DOUB,C3,C4,yes,N,7,,145969,26847,OTA
8,,SING,C3,S13,yes,N,8,,145969,26847,OTA
9,,SING,C4,C5,no,N,9,,145969,26847,OTA
10,,SING,C4,C15,yes,N,10,,145969,26847,OTA
11,,SING,C5,C6,no,N,11,,145969,26847,OTA
12,,SING,C5,H51,no,N,12,,145969,26847,OTA
13,,SING,C5,H52,no,N,13,,145969,26847,OTA
14,,SING,C6,H61,no,N,14,,145969,26847,OTA
15,,SING,C6,H62,no,N,15,,145969,26847,OTA
16,,SING,S13,C14,yes,N,16,,145969,26847,OTA
17,,DOUB,C14,C15,yes,N,17,,145969,26847,OTA
18,,SING,C14,N19,no,N,18,,145969,26847,OTA
19,,SING,C15,C16,no,N,19,,145969,26847,OTA
20,,SING,C16,O17,no,N,20,,145969,26847,OTA
21,,DOUB,C16,O18,no,N,21,,145969,26847,OTA
22,,SING,O17,H17,no,N,22,,145969,26847,OTA
23,,SING,N19,C20,no,N,23,,145969,26847,OTA
24,,SING,N19,H19,no,N,24,,145969,26847,OTA
25,,SING,C20,C21,no,N,25,,145969,26847,OTA
26,,DOUB,C20,O24,no,N,26,,145969,26847,OTA
27,,SING,C21,O22,no,N,27,,145969,26847,OTA
28,,DOUB,C21,O23,no,N,28,,145969,26847,OTA
29,,SING,O22,H22,no,N,29,,145969,26847,OTA
1,,SING,N,CA,no,N,1,,145990,26848,SAM
2,,SING,N,HN1,no,N,2,,145990,26848,SAM
3,,SING,N,HN2,no,N,3,,145990,26848,SAM
4,,SING,CA,C,no,N,4,,145990,26848,SAM
5,,SING,CA,CB,no,N,5,,145990,26848,SAM
6,,SING,CA,HA,no,N,6,,145990,26848,SAM
7,,DOUB,C,O,no,N,7,,145990,26848,SAM
8,,SING,C,OXT,no,N,8,,145990,26848,SAM
9,,SING,CB,CG,no,N,9,,145990,26848,SAM
10,,SING,CB,HB1,no,N,10,,145990,26848,SAM
11,,SING,CB,HB2,no,N,11,,145990,26848,SAM
12,,SING,CG,SD,no,N,12,,145990,26848,SAM
13,,SING,CG,HG1,no,N,13,,145990,26848,SAM
14,,SING,CG,HG2,no,N,14,,145990,26848,SAM
15,,SING,SD,CE,no,N,15,,145990,26848,SAM
16,,SING,SD,C5',no,N,16,,145990,26848,SAM
17,,SING,CE,HE1,no,N,17,,145990,26848,SAM
7,,SING,CB,CG,,,,,240396,6146,MLN_2
18,,SING,CE,HE2,no,N,18,,145990,26848,SAM
19,,SING,CE,HE3,no,N,19,,145990,26848,SAM
20,,SING,C5',C4',no,N,20,,145990,26848,SAM
21,,SING,C5',H5'1,no,N,21,,145990,26848,SAM
22,,SING,C5',H5'2,no,N,22,,145990,26848,SAM
23,,SING,C4',O4',no,N,23,,145990,26848,SAM
24,,SING,C4',C3',no,N,24,,145990,26848,SAM
25,,SING,C4',H4',no,N,25,,145990,26848,SAM
26,,SING,O4',C1',no,N,26,,145990,26848,SAM
27,,SING,C3',O3',no,N,27,,145990,26848,SAM
28,,SING,C3',C2',no,N,28,,145990,26848,SAM
29,,SING,C3',H3',no,N,29,,145990,26848,SAM
30,,SING,O3',HO3',no,N,30,,145990,26848,SAM
31,,SING,C2',O2',no,N,31,,145990,26848,SAM
32,,SING,C2',C1',no,N,32,,145990,26848,SAM
33,,SING,C2',H2',no,N,33,,145990,26848,SAM
34,,SING,O2',HO2',no,N,34,,145990,26848,SAM
35,,SING,C1',N9,no,N,35,,145990,26848,SAM
36,,SING,C1',H1',no,N,36,,145990,26848,SAM
37,,SING,N9,C8,yes,N,37,,145990,26848,SAM
38,,SING,N9,C4,yes,N,38,,145990,26848,SAM
39,,DOUB,C8,N7,yes,N,39,,145990,26848,SAM
40,,SING,C8,H8,no,N,40,,145990,26848,SAM
41,,SING,N7,C5,yes,N,41,,145990,26848,SAM
42,,SING,C5,C6,yes,N,42,,145990,26848,SAM
43,,DOUB,C5,C4,yes,N,43,,145990,26848,SAM
44,,SING,C6,N6,no,N,44,,145990,26848,SAM
45,,DOUB,C6,N1,yes,N,45,,145990,26848,SAM
46,,SING,N6,HN61,no,N,46,,145990,26848,SAM
47,,SING,N6,HN62,no,N,47,,145990,26848,SAM
48,,SING,N1,C2,yes,N,48,,145990,26848,SAM
49,,DOUB,C2,N3,yes,N,49,,145990,26848,SAM
50,,SING,C2,H2,no,N,50,,145990,26848,SAM
51,,SING,N3,C4,yes,N,51,,145990,26848,SAM
1,,SING,C1,O1,no,N,1,,145991,26848,DNC
2,,DOUB,C1,C2,yes,N,2,,145991,26848,DNC
3,,SING,C1,C6,yes,N,3,,145991,26848,DNC
4,,SING,O1,HO1,no,N,4,,145991,26848,DNC
5,,SING,C2,O2,no,N,5,,145991,26848,DNC
6,,SING,C2,C3,yes,N,6,,145991,26848,DNC
7,,SING,O2,HO2,no,N,7,,145991,26848,DNC
8,,SING,C3,N1,no,N,8,,145991,26848,DNC
9,,DOUB,C3,C4,yes,N,9,,145991,26848,DNC
10,,SING,N1,O3,no,N,10,,145991,26848,DNC
11,,DOUB,N1,O4,no,N,11,,145991,26848,DNC
12,,SING,C4,C5,yes,N,12,,145991,26848,DNC
13,,SING,C4,H4,no,N,13,,145991,26848,DNC
14,,SING,C5,N2,no,N,14,,145991,26848,DNC
15,,DOUB,C5,C6,yes,N,15,,145991,26848,DNC
16,,SING,N2,O5,no,N,16,,145991,26848,DNC
17,,DOUB,N2,O6,no,N,17,,145991,26848,DNC
18,,SING,C6,H6,no,N,18,,145991,26848,DNC
1,,SING,N,CA,no,N,1,,146044,26851,SFG
2,,SING,N,HN1,no,N,2,,146044,26851,SFG
3,,SING,N,HN2,no,N,3,,146044,26851,SFG
4,,SING,CA,C,no,N,4,,146044,26851,SFG
5,,SING,CA,CB,no,N,5,,146044,26851,SFG
6,,SING,CA,HA,no,N,6,,146044,26851,SFG
7,,DOUB,C,O,no,N,7,,146044,26851,SFG
8,,SING,C,OXT,no,N,8,,146044,26851,SFG
9,,SING,OXT,HXT,no,N,9,,146044,26851,SFG
10,,SING,CB,CG,no,N,10,,146044,26851,SFG
11,,SING,CB,HB1,no,N,11,,146044,26851,SFG
12,,SING,CB,HB2,no,N,12,,146044,26851,SFG
13,,SING,CG,CD,no,N,13,,146044,26851,SFG
14,,SING,CG,HG1,no,N,14,,146044,26851,SFG
15,,SING,CG,HG2,no,N,15,,146044,26851,SFG
16,,SING,CD,NE,no,N,16,,146044,26851,SFG
17,,SING,CD,C5',no,N,17,,146044,26851,SFG
18,,SING,CD,HD,no,N,18,,146044,26851,SFG
19,,SING,NE,HNE1,no,N,19,,146044,26851,SFG
20,,SING,NE,HNE2,no,N,20,,146044,26851,SFG
21,,SING,C5',C4',no,N,21,,146044,26851,SFG
22,,SING,C5',H5'1,no,N,22,,146044,26851,SFG
23,,SING,C5',H5'2,no,N,23,,146044,26851,SFG
24,,SING,C4',O4',no,N,24,,146044,26851,SFG
25,,SING,C4',C3',no,N,25,,146044,26851,SFG
26,,SING,C4',H4',no,N,26,,146044,26851,SFG
27,,SING,O4',C1',no,N,27,,146044,26851,SFG
28,,SING,C3',O3',no,N,28,,146044,26851,SFG
29,,SING,C3',C2',no,N,29,,146044,26851,SFG
30,,SING,C3',H3',no,N,30,,146044,26851,SFG
31,,SING,O3',HO3',no,N,31,,146044,26851,SFG
32,,SING,C2',O2',no,N,32,,146044,26851,SFG
33,,SING,C2',C1',no,N,33,,146044,26851,SFG
34,,SING,C2',H2',no,N,34,,146044,26851,SFG
35,,SING,O2',HO2',no,N,35,,146044,26851,SFG
36,,SING,C1',N9,no,N,36,,146044,26851,SFG
37,,SING,C1',H1',no,N,37,,146044,26851,SFG
38,,SING,N9,C8,yes,N,38,,146044,26851,SFG
39,,SING,N9,C4,yes,N,39,,146044,26851,SFG
40,,DOUB,C8,N7,yes,N,40,,146044,26851,SFG
41,,SING,C8,H8,no,N,41,,146044,26851,SFG
42,,SING,N7,C5,yes,N,42,,146044,26851,SFG
43,,SING,C5,C6,yes,N,43,,146044,26851,SFG
44,,DOUB,C5,C4,yes,N,44,,146044,26851,SFG
45,,SING,C6,N6,no,N,45,,146044,26851,SFG
46,,DOUB,C6,N1,yes,N,46,,146044,26851,SFG
47,,SING,N6,HN61,no,N,47,,146044,26851,SFG
48,,SING,N6,HN62,no,N,48,,146044,26851,SFG
49,,SING,N1,C2,yes,N,49,,146044,26851,SFG
50,,DOUB,C2,N3,yes,N,50,,146044,26851,SFG
51,,SING,C2,H2,no,N,51,,146044,26851,SFG
52,,SING,N3,C4,yes,N,52,,146044,26851,SFG
1,,SING,C1,O1,no,N,1,,146045,26851,DNC
2,,DOUB,C1,C2,yes,N,2,,146045,26851,DNC
3,,SING,C1,C6,yes,N,3,,146045,26851,DNC
4,,SING,O1,HO1,no,N,4,,146045,26851,DNC
5,,SING,C2,O2,no,N,5,,146045,26851,DNC
6,,SING,C2,C3,yes,N,6,,146045,26851,DNC
7,,SING,O2,HO2,no,N,7,,146045,26851,DNC
8,,SING,C3,N1,no,N,8,,146045,26851,DNC
9,,DOUB,C3,C4,yes,N,9,,146045,26851,DNC
10,,SING,N1,O3,no,N,10,,146045,26851,DNC
11,,DOUB,N1,O4,no,N,11,,146045,26851,DNC
12,,SING,C4,C5,yes,N,12,,146045,26851,DNC
13,,SING,C4,H4,no,N,13,,146045,26851,DNC
14,,SING,C5,N2,no,N,14,,146045,26851,DNC
15,,DOUB,C5,C6,yes,N,15,,146045,26851,DNC
16,,SING,N2,O5,no,N,16,,146045,26851,DNC
17,,DOUB,N2,O6,no,N,17,,146045,26851,DNC
18,,SING,C6,H6,no,N,18,,146045,26851,DNC
1,,SING,N1,C2,no,N,1,,146093,26854,FMN
2,,DOUB,N1,C10,no,N,2,,146093,26854,FMN
3,,DOUB,C2,O2,no,N,3,,146093,26854,FMN
4,,SING,C2,N3,no,N,4,,146093,26854,FMN
5,,SING,N3,C4,no,N,5,,146093,26854,FMN
6,,SING,N3,HN3,no,N,6,,146093,26854,FMN
7,,DOUB,C4,O4,no,N,7,,146093,26854,FMN
8,,SING,C4,C4A,no,N,8,,146093,26854,FMN
9,,DOUB,C4A,N5,no,N,9,,146093,26854,FMN
10,,SING,C4A,C10,no,N,10,,146093,26854,FMN
11,,SING,N5,C5A,no,N,11,,146093,26854,FMN
12,,DOUB,C5A,C6,yes,N,12,,146093,26854,FMN
13,,SING,C5A,C9A,yes,N,13,,146093,26854,FMN
14,,SING,C6,C7,yes,N,14,,146093,26854,FMN
15,,SING,C6,H6,no,N,15,,146093,26854,FMN
16,,SING,C7,C7M,no,N,16,,146093,26854,FMN
17,,DOUB,C7,C8,yes,N,17,,146093,26854,FMN
18,,SING,C7M,HM71,no,N,18,,146093,26854,FMN
19,,SING,C7M,HM72,no,N,19,,146093,26854,FMN
20,,SING,C7M,HM73,no,N,20,,146093,26854,FMN
21,,SING,C8,C8M,no,N,21,,146093,26854,FMN
22,,SING,C8,C9,yes,N,22,,146093,26854,FMN
23,,SING,C8M,HM81,no,N,23,,146093,26854,FMN
24,,SING,C8M,HM82,no,N,24,,146093,26854,FMN
25,,SING,C8M,HM83,no,N,25,,146093,26854,FMN
26,,DOUB,C9,C9A,yes,N,26,,146093,26854,FMN
27,,SING,C9,H9,no,N,27,,146093,26854,FMN
28,,SING,C9A,N10,no,N,28,,146093,26854,FMN
29,,SING,N10,C10,no,N,29,,146093,26854,FMN
30,,SING,N10,C1',no,N,30,,146093,26854,FMN
31,,SING,C1',C2',no,N,31,,146093,26854,FMN
32,,SING,C1',H1'1,no,N,32,,146093,26854,FMN
33,,SING,C1',H1'2,no,N,33,,146093,26854,FMN
34,,SING,C2',O2',no,N,34,,146093,26854,FMN
35,,SING,C2',C3',no,N,35,,146093,26854,FMN
36,,SING,C2',H2',no,N,36,,146093,26854,FMN
37,,SING,O2',HO2',no,N,37,,146093,26854,FMN
38,,SING,C3',O3',no,N,38,,146093,26854,FMN
39,,SING,C3',C4',no,N,39,,146093,26854,FMN
40,,SING,C3',H3',no,N,40,,146093,26854,FMN
41,,SING,O3',HO3',no,N,41,,146093,26854,FMN
42,,SING,C4',O4',no,N,42,,146093,26854,FMN
43,,SING,C4',C5',no,N,43,,146093,26854,FMN
44,,SING,C4',H4',no,N,44,,146093,26854,FMN
45,,SING,O4',HO4',no,N,45,,146093,26854,FMN
46,,SING,C5',O5',no,N,46,,146093,26854,FMN
47,,SING,C5',H5'1,no,N,47,,146093,26854,FMN
48,,SING,C5',H5'2,no,N,48,,146093,26854,FMN
49,,SING,O5',P,no,N,49,,146093,26854,FMN
50,,DOUB,P,O1P,no,N,50,,146093,26854,FMN
51,,SING,P,O2P,no,N,51,,146093,26854,FMN
52,,SING,P,O3P,no,N,52,,146093,26854,FMN
53,,SING,O2P,HOP2,no,N,53,,146093,26854,FMN
54,,SING,O3P,HOP3,no,N,54,,146093,26854,FMN
1,,SING,CHA,C1A,no,N,1,,146506,26885,HEM
2,,DOUB,CHA,C4D,no,N,2,,146506,26885,HEM
3,,SING,CHA,HHA,no,N,3,,146506,26885,HEM
4,,SING,CHB,C4A,no,N,4,,146506,26885,HEM
5,,DOUB,CHB,C1B,no,N,5,,146506,26885,HEM
6,,SING,CHB,HHB,no,N,6,,146506,26885,HEM
7,,SING,CHC,C4B,no,N,7,,146506,26885,HEM
8,,DOUB,CHC,C1C,no,N,8,,146506,26885,HEM
9,,SING,CHC,HHC,no,N,9,,146506,26885,HEM
10,,DOUB,CHD,C4C,no,N,10,,146506,26885,HEM
11,,SING,CHD,C1D,no,N,11,,146506,26885,HEM
12,,SING,CHD,HHD,no,N,12,,146506,26885,HEM
13,,DOUB,C1A,C2A,yes,N,13,,146506,26885,HEM
14,,SING,C1A,NA,yes,N,14,,146506,26885,HEM
15,,SING,C2A,C3A,yes,N,15,,146506,26885,HEM
16,,SING,C2A,CAA,no,N,16,,146506,26885,HEM
17,,DOUB,C3A,C4A,yes,N,17,,146506,26885,HEM
18,,SING,C3A,CMA,no,N,18,,146506,26885,HEM
19,,SING,C4A,NA,yes,N,19,,146506,26885,HEM
20,,SING,CMA,HMA,no,N,20,,146506,26885,HEM
21,,SING,CMA,HMAA,no,N,21,,146506,26885,HEM
22,,SING,CMA,HMAB,no,N,22,,146506,26885,HEM
23,,SING,CAA,CBA,no,N,23,,146506,26885,HEM
24,,SING,CAA,HAA,no,N,24,,146506,26885,HEM
25,,SING,CAA,HAAA,no,N,25,,146506,26885,HEM
26,,SING,CBA,CGA,no,N,26,,146506,26885,HEM
27,,SING,CBA,HBA,no,N,27,,146506,26885,HEM
28,,SING,CBA,HBAA,no,N,28,,146506,26885,HEM
8,,SING,CG,HG1,,,,,240396,6146,MLN_2
29,,DOUB,CGA,O1A,no,N,29,,146506,26885,HEM
30,,SING,CGA,O2A,no,N,30,,146506,26885,HEM
31,,SING,C1B,C2B,no,N,31,,146506,26885,HEM
32,,SING,C1B,NB,no,N,32,,146506,26885,HEM
33,,DOUB,C2B,C3B,no,N,33,,146506,26885,HEM
34,,SING,C2B,CMB,no,N,34,,146506,26885,HEM
35,,SING,C3B,C4B,no,N,35,,146506,26885,HEM
36,,SING,C3B,CAB,no,N,36,,146506,26885,HEM
37,,DOUB,C4B,NB,no,N,37,,146506,26885,HEM
38,,SING,CMB,HMB,no,N,38,,146506,26885,HEM
39,,SING,CMB,HMBA,no,N,39,,146506,26885,HEM
40,,SING,CMB,HMBB,no,N,40,,146506,26885,HEM
41,,DOUB,CAB,CBB,no,N,41,,146506,26885,HEM
42,,SING,CAB,HAB,no,N,42,,146506,26885,HEM
43,,SING,CBB,HBB,no,N,43,,146506,26885,HEM
44,,SING,CBB,HBBA,no,N,44,,146506,26885,HEM
45,,SING,C1C,C2C,yes,N,45,,146506,26885,HEM
46,,SING,C1C,NC,yes,N,46,,146506,26885,HEM
47,,DOUB,C2C,C3C,yes,N,47,,146506,26885,HEM
48,,SING,C2C,CMC,no,N,48,,146506,26885,HEM
49,,SING,C3C,C4C,yes,N,49,,146506,26885,HEM
50,,SING,C3C,CAC,no,N,50,,146506,26885,HEM
51,,SING,C4C,NC,yes,N,51,,146506,26885,HEM
52,,SING,CMC,HMC,no,N,52,,146506,26885,HEM
53,,SING,CMC,HMCA,no,N,53,,146506,26885,HEM
54,,SING,CMC,HMCB,no,N,54,,146506,26885,HEM
55,,DOUB,CAC,CBC,no,N,55,,146506,26885,HEM
56,,SING,CAC,HAC,no,N,56,,146506,26885,HEM
57,,SING,CBC,HBC,no,N,57,,146506,26885,HEM
58,,SING,CBC,HBCA,no,N,58,,146506,26885,HEM
59,,SING,C1D,C2D,no,N,59,,146506,26885,HEM
60,,DOUB,C1D,ND,no,N,60,,146506,26885,HEM
61,,DOUB,C2D,C3D,no,N,61,,146506,26885,HEM
62,,SING,C2D,CMD,no,N,62,,146506,26885,HEM
63,,SING,C3D,C4D,no,N,63,,146506,26885,HEM
64,,SING,C3D,CAD,no,N,64,,146506,26885,HEM
65,,SING,C4D,ND,no,N,65,,146506,26885,HEM
66,,SING,CMD,HMD,no,N,66,,146506,26885,HEM
67,,SING,CMD,HMDA,no,N,67,,146506,26885,HEM
68,,SING,CMD,HMDB,no,N,68,,146506,26885,HEM
69,,SING,CAD,CBD,no,N,69,,146506,26885,HEM
70,,SING,CAD,HAD,no,N,70,,146506,26885,HEM
71,,SING,CAD,HADA,no,N,71,,146506,26885,HEM
72,,SING,CBD,CGD,no,N,72,,146506,26885,HEM
73,,SING,CBD,HBD,no,N,73,,146506,26885,HEM
74,,SING,CBD,HBDA,no,N,74,,146506,26885,HEM
75,,DOUB,CGD,O1D,no,N,75,,146506,26885,HEM
76,,SING,CGD,O2D,no,N,76,,146506,26885,HEM
77,,SING,O2A,H2A,no,N,77,,146506,26885,HEM
78,,SING,O2D,H2D,no,N,78,,146506,26885,HEM
79,,SING,FE,NA,no,N,79,,146506,26885,HEM
80,,SING,FE,NB,no,N,80,,146506,26885,HEM
81,,SING,FE,NC,no,N,81,,146506,26885,HEM
82,,SING,FE,ND,no,N,82,,146506,26885,HEM
1,,SING,CHA,C1A,no,N,1,,146522,26886,HEM
2,,DOUB,CHA,C4D,no,N,2,,146522,26886,HEM
3,,SING,CHA,HHA,no,N,3,,146522,26886,HEM
4,,SING,CHB,C4A,no,N,4,,146522,26886,HEM
5,,DOUB,CHB,C1B,no,N,5,,146522,26886,HEM
6,,SING,CHB,HHB,no,N,6,,146522,26886,HEM
7,,SING,CHC,C4B,no,N,7,,146522,26886,HEM
8,,DOUB,CHC,C1C,no,N,8,,146522,26886,HEM
9,,SING,CHC,HHC,no,N,9,,146522,26886,HEM
10,,DOUB,CHD,C4C,no,N,10,,146522,26886,HEM
11,,SING,CHD,C1D,no,N,11,,146522,26886,HEM
12,,SING,CHD,HHD,no,N,12,,146522,26886,HEM
13,,DOUB,C1A,C2A,yes,N,13,,146522,26886,HEM
14,,SING,C1A,NA,yes,N,14,,146522,26886,HEM
15,,SING,C2A,C3A,yes,N,15,,146522,26886,HEM
16,,SING,C2A,CAA,no,N,16,,146522,26886,HEM
17,,DOUB,C3A,C4A,yes,N,17,,146522,26886,HEM
18,,SING,C3A,CMA,no,N,18,,146522,26886,HEM
19,,SING,C4A,NA,yes,N,19,,146522,26886,HEM
20,,SING,CMA,HMA,no,N,20,,146522,26886,HEM
21,,SING,CMA,HMAA,no,N,21,,146522,26886,HEM
22,,SING,CMA,HMAB,no,N,22,,146522,26886,HEM
23,,SING,CAA,CBA,no,N,23,,146522,26886,HEM
24,,SING,CAA,HAA,no,N,24,,146522,26886,HEM
25,,SING,CAA,HAAA,no,N,25,,146522,26886,HEM
26,,SING,CBA,CGA,no,N,26,,146522,26886,HEM
27,,SING,CBA,HBA,no,N,27,,146522,26886,HEM
28,,SING,CBA,HBAA,no,N,28,,146522,26886,HEM
29,,DOUB,CGA,O1A,no,N,29,,146522,26886,HEM
30,,SING,CGA,O2A,no,N,30,,146522,26886,HEM
31,,SING,C1B,C2B,no,N,31,,146522,26886,HEM
32,,SING,C1B,NB,no,N,32,,146522,26886,HEM
33,,DOUB,C2B,C3B,no,N,33,,146522,26886,HEM
34,,SING,C2B,CMB,no,N,34,,146522,26886,HEM
35,,SING,C3B,C4B,no,N,35,,146522,26886,HEM
36,,SING,C3B,CAB,no,N,36,,146522,26886,HEM
37,,DOUB,C4B,NB,no,N,37,,146522,26886,HEM
38,,SING,CMB,HMB,no,N,38,,146522,26886,HEM
39,,SING,CMB,HMBA,no,N,39,,146522,26886,HEM
40,,SING,CMB,HMBB,no,N,40,,146522,26886,HEM
41,,DOUB,CAB,CBB,no,N,41,,146522,26886,HEM
42,,SING,CAB,HAB,no,N,42,,146522,26886,HEM
43,,SING,CBB,HBB,no,N,43,,146522,26886,HEM
44,,SING,CBB,HBBA,no,N,44,,146522,26886,HEM
45,,SING,C1C,C2C,yes,N,45,,146522,26886,HEM
46,,SING,C1C,NC,yes,N,46,,146522,26886,HEM
47,,DOUB,C2C,C3C,yes,N,47,,146522,26886,HEM
48,,SING,C2C,CMC,no,N,48,,146522,26886,HEM
49,,SING,C3C,C4C,yes,N,49,,146522,26886,HEM
50,,SING,C3C,CAC,no,N,50,,146522,26886,HEM
51,,SING,C4C,NC,yes,N,51,,146522,26886,HEM
52,,SING,CMC,HMC,no,N,52,,146522,26886,HEM
53,,SING,CMC,HMCA,no,N,53,,146522,26886,HEM
54,,SING,CMC,HMCB,no,N,54,,146522,26886,HEM
55,,DOUB,CAC,CBC,no,N,55,,146522,26886,HEM
56,,SING,CAC,HAC,no,N,56,,146522,26886,HEM
57,,SING,CBC,HBC,no,N,57,,146522,26886,HEM
58,,SING,CBC,HBCA,no,N,58,,146522,26886,HEM
59,,SING,C1D,C2D,no,N,59,,146522,26886,HEM
60,,DOUB,C1D,ND,no,N,60,,146522,26886,HEM
61,,DOUB,C2D,C3D,no,N,61,,146522,26886,HEM
62,,SING,C2D,CMD,no,N,62,,146522,26886,HEM
63,,SING,C3D,C4D,no,N,63,,146522,26886,HEM
64,,SING,C3D,CAD,no,N,64,,146522,26886,HEM
65,,SING,C4D,ND,no,N,65,,146522,26886,HEM
66,,SING,CMD,HMD,no,N,66,,146522,26886,HEM
67,,SING,CMD,HMDA,no,N,67,,146522,26886,HEM
68,,SING,CMD,HMDB,no,N,68,,146522,26886,HEM
69,,SING,CAD,CBD,no,N,69,,146522,26886,HEM
70,,SING,CAD,HAD,no,N,70,,146522,26886,HEM
71,,SING,CAD,HADA,no,N,71,,146522,26886,HEM
72,,SING,CBD,CGD,no,N,72,,146522,26886,HEM
73,,SING,CBD,HBD,no,N,73,,146522,26886,HEM
74,,SING,CBD,HBDA,no,N,74,,146522,26886,HEM
75,,DOUB,CGD,O1D,no,N,75,,146522,26886,HEM
76,,SING,CGD,O2D,no,N,76,,146522,26886,HEM
77,,SING,O2A,H2A,no,N,77,,146522,26886,HEM
78,,SING,O2D,H2D,no,N,78,,146522,26886,HEM
79,,SING,FE,NA,no,N,79,,146522,26886,HEM
80,,SING,FE,NB,no,N,80,,146522,26886,HEM
81,,SING,FE,NC,no,N,81,,146522,26886,HEM
82,,SING,FE,ND,no,N,82,,146522,26886,HEM
1,,DOUB,C,O,no,N,1,,147041,26927,ACE
2,,SING,C,CH3,no,N,2,,147041,26927,ACE
3,,SING,C,H,no,N,3,,147041,26927,ACE
4,,SING,CH3,H1,no,N,4,,147041,26927,ACE
5,,SING,CH3,H2,no,N,5,,147041,26927,ACE
6,,SING,CH3,H3,no,N,6,,147041,26927,ACE
1,,DOUB,NAV,CAU,no,N,1,,147109,26933,7HS
2,,SING,CAU,NAW,no,N,2,,147109,26933,7HS
3,,SING,CAU,NAT,no,N,3,,147109,26933,7HS
4,,SING,NAT,CAS,no,N,4,,147109,26933,7HS
5,,SING,CAS,CAR,no,N,5,,147109,26933,7HS
6,,SING,CAR,CAQ,no,N,6,,147109,26933,7HS
7,,SING,CAQ,CAN,no,N,7,,147109,26933,7HS
8,,SING,CAN,CAO,no,N,8,,147109,26933,7HS
9,,SING,CAN,NAM,no,N,9,,147109,26933,7HS
10,,DOUB,CAO,OAX,no,N,10,,147109,26933,7HS
11,,SING,NAM,C,no,N,11,,147109,26933,7HS
12,,DOUB,O,C,no,N,12,,147109,26933,7HS
13,,SING,C,CA,no,N,13,,147109,26933,7HS
14,,DOUB,OAC,CAB,no,N,14,,147109,26933,7HS
15,,SING,CAA,CAB,no,N,15,,147109,26933,7HS
16,,SING,CAB,N,no,N,16,,147109,26933,7HS
17,,SING,N,CA,no,N,17,,147109,26933,7HS
18,,SING,CA,CB,no,N,18,,147109,26933,7HS
19,,SING,CB,CG,no,N,19,,147109,26933,7HS
20,,SING,CG,CD,no,N,20,,147109,26933,7HS
21,,SING,CD,CE,no,N,21,,147109,26933,7HS
22,,SING,NZ,CE,no,N,22,,147109,26933,7HS
23,,SING,N,H1,no,N,23,,147109,26933,7HS
24,,SING,CA,H2,no,N,24,,147109,26933,7HS
25,,SING,CAA,H3,no,N,25,,147109,26933,7HS
26,,SING,CAA,H4,no,N,26,,147109,26933,7HS
27,,SING,CAA,H5,no,N,27,,147109,26933,7HS
28,,SING,CAN,H6,no,N,28,,147109,26933,7HS
29,,SING,CAO,H7,no,N,29,,147109,26933,7HS
30,,SING,CAQ,H8,no,N,30,,147109,26933,7HS
31,,SING,CAQ,H9,no,N,31,,147109,26933,7HS
32,,SING,CAR,H10,no,N,32,,147109,26933,7HS
33,,SING,CAR,H11,no,N,33,,147109,26933,7HS
34,,SING,CAS,H12,no,N,34,,147109,26933,7HS
35,,SING,CAS,H13,no,N,35,,147109,26933,7HS
36,,SING,NAM,H14,no,N,36,,147109,26933,7HS
37,,SING,NAT,H15,no,N,37,,147109,26933,7HS
38,,SING,NAV,H16,no,N,38,,147109,26933,7HS
39,,SING,NAW,H17,no,N,39,,147109,26933,7HS
40,,SING,NAW,H18,no,N,40,,147109,26933,7HS
41,,SING,CB,H19,no,N,41,,147109,26933,7HS
42,,SING,CB,H20,no,N,42,,147109,26933,7HS
43,,SING,CG,H21,no,N,43,,147109,26933,7HS
44,,SING,CG,H22,no,N,44,,147109,26933,7HS
45,,SING,CD,H23,no,N,45,,147109,26933,7HS
46,,SING,CD,H24,no,N,46,,147109,26933,7HS
47,,SING,CE,H25,no,N,47,,147109,26933,7HS
48,,SING,CE,H26,no,N,48,,147109,26933,7HS
49,,SING,NZ,H27,no,N,49,,147109,26933,7HS
50,,SING,NZ,H28,no,N,50,,147109,26933,7HS
1,,SING,CAD,CAA,no,N,1,,147329,26947,5U0
2,,SING,CAB,CAA,no,N,2,,147329,26947,5U0
3,,DOUB,CAA,CAC,no,N,3,,147329,26947,5U0
4,,SING,CAC,CAE,no,N,4,,147329,26947,5U0
5,,SING,CAE,CAF,no,N,5,,147329,26947,5U0
6,,SING,CAF,CAG,no,N,6,,147329,26947,5U0
7,,DOUB,CAH,CAG,no,E,7,,147329,26947,5U0
8,,SING,CAH,CAJ,no,N,8,,147329,26947,5U0
9,,SING,CAG,CAI,no,N,9,,147329,26947,5U0
9,,SING,CG,HG2,,,,,240396,6146,MLN_2
10,,SING,CAJ,CAK,no,N,10,,147329,26947,5U0
11,,SING,CAK,CAL,no,N,11,,147329,26947,5U0
12,,DOUB,CAL,CAM,no,E,12,,147329,26947,5U0
13,,SING,CAL,CAN,no,N,13,,147329,26947,5U0
14,,SING,CAM,CAO,no,N,14,,147329,26947,5U0
15,,SING,CB,SAP,no,N,15,,147329,26947,5U0
16,,SING,CB,CA,no,N,16,,147329,26947,5U0
17,,SING,SAP,CAO,no,N,17,,147329,26947,5U0
18,,SING,N,CA,no,N,18,,147329,26947,5U0
19,,SING,CA,C,no,N,19,,147329,26947,5U0
20,,DOUB,O,C,no,N,20,,147329,26947,5U0
21,,SING,C,OAV,no,N,21,,147329,26947,5U0
22,,SING,OAV,CAW,no,N,22,,147329,26947,5U0
23,,SING,CAB,H1,no,N,23,,147329,26947,5U0
24,,SING,CAB,H2,no,N,24,,147329,26947,5U0
25,,SING,CAB,H3,no,N,25,,147329,26947,5U0
26,,SING,CAD,H4,no,N,26,,147329,26947,5U0
27,,SING,CAD,H5,no,N,27,,147329,26947,5U0
28,,SING,CAD,H6,no,N,28,,147329,26947,5U0
29,,SING,CAC,H7,no,N,29,,147329,26947,5U0
30,,SING,CAE,H8,no,N,30,,147329,26947,5U0
31,,SING,CAE,H9,no,N,31,,147329,26947,5U0
32,,SING,CAF,H10,no,N,32,,147329,26947,5U0
33,,SING,CAF,H11,no,N,33,,147329,26947,5U0
34,,SING,CAI,H12,no,N,34,,147329,26947,5U0
35,,SING,CAI,H13,no,N,35,,147329,26947,5U0
36,,SING,CAI,H14,no,N,36,,147329,26947,5U0
37,,SING,CAH,H15,no,N,37,,147329,26947,5U0
38,,SING,CAJ,H16,no,N,38,,147329,26947,5U0
39,,SING,CAJ,H17,no,N,39,,147329,26947,5U0
40,,SING,CAK,H18,no,N,40,,147329,26947,5U0
41,,SING,CAK,H19,no,N,41,,147329,26947,5U0
42,,SING,CAN,H20,no,N,42,,147329,26947,5U0
43,,SING,CAN,H21,no,N,43,,147329,26947,5U0
44,,SING,CAN,H22,no,N,44,,147329,26947,5U0
45,,SING,CAM,H23,no,N,45,,147329,26947,5U0
46,,SING,CAO,H24,no,N,46,,147329,26947,5U0
47,,SING,CAO,H25,no,N,47,,147329,26947,5U0
48,,SING,CB,H26,no,N,48,,147329,26947,5U0
49,,SING,CB,H27,no,N,49,,147329,26947,5U0
50,,SING,CA,H28,no,N,50,,147329,26947,5U0
51,,SING,N,H29,no,N,51,,147329,26947,5U0
52,,SING,N,H30,no,N,52,,147329,26947,5U0
53,,SING,CAW,H32,no,N,53,,147329,26947,5U0
54,,SING,CAW,H33,no,N,54,,147329,26947,5U0
55,,SING,CAW,H34,no,N,55,,147329,26947,5U0
1,,SING,N,CA,no,N,1,,147515,26960,SEP
2,,SING,N,H,no,N,2,,147515,26960,SEP
3,,SING,N,H2,no,N,3,,147515,26960,SEP
4,,SING,CA,CB,no,N,4,,147515,26960,SEP
5,,SING,CA,C,no,N,5,,147515,26960,SEP
6,,SING,CA,HA,no,N,6,,147515,26960,SEP
7,,SING,CB,OG,no,N,7,,147515,26960,SEP
8,,SING,CB,HB2,no,N,8,,147515,26960,SEP
9,,SING,CB,HB3,no,N,9,,147515,26960,SEP
10,,SING,OG,P,no,N,10,,147515,26960,SEP
11,,DOUB,C,O,no,N,11,,147515,26960,SEP
12,,SING,C,OXT,no,N,12,,147515,26960,SEP
13,,SING,OXT,HXT,no,N,13,,147515,26960,SEP
14,,DOUB,P,O1P,no,N,14,,147515,26960,SEP
15,,SING,P,O2P,no,N,15,,147515,26960,SEP
16,,SING,P,O3P,no,N,16,,147515,26960,SEP
17,,SING,O2P,HOP2,no,N,17,,147515,26960,SEP
18,,SING,O3P,HOP3,no,N,18,,147515,26960,SEP
1,,SING,N,CA,no,N,1,,147516,26960,TPO
2,,SING,N,H,no,N,2,,147516,26960,TPO
3,,SING,N,H2,no,N,3,,147516,26960,TPO
4,,SING,CA,CB,no,N,4,,147516,26960,TPO
5,,SING,CA,C,no,N,5,,147516,26960,TPO
6,,SING,CA,HA,no,N,6,,147516,26960,TPO
7,,SING,CB,CG2,no,N,7,,147516,26960,TPO
8,,SING,CB,OG1,no,N,8,,147516,26960,TPO
9,,SING,CB,HB,no,N,9,,147516,26960,TPO
10,,SING,CG2,HG21,no,N,10,,147516,26960,TPO
11,,SING,CG2,HG22,no,N,11,,147516,26960,TPO
12,,SING,CG2,HG23,no,N,12,,147516,26960,TPO
13,,SING,OG1,P,no,N,13,,147516,26960,TPO
14,,DOUB,P,O1P,no,N,14,,147516,26960,TPO
15,,SING,P,O2P,no,N,15,,147516,26960,TPO
16,,SING,P,O3P,no,N,16,,147516,26960,TPO
17,,SING,O2P,HOP2,no,N,17,,147516,26960,TPO
18,,SING,O3P,HOP3,no,N,18,,147516,26960,TPO
19,,DOUB,C,O,no,N,19,,147516,26960,TPO
20,,SING,C,OXT,no,N,20,,147516,26960,TPO
21,,SING,OXT,HXT,no,N,21,,147516,26960,TPO
1,,DOUB,OAF,CAZ,no,N,1,,147708,26971,HXG
2,,SING,CAN,CAL,no,N,2,,147708,26971,HXG
3,,SING,CAN,CAQ,no,N,3,,147708,26971,HXG
4,,SING,CAZ,OAV,no,N,4,,147708,26971,HXG
5,,SING,CAZ,CAQ,no,N,5,,147708,26971,HXG
6,,SING,CAL,CAJ,no,N,6,,147708,26971,HXG
7,,SING,CAS,CAP,no,N,7,,147708,26971,HXG
8,,SING,CAS,NBC,no,N,8,,147708,26971,HXG
9,,SING,CAC,NBC,no,N,9,,147708,26971,HXG
10,,SING,CAA,CAJ,no,N,10,,147708,26971,HXG
11,,SING,OAV,CAT,no,N,11,,147708,26971,HXG
12,,SING,CAP,OAW,no,N,12,,147708,26971,HXG
13,,SING,NBC,CAD,no,N,13,,147708,26971,HXG
14,,SING,NBC,CAE,no,N,14,,147708,26971,HXG
15,,SING,OAW,PBD,no,N,15,,147708,26971,HXG
16,,SING,CAT,CBB,no,N,16,,147708,26971,HXG
17,,SING,OAX,PBD,no,N,17,,147708,26971,HXG
5,,SING,C1,H11,,,,,240402,6146,TPL_2
18,,SING,OAX,CAU,no,N,18,,147708,26971,HXG
19,,SING,CBB,CAU,no,N,19,,147708,26971,HXG
20,,SING,CBB,OAY,no,N,20,,147708,26971,HXG
21,,DOUB,PBD,OAI,no,N,21,,147708,26971,HXG
22,,SING,PBD,OAH,no,N,22,,147708,26971,HXG
23,,SING,OAY,CBA,no,N,23,,147708,26971,HXG
24,,DOUB,CBA,OAG,no,N,24,,147708,26971,HXG
25,,SING,CBA,CAR,no,N,25,,147708,26971,HXG
26,,SING,CAR,CAO,no,N,26,,147708,26971,HXG
27,,SING,CAM,CAO,no,N,27,,147708,26971,HXG
28,,SING,CAM,CAK,no,N,28,,147708,26971,HXG
29,,SING,CAB,CAK,no,N,29,,147708,26971,HXG
30,,SING,CAA,H1,no,N,30,,147708,26971,HXG
31,,SING,CAA,H2,no,N,31,,147708,26971,HXG
32,,SING,CAA,H3,no,N,32,,147708,26971,HXG
33,,SING,CAJ,H4,no,N,33,,147708,26971,HXG
34,,SING,CAJ,H5,no,N,34,,147708,26971,HXG
35,,SING,CAL,H6,no,N,35,,147708,26971,HXG
36,,SING,CAL,H7,no,N,36,,147708,26971,HXG
37,,SING,CAN,H8,no,N,37,,147708,26971,HXG
38,,SING,CAN,H9,no,N,38,,147708,26971,HXG
39,,SING,CAQ,H10,no,N,39,,147708,26971,HXG
40,,SING,CAQ,H11,no,N,40,,147708,26971,HXG
41,,SING,CAT,H12,no,N,41,,147708,26971,HXG
42,,SING,CAT,H13,no,N,42,,147708,26971,HXG
43,,SING,CBB,H14,no,N,43,,147708,26971,HXG
44,,SING,CAR,H15,no,N,44,,147708,26971,HXG
45,,SING,CAR,H16,no,N,45,,147708,26971,HXG
46,,SING,CAO,H17,no,N,46,,147708,26971,HXG
47,,SING,CAO,H18,no,N,47,,147708,26971,HXG
48,,SING,CAM,H19,no,N,48,,147708,26971,HXG
49,,SING,CAM,H20,no,N,49,,147708,26971,HXG
50,,SING,CAK,H21,no,N,50,,147708,26971,HXG
51,,SING,CAK,H22,no,N,51,,147708,26971,HXG
52,,SING,CAB,H23,no,N,52,,147708,26971,HXG
53,,SING,CAB,H24,no,N,53,,147708,26971,HXG
54,,SING,CAB,H25,no,N,54,,147708,26971,HXG
55,,SING,CAU,H26,no,N,55,,147708,26971,HXG
56,,SING,CAU,H27,no,N,56,,147708,26971,HXG
57,,SING,OAH,H28,no,N,57,,147708,26971,HXG
58,,SING,CAP,H29,no,N,58,,147708,26971,HXG
59,,SING,CAP,H30,no,N,59,,147708,26971,HXG
60,,SING,CAS,H31,no,N,60,,147708,26971,HXG
61,,SING,CAS,H32,no,N,61,,147708,26971,HXG
62,,SING,CAD,H33,no,N,62,,147708,26971,HXG
63,,SING,CAD,H34,no,N,63,,147708,26971,HXG
64,,SING,CAD,H35,no,N,64,,147708,26971,HXG
65,,SING,CAE,H36,no,N,65,,147708,26971,HXG
66,,SING,CAE,H37,no,N,66,,147708,26971,HXG
67,,SING,CAE,H38,no,N,67,,147708,26971,HXG
68,,SING,CAC,H39,no,N,68,,147708,26971,HXG
69,,SING,CAC,H40,no,N,69,,147708,26971,HXG
70,,SING,CAC,H41,no,N,70,,147708,26971,HXG
1,,SING,N,CA,no,N,1,,147723,26972,SAM
2,,SING,N,HN1,no,N,2,,147723,26972,SAM
3,,SING,N,HN2,no,N,3,,147723,26972,SAM
4,,SING,CA,C,no,N,4,,147723,26972,SAM
5,,SING,CA,CB,no,N,5,,147723,26972,SAM
6,,SING,CA,HA,no,N,6,,147723,26972,SAM
7,,DOUB,C,O,no,N,7,,147723,26972,SAM
8,,SING,C,OXT,no,N,8,,147723,26972,SAM
9,,SING,CB,CG,no,N,9,,147723,26972,SAM
10,,SING,CB,HB1,no,N,10,,147723,26972,SAM
11,,SING,CB,HB2,no,N,11,,147723,26972,SAM
12,,SING,CG,SD,no,N,12,,147723,26972,SAM
13,,SING,CG,HG1,no,N,13,,147723,26972,SAM
14,,SING,CG,HG2,no,N,14,,147723,26972,SAM
15,,SING,SD,CE,no,N,15,,147723,26972,SAM
16,,SING,SD,C5',no,N,16,,147723,26972,SAM
17,,SING,CE,HE1,no,N,17,,147723,26972,SAM
18,,SING,CE,HE2,no,N,18,,147723,26972,SAM
19,,SING,CE,HE3,no,N,19,,147723,26972,SAM
20,,SING,C5',C4',no,N,20,,147723,26972,SAM
21,,SING,C5',H5'1,no,N,21,,147723,26972,SAM
22,,SING,C5',H5'2,no,N,22,,147723,26972,SAM
23,,SING,C4',O4',no,N,23,,147723,26972,SAM
24,,SING,C4',C3',no,N,24,,147723,26972,SAM
25,,SING,C4',H4',no,N,25,,147723,26972,SAM
26,,SING,O4',C1',no,N,26,,147723,26972,SAM
27,,SING,C3',O3',no,N,27,,147723,26972,SAM
28,,SING,C3',C2',no,N,28,,147723,26972,SAM
29,,SING,C3',H3',no,N,29,,147723,26972,SAM
30,,SING,O3',HO3',no,N,30,,147723,26972,SAM
31,,SING,C2',O2',no,N,31,,147723,26972,SAM
32,,SING,C2',C1',no,N,32,,147723,26972,SAM
33,,SING,C2',H2',no,N,33,,147723,26972,SAM
34,,SING,O2',HO2',no,N,34,,147723,26972,SAM
35,,SING,C1',N9,no,N,35,,147723,26972,SAM
36,,SING,C1',H1',no,N,36,,147723,26972,SAM
37,,SING,N9,C8,yes,N,37,,147723,26972,SAM
38,,SING,N9,C4,yes,N,38,,147723,26972,SAM
39,,DOUB,C8,N7,yes,N,39,,147723,26972,SAM
40,,SING,C8,H8,no,N,40,,147723,26972,SAM
41,,SING,N7,C5,yes,N,41,,147723,26972,SAM
42,,SING,C5,C6,yes,N,42,,147723,26972,SAM
43,,DOUB,C5,C4,yes,N,43,,147723,26972,SAM
44,,SING,C6,N6,no,N,44,,147723,26972,SAM
45,,DOUB,C6,N1,yes,N,45,,147723,26972,SAM
46,,SING,N6,HN61,no,N,46,,147723,26972,SAM
47,,SING,N6,HN62,no,N,47,,147723,26972,SAM
6,,SING,C1,H12,,,,,240402,6146,TPL_2
48,,SING,N1,C2,yes,N,48,,147723,26972,SAM
49,,DOUB,C2,N3,yes,N,49,,147723,26972,SAM
50,,SING,C2,H2,no,N,50,,147723,26972,SAM
51,,SING,N3,C4,yes,N,51,,147723,26972,SAM
1,,SING,FE,NA,no,N,1,,147739,26973,HEC
2,,SING,FE,NB,no,N,2,,147739,26973,HEC
3,,SING,FE,NC,no,N,3,,147739,26973,HEC
4,,SING,FE,ND,no,N,4,,147739,26973,HEC
5,,DOUB,CHA,C1A,no,N,5,,147739,26973,HEC
6,,SING,CHA,C4D,no,N,6,,147739,26973,HEC
7,,SING,CHA,HHA,no,N,7,,147739,26973,HEC
8,,DOUB,CHB,C4A,no,N,8,,147739,26973,HEC
9,,SING,CHB,C1B,no,N,9,,147739,26973,HEC
10,,SING,CHB,HHB,no,N,10,,147739,26973,HEC
11,,DOUB,CHC,C4B,no,N,11,,147739,26973,HEC
12,,SING,CHC,C1C,no,N,12,,147739,26973,HEC
13,,SING,CHC,HHC,no,N,13,,147739,26973,HEC
14,,DOUB,CHD,C4C,no,N,14,,147739,26973,HEC
15,,SING,CHD,C1D,no,N,15,,147739,26973,HEC
16,,SING,CHD,HHD,no,N,16,,147739,26973,HEC
17,,SING,NA,C1A,yes,N,17,,147739,26973,HEC
18,,SING,NA,C4A,yes,N,18,,147739,26973,HEC
19,,SING,C1A,C2A,yes,N,19,,147739,26973,HEC
20,,DOUB,C2A,C3A,yes,N,20,,147739,26973,HEC
21,,SING,C2A,CAA,no,N,21,,147739,26973,HEC
22,,SING,C3A,C4A,yes,N,22,,147739,26973,HEC
23,,SING,C3A,CMA,no,N,23,,147739,26973,HEC
24,,SING,CMA,HMA1,no,N,24,,147739,26973,HEC
25,,SING,CMA,HMA2,no,N,25,,147739,26973,HEC
26,,SING,CMA,HMA3,no,N,26,,147739,26973,HEC
27,,SING,CAA,CBA,no,N,27,,147739,26973,HEC
28,,SING,CAA,HAA1,no,N,28,,147739,26973,HEC
29,,SING,CAA,HAA2,no,N,29,,147739,26973,HEC
30,,SING,CBA,CGA,no,N,30,,147739,26973,HEC
31,,SING,CBA,HBA1,no,N,31,,147739,26973,HEC
32,,SING,CBA,HBA2,no,N,32,,147739,26973,HEC
33,,DOUB,CGA,O1A,no,N,33,,147739,26973,HEC
34,,SING,CGA,O2A,no,N,34,,147739,26973,HEC
35,,SING,O2A,H2A,no,N,35,,147739,26973,HEC
36,,SING,NB,C1B,yes,N,36,,147739,26973,HEC
37,,SING,NB,C4B,yes,N,37,,147739,26973,HEC
38,,DOUB,C1B,C2B,yes,N,38,,147739,26973,HEC
39,,SING,C2B,C3B,yes,N,39,,147739,26973,HEC
40,,SING,C2B,CMB,no,N,40,,147739,26973,HEC
41,,SING,C3B,C4B,yes,N,41,,147739,26973,HEC
42,,DOUB,C3B,CAB,no,E,42,,147739,26973,HEC
43,,SING,CMB,HMB1,no,N,43,,147739,26973,HEC
44,,SING,CMB,HMB2,no,N,44,,147739,26973,HEC
45,,SING,CMB,HMB3,no,N,45,,147739,26973,HEC
46,,SING,CAB,CBB,no,N,46,,147739,26973,HEC
47,,SING,CAB,HAB,no,N,47,,147739,26973,HEC
48,,SING,CBB,HBB1,no,N,48,,147739,26973,HEC
49,,SING,CBB,HBB2,no,N,49,,147739,26973,HEC
50,,SING,CBB,HBB3,no,N,50,,147739,26973,HEC
51,,SING,NC,C1C,yes,N,51,,147739,26973,HEC
52,,SING,NC,C4C,yes,N,52,,147739,26973,HEC
53,,DOUB,C1C,C2C,yes,N,53,,147739,26973,HEC
54,,SING,C2C,C3C,yes,N,54,,147739,26973,HEC
55,,SING,C2C,CMC,no,N,55,,147739,26973,HEC
56,,SING,C3C,C4C,yes,N,56,,147739,26973,HEC
57,,DOUB,C3C,CAC,no,E,57,,147739,26973,HEC
58,,SING,CMC,HMC1,no,N,58,,147739,26973,HEC
59,,SING,CMC,HMC2,no,N,59,,147739,26973,HEC
60,,SING,CMC,HMC3,no,N,60,,147739,26973,HEC
61,,SING,CAC,CBC,no,N,61,,147739,26973,HEC
62,,SING,CAC,HAC,no,N,62,,147739,26973,HEC
63,,SING,CBC,HBC1,no,N,63,,147739,26973,HEC
64,,SING,CBC,HBC2,no,N,64,,147739,26973,HEC
65,,SING,CBC,HBC3,no,N,65,,147739,26973,HEC
66,,SING,ND,C1D,yes,N,66,,147739,26973,HEC
67,,SING,ND,C4D,yes,N,67,,147739,26973,HEC
68,,DOUB,C1D,C2D,yes,N,68,,147739,26973,HEC
69,,SING,C2D,C3D,yes,N,69,,147739,26973,HEC
70,,SING,C2D,CMD,no,N,70,,147739,26973,HEC
71,,DOUB,C3D,C4D,yes,N,71,,147739,26973,HEC
72,,SING,C3D,CAD,no,N,72,,147739,26973,HEC
73,,SING,CMD,HMD1,no,N,73,,147739,26973,HEC
74,,SING,CMD,HMD2,no,N,74,,147739,26973,HEC
75,,SING,CMD,HMD3,no,N,75,,147739,26973,HEC
76,,SING,CAD,CBD,no,N,76,,147739,26973,HEC
77,,SING,CAD,HAD1,no,N,77,,147739,26973,HEC
78,,SING,CAD,HAD2,no,N,78,,147739,26973,HEC
79,,SING,CBD,CGD,no,N,79,,147739,26973,HEC
80,,SING,CBD,HBD1,no,N,80,,147739,26973,HEC
81,,SING,CBD,HBD2,no,N,81,,147739,26973,HEC
82,,DOUB,CGD,O1D,no,N,82,,147739,26973,HEC
83,,SING,CGD,O2D,no,N,83,,147739,26973,HEC
84,,SING,O2D,H2D,no,N,84,,147739,26973,HEC
1,,DOUB,PB,O1B,no,N,1,,147773,26975,GDP
2,,SING,PB,O2B,no,N,2,,147773,26975,GDP
3,,SING,PB,O3B,no,N,3,,147773,26975,GDP
4,,SING,PB,O3A,no,N,4,,147773,26975,GDP
5,,SING,O2B,HOB2,no,N,5,,147773,26975,GDP
6,,SING,O3B,HOB3,no,N,6,,147773,26975,GDP
7,,SING,O3A,PA,no,N,7,,147773,26975,GDP
8,,DOUB,PA,O1A,no,N,8,,147773,26975,GDP
9,,SING,PA,O2A,no,N,9,,147773,26975,GDP
10,,SING,PA,O5',no,N,10,,147773,26975,GDP
11,,SING,O2A,HOA2,no,N,11,,147773,26975,GDP
12,,SING,O5',C5',no,N,12,,147773,26975,GDP
13,,SING,C5',C4',no,N,13,,147773,26975,GDP
14,,SING,C5',H5',no,N,14,,147773,26975,GDP
15,,SING,C5',H5'',no,N,15,,147773,26975,GDP
16,,SING,C4',O4',no,N,16,,147773,26975,GDP
17,,SING,C4',C3',no,N,17,,147773,26975,GDP
18,,SING,C4',H4',no,N,18,,147773,26975,GDP
19,,SING,O4',C1',no,N,19,,147773,26975,GDP
20,,SING,C3',O3',no,N,20,,147773,26975,GDP
21,,SING,C3',C2',no,N,21,,147773,26975,GDP
22,,SING,C3',H3',no,N,22,,147773,26975,GDP
23,,SING,O3',HO3',no,N,23,,147773,26975,GDP
24,,SING,C2',O2',no,N,24,,147773,26975,GDP
25,,SING,C2',C1',no,N,25,,147773,26975,GDP
26,,SING,C2',H2',no,N,26,,147773,26975,GDP
27,,SING,O2',HO2',no,N,27,,147773,26975,GDP
28,,SING,C1',N9,no,N,28,,147773,26975,GDP
29,,SING,C1',H1',no,N,29,,147773,26975,GDP
30,,SING,N9,C8,yes,N,30,,147773,26975,GDP
31,,SING,N9,C4,yes,N,31,,147773,26975,GDP
32,,DOUB,C8,N7,yes,N,32,,147773,26975,GDP
33,,SING,C8,H8,no,N,33,,147773,26975,GDP
34,,SING,N7,C5,yes,N,34,,147773,26975,GDP
35,,SING,C5,C6,no,N,35,,147773,26975,GDP
36,,DOUB,C5,C4,yes,N,36,,147773,26975,GDP
37,,DOUB,C6,O6,no,N,37,,147773,26975,GDP
38,,SING,C6,N1,no,N,38,,147773,26975,GDP
39,,SING,N1,C2,no,N,39,,147773,26975,GDP
40,,SING,N1,HN1,no,N,40,,147773,26975,GDP
41,,SING,C2,N2,no,N,41,,147773,26975,GDP
42,,DOUB,C2,N3,no,N,42,,147773,26975,GDP
43,,SING,N2,HN21,no,N,43,,147773,26975,GDP
44,,SING,N2,HN22,no,N,44,,147773,26975,GDP
45,,SING,N3,C4,no,N,45,,147773,26975,GDP
1,,DOUB,PB,O1B,no,N,1,,147791,26976,GDP
2,,SING,PB,O2B,no,N,2,,147791,26976,GDP
3,,SING,PB,O3B,no,N,3,,147791,26976,GDP
4,,SING,PB,O3A,no,N,4,,147791,26976,GDP
5,,SING,O2B,HOB2,no,N,5,,147791,26976,GDP
6,,SING,O3B,HOB3,no,N,6,,147791,26976,GDP
7,,SING,O3A,PA,no,N,7,,147791,26976,GDP
8,,DOUB,PA,O1A,no,N,8,,147791,26976,GDP
9,,SING,PA,O2A,no,N,9,,147791,26976,GDP
10,,SING,PA,O5',no,N,10,,147791,26976,GDP
11,,SING,O2A,HOA2,no,N,11,,147791,26976,GDP
12,,SING,O5',C5',no,N,12,,147791,26976,GDP
13,,SING,C5',C4',no,N,13,,147791,26976,GDP
14,,SING,C5',H5',no,N,14,,147791,26976,GDP
15,,SING,C5',H5'',no,N,15,,147791,26976,GDP
16,,SING,C4',O4',no,N,16,,147791,26976,GDP
17,,SING,C4',C3',no,N,17,,147791,26976,GDP
18,,SING,C4',H4',no,N,18,,147791,26976,GDP
19,,SING,O4',C1',no,N,19,,147791,26976,GDP
20,,SING,C3',O3',no,N,20,,147791,26976,GDP
21,,SING,C3',C2',no,N,21,,147791,26976,GDP
22,,SING,C3',H3',no,N,22,,147791,26976,GDP
23,,SING,O3',HO3',no,N,23,,147791,26976,GDP
24,,SING,C2',O2',no,N,24,,147791,26976,GDP
25,,SING,C2',C1',no,N,25,,147791,26976,GDP
26,,SING,C2',H2',no,N,26,,147791,26976,GDP
27,,SING,O2',HO2',no,N,27,,147791,26976,GDP
28,,SING,C1',N9,no,N,28,,147791,26976,GDP
29,,SING,C1',H1',no,N,29,,147791,26976,GDP
30,,SING,N9,C8,yes,N,30,,147791,26976,GDP
31,,SING,N9,C4,yes,N,31,,147791,26976,GDP
32,,DOUB,C8,N7,yes,N,32,,147791,26976,GDP
33,,SING,C8,H8,no,N,33,,147791,26976,GDP
34,,SING,N7,C5,yes,N,34,,147791,26976,GDP
35,,SING,C5,C6,no,N,35,,147791,26976,GDP
36,,DOUB,C5,C4,yes,N,36,,147791,26976,GDP
37,,DOUB,C6,O6,no,N,37,,147791,26976,GDP
38,,SING,C6,N1,no,N,38,,147791,26976,GDP
39,,SING,N1,C2,no,N,39,,147791,26976,GDP
40,,SING,N1,HN1,no,N,40,,147791,26976,GDP
41,,SING,C2,N2,no,N,41,,147791,26976,GDP
42,,DOUB,C2,N3,no,N,42,,147791,26976,GDP
43,,SING,N2,HN21,no,N,43,,147791,26976,GDP
44,,SING,N2,HN22,no,N,44,,147791,26976,GDP
45,,SING,N3,C4,no,N,45,,147791,26976,GDP
1,,DOUB,N3,C4,no,N,1,,147829,26978,1MC
2,,SING,N3,C2,no,N,2,,147829,26978,1MC
3,,SING,C4,N4,no,N,3,,147829,26978,1MC
4,,SING,C4,C5,no,N,4,,147829,26978,1MC
5,,SING,N1,CN1,no,N,5,,147829,26978,1MC
6,,SING,N1,C2,no,N,6,,147829,26978,1MC
7,,SING,N1,C6,no,N,7,,147829,26978,1MC
8,,SING,CN1,H11,no,N,8,,147829,26978,1MC
9,,SING,CN1,H12,no,N,9,,147829,26978,1MC
10,,SING,CN1,H13,no,N,10,,147829,26978,1MC
11,,DOUB,C2,O2,no,N,11,,147829,26978,1MC
12,,SING,N4,HN41,no,N,12,,147829,26978,1MC
13,,SING,N4,HN42,no,N,13,,147829,26978,1MC
14,,DOUB,C5,C6,no,N,14,,147829,26978,1MC
15,,SING,C5,H5,no,N,15,,147829,26978,1MC
16,,SING,C6,H6,no,N,16,,147829,26978,1MC
1,,SING,OH,CZ3,no,N,1,,147915,26983,SRO
2,,SING,OH,HOH,no,N,2,,147915,26983,SRO
3,,DOUB,CZ3,CE3,yes,N,3,,147915,26983,SRO
4,,SING,CZ3,CH2,yes,N,4,,147915,26983,SRO
5,,DOUB,CH2,CZ2,yes,N,5,,147915,26983,SRO
6,,SING,CH2,HH2,no,N,6,,147915,26983,SRO
7,,SING,CZ2,CE2,yes,N,7,,147915,26983,SRO
8,,SING,CZ2,HZ2,no,N,8,,147915,26983,SRO
9,,SING,CE2,NE1,yes,N,9,,147915,26983,SRO
10,,DOUB,CE2,CD2,yes,N,10,,147915,26983,SRO
11,,SING,NE1,CD1,yes,N,11,,147915,26983,SRO
12,,SING,NE1,HNE1,no,N,12,,147915,26983,SRO
13,,DOUB,CD1,CG,yes,N,13,,147915,26983,SRO
14,,SING,CD1,HD1,no,N,14,,147915,26983,SRO
15,,SING,CG,CB,no,N,15,,147915,26983,SRO
16,,SING,CG,CD2,yes,N,16,,147915,26983,SRO
17,,SING,CD2,CE3,yes,N,17,,147915,26983,SRO
18,,SING,CE3,HE3,no,N,18,,147915,26983,SRO
19,,SING,CB,CA,no,N,19,,147915,26983,SRO
20,,SING,CB,HB1,no,N,20,,147915,26983,SRO
21,,SING,CB,HB2,no,N,21,,147915,26983,SRO
22,,SING,CA,NZ,no,N,22,,147915,26983,SRO
23,,SING,CA,HA1,no,N,23,,147915,26983,SRO
24,,SING,CA,HA2,no,N,24,,147915,26983,SRO
25,,SING,NZ,HNZ1,no,N,25,,147915,26983,SRO
26,,SING,NZ,HNZ2,no,N,26,,147915,26983,SRO
1,,SING,N,CA,no,N,1,,147916,26983,HSM
2,,SING,N,H1,no,N,2,,147916,26983,HSM
3,,SING,N,H2,no,N,3,,147916,26983,HSM
4,,SING,CA,CB,no,N,4,,147916,26983,HSM
5,,SING,CA,HA1,no,N,5,,147916,26983,HSM
6,,SING,CA,HA2,no,N,6,,147916,26983,HSM
7,,SING,CB,CG,no,N,7,,147916,26983,HSM
8,,SING,CB,HB1,no,N,8,,147916,26983,HSM
9,,SING,CB,HB2,no,N,9,,147916,26983,HSM
10,,SING,CG,ND1,yes,N,10,,147916,26983,HSM
11,,DOUB,CG,CD2,yes,N,11,,147916,26983,HSM
12,,DOUB,ND1,CE1,yes,N,12,,147916,26983,HSM
13,,SING,CD2,NE2,yes,N,13,,147916,26983,HSM
14,,SING,CD2,HD2,no,N,14,,147916,26983,HSM
15,,SING,CE1,NE2,yes,N,15,,147916,26983,HSM
16,,SING,CE1,HE1,no,N,16,,147916,26983,HSM
17,,SING,NE2,HE2,no,N,17,,147916,26983,HSM
1,,SING,N,CN,no,N,1,,148016,26992,FME
2,,SING,N,CA,no,N,2,,148016,26992,FME
3,,SING,N,H,no,N,3,,148016,26992,FME
4,,DOUB,CN,O1,no,N,4,,148016,26992,FME
5,,SING,CN,HCN,no,N,5,,148016,26992,FME
6,,SING,CA,CB,no,N,6,,148016,26992,FME
7,,SING,CA,C,no,N,7,,148016,26992,FME
8,,SING,CA,HA,no,N,8,,148016,26992,FME
9,,SING,CB,CG,no,N,9,,148016,26992,FME
10,,SING,CB,HB2,no,N,10,,148016,26992,FME
11,,SING,CB,HB3,no,N,11,,148016,26992,FME
12,,SING,CG,SD,no,N,12,,148016,26992,FME
13,,SING,CG,HG2,no,N,13,,148016,26992,FME
14,,SING,CG,HG3,no,N,14,,148016,26992,FME
15,,SING,SD,CE,no,N,15,,148016,26992,FME
16,,SING,CE,HE1,no,N,16,,148016,26992,FME
17,,SING,CE,HE2,no,N,17,,148016,26992,FME
18,,SING,CE,HE3,no,N,18,,148016,26992,FME
19,,DOUB,C,O,no,N,19,,148016,26992,FME
20,,SING,C,OXT,no,N,20,,148016,26992,FME
21,,SING,OXT,HXT,no,N,21,,148016,26992,FME
1,,SING,N,CA,no,N,1,,148153,27,TYS
2,,SING,N,H,no,N,2,,148153,27,TYS
3,,SING,N,HN2,no,N,3,,148153,27,TYS
4,,SING,CA,CB,no,N,4,,148153,27,TYS
5,,SING,CA,C,no,N,5,,148153,27,TYS
6,,SING,CA,HA,no,N,6,,148153,27,TYS
7,,SING,CB,CG,no,N,7,,148153,27,TYS
8,,SING,CB,HB2,no,N,8,,148153,27,TYS
9,,SING,CB,HB3,no,N,9,,148153,27,TYS
10,,DOUB,CG,CD1,yes,N,10,,148153,27,TYS
11,,SING,CG,CD2,yes,N,11,,148153,27,TYS
12,,SING,CD1,CE1,yes,N,12,,148153,27,TYS
13,,SING,CD1,HD1,no,N,13,,148153,27,TYS
14,,DOUB,CD2,CE2,yes,N,14,,148153,27,TYS
15,,SING,CD2,HD2,no,N,15,,148153,27,TYS
16,,DOUB,CE1,CZ,yes,N,16,,148153,27,TYS
17,,SING,CE1,HE1,no,N,17,,148153,27,TYS
18,,SING,CE2,CZ,yes,N,18,,148153,27,TYS
19,,SING,CE2,HE2,no,N,19,,148153,27,TYS
20,,SING,CZ,OH,no,N,20,,148153,27,TYS
21,,SING,OH,S,no,N,21,,148153,27,TYS
22,,DOUB,S,O1,no,N,22,,148153,27,TYS
23,,DOUB,S,O2,no,N,23,,148153,27,TYS
24,,SING,S,O3,no,N,24,,148153,27,TYS
25,,SING,O3,HO3,no,N,25,,148153,27,TYS
26,,DOUB,C,O,no,N,26,,148153,27,TYS
27,,SING,C,OXT,no,N,27,,148153,27,TYS
28,,SING,OXT,HXT,no,N,28,,148153,27,TYS
1,,DOUB,PA,O1A,no,N,1,,148231,27004,AP5
2,,SING,PA,O2A,no,N,2,,148231,27004,AP5
3,,SING,PA,O3A,no,N,3,,148231,27004,AP5
4,,SING,PA,O5F,no,N,4,,148231,27004,AP5
5,,SING,O2A,HOA2,no,N,5,,148231,27004,AP5
6,,SING,O3A,PB,no,N,6,,148231,27004,AP5
7,,DOUB,PB,O1B,no,N,7,,148231,27004,AP5
8,,SING,PB,O2B,no,N,8,,148231,27004,AP5
9,,SING,PB,O3B,no,N,9,,148231,27004,AP5
10,,SING,O2B,HOB2,no,N,10,,148231,27004,AP5
11,,SING,O3B,PG,no,N,11,,148231,27004,AP5
12,,DOUB,PG,O1G,no,N,12,,148231,27004,AP5
13,,SING,PG,O2G,no,N,13,,148231,27004,AP5
14,,SING,PG,O3G,no,N,14,,148231,27004,AP5
15,,SING,O2G,HOG2,no,N,15,,148231,27004,AP5
16,,SING,O3G,PD,no,N,16,,148231,27004,AP5
17,,DOUB,PD,O1D,no,N,17,,148231,27004,AP5
18,,SING,PD,O2D,no,N,18,,148231,27004,AP5
19,,SING,PD,O3D,no,N,19,,148231,27004,AP5
20,,SING,O2D,HOD2,no,N,20,,148231,27004,AP5
21,,SING,O3D,PE,no,N,21,,148231,27004,AP5
22,,DOUB,PE,O1E,no,N,22,,148231,27004,AP5
23,,SING,PE,O2E,no,N,23,,148231,27004,AP5
24,,SING,PE,O5J,no,N,24,,148231,27004,AP5
25,,SING,O2E,HOE2,no,N,25,,148231,27004,AP5
26,,SING,O5F,C5F,no,N,26,,148231,27004,AP5
27,,SING,C5F,C4F,no,N,27,,148231,27004,AP5
28,,SING,C5F,H51A,no,N,28,,148231,27004,AP5
29,,SING,C5F,H52A,no,N,29,,148231,27004,AP5
30,,SING,C4F,O4F,no,N,30,,148231,27004,AP5
31,,SING,C4F,C3F,no,N,31,,148231,27004,AP5
32,,SING,C4F,H4F,no,N,32,,148231,27004,AP5
33,,SING,O4F,C1F,no,N,33,,148231,27004,AP5
34,,SING,C3F,O3F,no,N,34,,148231,27004,AP5
35,,SING,C3F,C2F,no,N,35,,148231,27004,AP5
36,,SING,C3F,H3F,no,N,36,,148231,27004,AP5
37,,SING,O3F,HO3A,no,N,37,,148231,27004,AP5
38,,SING,C2F,O2F,no,N,38,,148231,27004,AP5
39,,SING,C2F,C1F,no,N,39,,148231,27004,AP5
40,,SING,C2F,H2F,no,N,40,,148231,27004,AP5
41,,SING,O2F,HO2A,no,N,41,,148231,27004,AP5
42,,SING,C1F,N9A,no,N,42,,148231,27004,AP5
43,,SING,C1F,H1F,no,N,43,,148231,27004,AP5
44,,SING,N9A,C8A,yes,N,44,,148231,27004,AP5
45,,SING,N9A,C4A,yes,N,45,,148231,27004,AP5
46,,DOUB,C8A,N7A,yes,N,46,,148231,27004,AP5
47,,SING,C8A,H8A,no,N,47,,148231,27004,AP5
48,,SING,N7A,C5A,yes,N,48,,148231,27004,AP5
49,,SING,C5A,C6A,yes,N,49,,148231,27004,AP5
50,,DOUB,C5A,C4A,yes,N,50,,148231,27004,AP5
51,,SING,C6A,N6A,no,N,51,,148231,27004,AP5
52,,DOUB,C6A,N1A,yes,N,52,,148231,27004,AP5
53,,SING,N6A,H61A,no,N,53,,148231,27004,AP5
54,,SING,N6A,H62A,no,N,54,,148231,27004,AP5
55,,SING,N1A,C2A,yes,N,55,,148231,27004,AP5
56,,DOUB,C2A,N3A,yes,N,56,,148231,27004,AP5
57,,SING,C2A,H2A,no,N,57,,148231,27004,AP5
58,,SING,N3A,C4A,yes,N,58,,148231,27004,AP5
59,,SING,O5J,C5J,no,N,59,,148231,27004,AP5
60,,SING,C5J,C4J,no,N,60,,148231,27004,AP5
61,,SING,C5J,H51B,no,N,61,,148231,27004,AP5
62,,SING,C5J,H52B,no,N,62,,148231,27004,AP5
63,,SING,C4J,O4J,no,N,63,,148231,27004,AP5
64,,SING,C4J,C3J,no,N,64,,148231,27004,AP5
65,,SING,C4J,H4J,no,N,65,,148231,27004,AP5
66,,SING,O4J,C1J,no,N,66,,148231,27004,AP5
67,,SING,C3J,O3J,no,N,67,,148231,27004,AP5
68,,SING,C3J,C2J,no,N,68,,148231,27004,AP5
69,,SING,C3J,H3J,no,N,69,,148231,27004,AP5
70,,SING,O3J,HO3B,no,N,70,,148231,27004,AP5
71,,SING,C2J,O2J,no,N,71,,148231,27004,AP5
72,,SING,C2J,C1J,no,N,72,,148231,27004,AP5
73,,SING,C2J,H2J,no,N,73,,148231,27004,AP5
74,,SING,O2J,HO2B,no,N,74,,148231,27004,AP5
75,,SING,C1J,N9B,no,N,75,,148231,27004,AP5
76,,SING,C1J,H1J,no,N,76,,148231,27004,AP5
77,,SING,N9B,C8B,yes,N,77,,148231,27004,AP5
78,,SING,N9B,C4B,yes,N,78,,148231,27004,AP5
79,,DOUB,C8B,N7B,yes,N,79,,148231,27004,AP5
80,,SING,C8B,H8B,no,N,80,,148231,27004,AP5
81,,SING,N7B,C5B,yes,N,81,,148231,27004,AP5
82,,SING,C5B,C6B,yes,N,82,,148231,27004,AP5
83,,DOUB,C5B,C4B,yes,N,83,,148231,27004,AP5
84,,SING,C6B,N6B,no,N,84,,148231,27004,AP5
85,,DOUB,C6B,N1B,yes,N,85,,148231,27004,AP5
86,,SING,N6B,H61B,no,N,86,,148231,27004,AP5
87,,SING,N6B,H62B,no,N,87,,148231,27004,AP5
88,,SING,N1B,C2B,yes,N,88,,148231,27004,AP5
89,,DOUB,C2B,N3B,yes,N,89,,148231,27004,AP5
90,,SING,C2B,H2B,no,N,90,,148231,27004,AP5
91,,SING,N3B,C4B,yes,N,91,,148231,27004,AP5
1,,DOUB,PG,O1G,no,N,1,,148249,27005,ATP
2,,SING,PG,O2G,no,N,2,,148249,27005,ATP
3,,SING,PG,O3G,no,N,3,,148249,27005,ATP
4,,SING,PG,O3B,no,N,4,,148249,27005,ATP
5,,SING,O2G,HOG2,no,N,5,,148249,27005,ATP
6,,SING,O3G,HOG3,no,N,6,,148249,27005,ATP
7,,DOUB,PB,O1B,no,N,7,,148249,27005,ATP
8,,SING,PB,O2B,no,N,8,,148249,27005,ATP
9,,SING,PB,O3B,no,N,9,,148249,27005,ATP
10,,SING,PB,O3A,no,N,10,,148249,27005,ATP
11,,SING,O2B,HOB2,no,N,11,,148249,27005,ATP
12,,DOUB,PA,O1A,no,N,12,,148249,27005,ATP
13,,SING,PA,O2A,no,N,13,,148249,27005,ATP
14,,SING,PA,O3A,no,N,14,,148249,27005,ATP
15,,SING,PA,O5',no,N,15,,148249,27005,ATP
16,,SING,O2A,HOA2,no,N,16,,148249,27005,ATP
17,,SING,O5',C5',no,N,17,,148249,27005,ATP
18,,SING,C5',C4',no,N,18,,148249,27005,ATP
19,,SING,C5',H5'1,no,N,19,,148249,27005,ATP
20,,SING,C5',H5'2,no,N,20,,148249,27005,ATP
21,,SING,C4',O4',no,N,21,,148249,27005,ATP
22,,SING,C4',C3',no,N,22,,148249,27005,ATP
23,,SING,C4',H4',no,N,23,,148249,27005,ATP
24,,SING,O4',C1',no,N,24,,148249,27005,ATP
25,,SING,C3',O3',no,N,25,,148249,27005,ATP
26,,SING,C3',C2',no,N,26,,148249,27005,ATP
27,,SING,C3',H3',no,N,27,,148249,27005,ATP
28,,SING,O3',HO3',no,N,28,,148249,27005,ATP
7,,SING,C2,H2,,,,,240402,6146,TPL_2
29,,SING,C2',O2',no,N,29,,148249,27005,ATP
30,,SING,C2',C1',no,N,30,,148249,27005,ATP
31,,SING,C2',H2',no,N,31,,148249,27005,ATP
32,,SING,O2',HO2',no,N,32,,148249,27005,ATP
33,,SING,C1',N9,no,N,33,,148249,27005,ATP
34,,SING,C1',H1',no,N,34,,148249,27005,ATP
35,,SING,N9,C8,yes,N,35,,148249,27005,ATP
36,,SING,N9,C4,yes,N,36,,148249,27005,ATP
37,,DOUB,C8,N7,yes,N,37,,148249,27005,ATP
38,,SING,C8,H8,no,N,38,,148249,27005,ATP
39,,SING,N7,C5,yes,N,39,,148249,27005,ATP
40,,SING,C5,C6,yes,N,40,,148249,27005,ATP
41,,DOUB,C5,C4,yes,N,41,,148249,27005,ATP
42,,SING,C6,N6,no,N,42,,148249,27005,ATP
43,,DOUB,C6,N1,yes,N,43,,148249,27005,ATP
44,,SING,N6,HN61,no,N,44,,148249,27005,ATP
45,,SING,N6,HN62,no,N,45,,148249,27005,ATP
46,,SING,N1,C2,yes,N,46,,148249,27005,ATP
47,,DOUB,C2,N3,yes,N,47,,148249,27005,ATP
48,,SING,C2,H2,no,N,48,,148249,27005,ATP
49,,SING,N3,C4,yes,N,49,,148249,27005,ATP
1,,DOUB,PA,O1A,no,N,1,,148267,27007,AP5
2,,SING,PA,O2A,no,N,2,,148267,27007,AP5
3,,SING,PA,O3A,no,N,3,,148267,27007,AP5
4,,SING,PA,O5F,no,N,4,,148267,27007,AP5
5,,SING,O2A,HOA2,no,N,5,,148267,27007,AP5
6,,SING,O3A,PB,no,N,6,,148267,27007,AP5
7,,DOUB,PB,O1B,no,N,7,,148267,27007,AP5
8,,SING,PB,O2B,no,N,8,,148267,27007,AP5
9,,SING,PB,O3B,no,N,9,,148267,27007,AP5
10,,SING,O2B,HOB2,no,N,10,,148267,27007,AP5
11,,SING,O3B,PG,no,N,11,,148267,27007,AP5
12,,DOUB,PG,O1G,no,N,12,,148267,27007,AP5
13,,SING,PG,O2G,no,N,13,,148267,27007,AP5
14,,SING,PG,O3G,no,N,14,,148267,27007,AP5
15,,SING,O2G,HOG2,no,N,15,,148267,27007,AP5
16,,SING,O3G,PD,no,N,16,,148267,27007,AP5
17,,DOUB,PD,O1D,no,N,17,,148267,27007,AP5
18,,SING,PD,O2D,no,N,18,,148267,27007,AP5
19,,SING,PD,O3D,no,N,19,,148267,27007,AP5
20,,SING,O2D,HOD2,no,N,20,,148267,27007,AP5
21,,SING,O3D,PE,no,N,21,,148267,27007,AP5
22,,DOUB,PE,O1E,no,N,22,,148267,27007,AP5
23,,SING,PE,O2E,no,N,23,,148267,27007,AP5
24,,SING,PE,O5J,no,N,24,,148267,27007,AP5
25,,SING,O2E,HOE2,no,N,25,,148267,27007,AP5
26,,SING,O5F,C5F,no,N,26,,148267,27007,AP5
27,,SING,C5F,C4F,no,N,27,,148267,27007,AP5
28,,SING,C5F,H51A,no,N,28,,148267,27007,AP5
29,,SING,C5F,H52A,no,N,29,,148267,27007,AP5
30,,SING,C4F,O4F,no,N,30,,148267,27007,AP5
31,,SING,C4F,C3F,no,N,31,,148267,27007,AP5
32,,SING,C4F,H4F,no,N,32,,148267,27007,AP5
33,,SING,O4F,C1F,no,N,33,,148267,27007,AP5
34,,SING,C3F,O3F,no,N,34,,148267,27007,AP5
35,,SING,C3F,C2F,no,N,35,,148267,27007,AP5
36,,SING,C3F,H3F,no,N,36,,148267,27007,AP5
37,,SING,O3F,HO3A,no,N,37,,148267,27007,AP5
38,,SING,C2F,O2F,no,N,38,,148267,27007,AP5
39,,SING,C2F,C1F,no,N,39,,148267,27007,AP5
40,,SING,C2F,H2F,no,N,40,,148267,27007,AP5
41,,SING,O2F,HO2A,no,N,41,,148267,27007,AP5
42,,SING,C1F,N9A,no,N,42,,148267,27007,AP5
43,,SING,C1F,H1F,no,N,43,,148267,27007,AP5
44,,SING,N9A,C8A,yes,N,44,,148267,27007,AP5
45,,SING,N9A,C4A,yes,N,45,,148267,27007,AP5
46,,DOUB,C8A,N7A,yes,N,46,,148267,27007,AP5
47,,SING,C8A,H8A,no,N,47,,148267,27007,AP5
48,,SING,N7A,C5A,yes,N,48,,148267,27007,AP5
49,,SING,C5A,C6A,yes,N,49,,148267,27007,AP5
50,,DOUB,C5A,C4A,yes,N,50,,148267,27007,AP5
51,,SING,C6A,N6A,no,N,51,,148267,27007,AP5
52,,DOUB,C6A,N1A,yes,N,52,,148267,27007,AP5
53,,SING,N6A,H61A,no,N,53,,148267,27007,AP5
54,,SING,N6A,H62A,no,N,54,,148267,27007,AP5
55,,SING,N1A,C2A,yes,N,55,,148267,27007,AP5
56,,DOUB,C2A,N3A,yes,N,56,,148267,27007,AP5
57,,SING,C2A,H2A,no,N,57,,148267,27007,AP5
58,,SING,N3A,C4A,yes,N,58,,148267,27007,AP5
59,,SING,O5J,C5J,no,N,59,,148267,27007,AP5
60,,SING,C5J,C4J,no,N,60,,148267,27007,AP5
61,,SING,C5J,H51B,no,N,61,,148267,27007,AP5
62,,SING,C5J,H52B,no,N,62,,148267,27007,AP5
63,,SING,C4J,O4J,no,N,63,,148267,27007,AP5
64,,SING,C4J,C3J,no,N,64,,148267,27007,AP5
65,,SING,C4J,H4J,no,N,65,,148267,27007,AP5
66,,SING,O4J,C1J,no,N,66,,148267,27007,AP5
67,,SING,C3J,O3J,no,N,67,,148267,27007,AP5
68,,SING,C3J,C2J,no,N,68,,148267,27007,AP5
69,,SING,C3J,H3J,no,N,69,,148267,27007,AP5
70,,SING,O3J,HO3B,no,N,70,,148267,27007,AP5
71,,SING,C2J,O2J,no,N,71,,148267,27007,AP5
72,,SING,C2J,C1J,no,N,72,,148267,27007,AP5
73,,SING,C2J,H2J,no,N,73,,148267,27007,AP5
74,,SING,O2J,HO2B,no,N,74,,148267,27007,AP5
75,,SING,C1J,N9B,no,N,75,,148267,27007,AP5
76,,SING,C1J,H1J,no,N,76,,148267,27007,AP5
77,,SING,N9B,C8B,yes,N,77,,148267,27007,AP5
78,,SING,N9B,C4B,yes,N,78,,148267,27007,AP5
79,,DOUB,C8B,N7B,yes,N,79,,148267,27007,AP5
80,,SING,C8B,H8B,no,N,80,,148267,27007,AP5
81,,SING,N7B,C5B,yes,N,81,,148267,27007,AP5
82,,SING,C5B,C6B,yes,N,82,,148267,27007,AP5
83,,DOUB,C5B,C4B,yes,N,83,,148267,27007,AP5
84,,SING,C6B,N6B,no,N,84,,148267,27007,AP5
85,,DOUB,C6B,N1B,yes,N,85,,148267,27007,AP5
86,,SING,N6B,H61B,no,N,86,,148267,27007,AP5
87,,SING,N6B,H62B,no,N,87,,148267,27007,AP5
88,,SING,N1B,C2B,yes,N,88,,148267,27007,AP5
89,,DOUB,C2B,N3B,yes,N,89,,148267,27007,AP5
90,,SING,C2B,H2B,no,N,90,,148267,27007,AP5
91,,SING,N3B,C4B,yes,N,91,,148267,27007,AP5
1,,DOUB,PG,O1G,no,N,1,,148285,27008,ATP
2,,SING,PG,O2G,no,N,2,,148285,27008,ATP
3,,SING,PG,O3G,no,N,3,,148285,27008,ATP
4,,SING,PG,O3B,no,N,4,,148285,27008,ATP
5,,SING,O2G,HOG2,no,N,5,,148285,27008,ATP
6,,SING,O3G,HOG3,no,N,6,,148285,27008,ATP
7,,DOUB,PB,O1B,no,N,7,,148285,27008,ATP
8,,SING,PB,O2B,no,N,8,,148285,27008,ATP
9,,SING,PB,O3B,no,N,9,,148285,27008,ATP
10,,SING,PB,O3A,no,N,10,,148285,27008,ATP
11,,SING,O2B,HOB2,no,N,11,,148285,27008,ATP
12,,DOUB,PA,O1A,no,N,12,,148285,27008,ATP
13,,SING,PA,O2A,no,N,13,,148285,27008,ATP
14,,SING,PA,O3A,no,N,14,,148285,27008,ATP
15,,SING,PA,O5',no,N,15,,148285,27008,ATP
16,,SING,O2A,HOA2,no,N,16,,148285,27008,ATP
17,,SING,O5',C5',no,N,17,,148285,27008,ATP
18,,SING,C5',C4',no,N,18,,148285,27008,ATP
19,,SING,C5',H5'1,no,N,19,,148285,27008,ATP
20,,SING,C5',H5'2,no,N,20,,148285,27008,ATP
21,,SING,C4',O4',no,N,21,,148285,27008,ATP
22,,SING,C4',C3',no,N,22,,148285,27008,ATP
23,,SING,C4',H4',no,N,23,,148285,27008,ATP
24,,SING,O4',C1',no,N,24,,148285,27008,ATP
25,,SING,C3',O3',no,N,25,,148285,27008,ATP
26,,SING,C3',C2',no,N,26,,148285,27008,ATP
27,,SING,C3',H3',no,N,27,,148285,27008,ATP
28,,SING,O3',HO3',no,N,28,,148285,27008,ATP
29,,SING,C2',O2',no,N,29,,148285,27008,ATP
30,,SING,C2',C1',no,N,30,,148285,27008,ATP
31,,SING,C2',H2',no,N,31,,148285,27008,ATP
32,,SING,O2',HO2',no,N,32,,148285,27008,ATP
33,,SING,C1',N9,no,N,33,,148285,27008,ATP
34,,SING,C1',H1',no,N,34,,148285,27008,ATP
35,,SING,N9,C8,yes,N,35,,148285,27008,ATP
36,,SING,N9,C4,yes,N,36,,148285,27008,ATP
37,,DOUB,C8,N7,yes,N,37,,148285,27008,ATP
38,,SING,C8,H8,no,N,38,,148285,27008,ATP
39,,SING,N7,C5,yes,N,39,,148285,27008,ATP
40,,SING,C5,C6,yes,N,40,,148285,27008,ATP
41,,DOUB,C5,C4,yes,N,41,,148285,27008,ATP
42,,SING,C6,N6,no,N,42,,148285,27008,ATP
43,,DOUB,C6,N1,yes,N,43,,148285,27008,ATP
44,,SING,N6,HN61,no,N,44,,148285,27008,ATP
45,,SING,N6,HN62,no,N,45,,148285,27008,ATP
46,,SING,N1,C2,yes,N,46,,148285,27008,ATP
47,,DOUB,C2,N3,yes,N,47,,148285,27008,ATP
48,,SING,C2,H2,no,N,48,,148285,27008,ATP
49,,SING,N3,C4,yes,N,49,,148285,27008,ATP
1,,DOUB,PA,O1A,no,N,1,,148303,27010,AP5
2,,SING,PA,O2A,no,N,2,,148303,27010,AP5
3,,SING,PA,O3A,no,N,3,,148303,27010,AP5
4,,SING,PA,O5F,no,N,4,,148303,27010,AP5
5,,SING,O2A,HOA2,no,N,5,,148303,27010,AP5
6,,SING,O3A,PB,no,N,6,,148303,27010,AP5
7,,DOUB,PB,O1B,no,N,7,,148303,27010,AP5
8,,SING,PB,O2B,no,N,8,,148303,27010,AP5
9,,SING,PB,O3B,no,N,9,,148303,27010,AP5
10,,SING,O2B,HOB2,no,N,10,,148303,27010,AP5
11,,SING,O3B,PG,no,N,11,,148303,27010,AP5
12,,DOUB,PG,O1G,no,N,12,,148303,27010,AP5
13,,SING,PG,O2G,no,N,13,,148303,27010,AP5
14,,SING,PG,O3G,no,N,14,,148303,27010,AP5
15,,SING,O2G,HOG2,no,N,15,,148303,27010,AP5
16,,SING,O3G,PD,no,N,16,,148303,27010,AP5
17,,DOUB,PD,O1D,no,N,17,,148303,27010,AP5
18,,SING,PD,O2D,no,N,18,,148303,27010,AP5
19,,SING,PD,O3D,no,N,19,,148303,27010,AP5
20,,SING,O2D,HOD2,no,N,20,,148303,27010,AP5
21,,SING,O3D,PE,no,N,21,,148303,27010,AP5
22,,DOUB,PE,O1E,no,N,22,,148303,27010,AP5
23,,SING,PE,O2E,no,N,23,,148303,27010,AP5
24,,SING,PE,O5J,no,N,24,,148303,27010,AP5
25,,SING,O2E,HOE2,no,N,25,,148303,27010,AP5
26,,SING,O5F,C5F,no,N,26,,148303,27010,AP5
27,,SING,C5F,C4F,no,N,27,,148303,27010,AP5
28,,SING,C5F,H51A,no,N,28,,148303,27010,AP5
29,,SING,C5F,H52A,no,N,29,,148303,27010,AP5
30,,SING,C4F,O4F,no,N,30,,148303,27010,AP5
31,,SING,C4F,C3F,no,N,31,,148303,27010,AP5
32,,SING,C4F,H4F,no,N,32,,148303,27010,AP5
33,,SING,O4F,C1F,no,N,33,,148303,27010,AP5
34,,SING,C3F,O3F,no,N,34,,148303,27010,AP5
35,,SING,C3F,C2F,no,N,35,,148303,27010,AP5
36,,SING,C3F,H3F,no,N,36,,148303,27010,AP5
37,,SING,O3F,HO3A,no,N,37,,148303,27010,AP5
38,,SING,C2F,O2F,no,N,38,,148303,27010,AP5
39,,SING,C2F,C1F,no,N,39,,148303,27010,AP5
40,,SING,C2F,H2F,no,N,40,,148303,27010,AP5
8,,SING,C3,C4,,,,,240402,6146,TPL_2
41,,SING,O2F,HO2A,no,N,41,,148303,27010,AP5
42,,SING,C1F,N9A,no,N,42,,148303,27010,AP5
43,,SING,C1F,H1F,no,N,43,,148303,27010,AP5
44,,SING,N9A,C8A,yes,N,44,,148303,27010,AP5
45,,SING,N9A,C4A,yes,N,45,,148303,27010,AP5
46,,DOUB,C8A,N7A,yes,N,46,,148303,27010,AP5
47,,SING,C8A,H8A,no,N,47,,148303,27010,AP5
48,,SING,N7A,C5A,yes,N,48,,148303,27010,AP5
49,,SING,C5A,C6A,yes,N,49,,148303,27010,AP5
50,,DOUB,C5A,C4A,yes,N,50,,148303,27010,AP5
51,,SING,C6A,N6A,no,N,51,,148303,27010,AP5
52,,DOUB,C6A,N1A,yes,N,52,,148303,27010,AP5
53,,SING,N6A,H61A,no,N,53,,148303,27010,AP5
54,,SING,N6A,H62A,no,N,54,,148303,27010,AP5
55,,SING,N1A,C2A,yes,N,55,,148303,27010,AP5
56,,DOUB,C2A,N3A,yes,N,56,,148303,27010,AP5
57,,SING,C2A,H2A,no,N,57,,148303,27010,AP5
58,,SING,N3A,C4A,yes,N,58,,148303,27010,AP5
59,,SING,O5J,C5J,no,N,59,,148303,27010,AP5
60,,SING,C5J,C4J,no,N,60,,148303,27010,AP5
61,,SING,C5J,H51B,no,N,61,,148303,27010,AP5
62,,SING,C5J,H52B,no,N,62,,148303,27010,AP5
63,,SING,C4J,O4J,no,N,63,,148303,27010,AP5
64,,SING,C4J,C3J,no,N,64,,148303,27010,AP5
65,,SING,C4J,H4J,no,N,65,,148303,27010,AP5
66,,SING,O4J,C1J,no,N,66,,148303,27010,AP5
67,,SING,C3J,O3J,no,N,67,,148303,27010,AP5
68,,SING,C3J,C2J,no,N,68,,148303,27010,AP5
69,,SING,C3J,H3J,no,N,69,,148303,27010,AP5
70,,SING,O3J,HO3B,no,N,70,,148303,27010,AP5
71,,SING,C2J,O2J,no,N,71,,148303,27010,AP5
72,,SING,C2J,C1J,no,N,72,,148303,27010,AP5
73,,SING,C2J,H2J,no,N,73,,148303,27010,AP5
74,,SING,O2J,HO2B,no,N,74,,148303,27010,AP5
75,,SING,C1J,N9B,no,N,75,,148303,27010,AP5
76,,SING,C1J,H1J,no,N,76,,148303,27010,AP5
77,,SING,N9B,C8B,yes,N,77,,148303,27010,AP5
78,,SING,N9B,C4B,yes,N,78,,148303,27010,AP5
79,,DOUB,C8B,N7B,yes,N,79,,148303,27010,AP5
80,,SING,C8B,H8B,no,N,80,,148303,27010,AP5
81,,SING,N7B,C5B,yes,N,81,,148303,27010,AP5
82,,SING,C5B,C6B,yes,N,82,,148303,27010,AP5
83,,DOUB,C5B,C4B,yes,N,83,,148303,27010,AP5
84,,SING,C6B,N6B,no,N,84,,148303,27010,AP5
85,,DOUB,C6B,N1B,yes,N,85,,148303,27010,AP5
86,,SING,N6B,H61B,no,N,86,,148303,27010,AP5
87,,SING,N6B,H62B,no,N,87,,148303,27010,AP5
88,,SING,N1B,C2B,yes,N,88,,148303,27010,AP5
89,,DOUB,C2B,N3B,yes,N,89,,148303,27010,AP5
90,,SING,C2B,H2B,no,N,90,,148303,27010,AP5
91,,SING,N3B,C4B,yes,N,91,,148303,27010,AP5
1,,DOUB,PB,O1B,no,N,1,,148489,27022,ADP
2,,SING,PB,O2B,no,N,2,,148489,27022,ADP
3,,SING,PB,O3B,no,N,3,,148489,27022,ADP
4,,SING,PB,O3A,no,N,4,,148489,27022,ADP
5,,SING,O2B,HOB2,no,N,5,,148489,27022,ADP
6,,SING,O3B,HOB3,no,N,6,,148489,27022,ADP
7,,DOUB,PA,O1A,no,N,7,,148489,27022,ADP
8,,SING,PA,O2A,no,N,8,,148489,27022,ADP
9,,SING,PA,O3A,no,N,9,,148489,27022,ADP
10,,SING,PA,O5',no,N,10,,148489,27022,ADP
11,,SING,O2A,HOA2,no,N,11,,148489,27022,ADP
12,,SING,O5',C5',no,N,12,,148489,27022,ADP
13,,SING,C5',C4',no,N,13,,148489,27022,ADP
14,,SING,C5',H5'1,no,N,14,,148489,27022,ADP
15,,SING,C5',H5'2,no,N,15,,148489,27022,ADP
16,,SING,C4',O4',no,N,16,,148489,27022,ADP
17,,SING,C4',C3',no,N,17,,148489,27022,ADP
18,,SING,C4',H4',no,N,18,,148489,27022,ADP
19,,SING,O4',C1',no,N,19,,148489,27022,ADP
20,,SING,C3',O3',no,N,20,,148489,27022,ADP
21,,SING,C3',C2',no,N,21,,148489,27022,ADP
22,,SING,C3',H3',no,N,22,,148489,27022,ADP
23,,SING,O3',HO3',no,N,23,,148489,27022,ADP
24,,SING,C2',O2',no,N,24,,148489,27022,ADP
25,,SING,C2',C1',no,N,25,,148489,27022,ADP
26,,SING,C2',H2',no,N,26,,148489,27022,ADP
27,,SING,O2',HO2',no,N,27,,148489,27022,ADP
28,,SING,C1',N9,no,N,28,,148489,27022,ADP
29,,SING,C1',H1',no,N,29,,148489,27022,ADP
30,,SING,N9,C8,yes,N,30,,148489,27022,ADP
31,,SING,N9,C4,yes,N,31,,148489,27022,ADP
32,,DOUB,C8,N7,yes,N,32,,148489,27022,ADP
33,,SING,C8,H8,no,N,33,,148489,27022,ADP
34,,SING,N7,C5,yes,N,34,,148489,27022,ADP
35,,SING,C5,C6,yes,N,35,,148489,27022,ADP
36,,DOUB,C5,C4,yes,N,36,,148489,27022,ADP
37,,SING,C6,N6,no,N,37,,148489,27022,ADP
38,,DOUB,C6,N1,yes,N,38,,148489,27022,ADP
39,,SING,N6,HN61,no,N,39,,148489,27022,ADP
40,,SING,N6,HN62,no,N,40,,148489,27022,ADP
41,,SING,N1,C2,yes,N,41,,148489,27022,ADP
42,,DOUB,C2,N3,yes,N,42,,148489,27022,ADP
43,,SING,C2,H2,no,N,43,,148489,27022,ADP
44,,SING,N3,C4,yes,N,44,,148489,27022,ADP
1,,DOUB,C1,O1,no,N,1,,148490,27022,3PG
2,,SING,C1,O2,no,N,2,,148490,27022,3PG
3,,SING,C1,C2,no,N,3,,148490,27022,3PG
4,,SING,O2,HO2,no,N,4,,148490,27022,3PG
5,,SING,C2,O3,no,N,5,,148490,27022,3PG
6,,SING,C2,C3,no,N,6,,148490,27022,3PG
7,,SING,C2,H2,no,N,7,,148490,27022,3PG
8,,SING,O3,HO3,no,N,8,,148490,27022,3PG
9,,SING,C3,O1P,no,N,9,,148490,27022,3PG
10,,SING,C3,H31,no,N,10,,148490,27022,3PG
11,,SING,C3,H32,no,N,11,,148490,27022,3PG
12,,SING,O1P,P,no,N,12,,148490,27022,3PG
13,,DOUB,P,O2P,no,N,13,,148490,27022,3PG
14,,SING,P,O3P,no,N,14,,148490,27022,3PG
15,,SING,P,O4P,no,N,15,,148490,27022,3PG
16,,SING,O3P,HOP3,no,N,16,,148490,27022,3PG
17,,SING,O4P,HOP4,no,N,17,,148490,27022,3PG
1,,SING,F1,MG,no,N,1,,148491,27022,MGF
2,,SING,MG,F2,no,N,2,,148491,27022,MGF
3,,SING,MG,F3,no,N,3,,148491,27022,MGF
1,,SING,N,HN1,no,N,1,,149081,27060,NH2
2,,SING,N,HN2,no,N,2,,149081,27060,NH2
1,,DOUB,S1,O1,no,N,1,,149215,27069,MPO
2,,DOUB,S1,O2,no,N,2,,149215,27069,MPO
3,,SING,S1,C1,no,N,3,,149215,27069,MPO
4,,SING,S1,O3,no,N,4,,149215,27069,MPO
5,,SING,O4,C5,no,N,5,,149215,27069,MPO
6,,SING,O4,C6,no,N,6,,149215,27069,MPO
7,,SING,N1,C3,no,N,7,,149215,27069,MPO
8,,SING,N1,C4,no,N,8,,149215,27069,MPO
9,,SING,N1,C7,no,N,9,,149215,27069,MPO
10,,SING,C1,C2,no,N,10,,149215,27069,MPO
11,,SING,C1,H11,no,N,11,,149215,27069,MPO
12,,SING,C1,H12,no,N,12,,149215,27069,MPO
13,,SING,O3,HO3,no,N,13,,149215,27069,MPO
14,,SING,C2,C3,no,N,14,,149215,27069,MPO
15,,SING,C2,H21,no,N,15,,149215,27069,MPO
16,,SING,C2,H22,no,N,16,,149215,27069,MPO
17,,SING,C3,H31,no,N,17,,149215,27069,MPO
18,,SING,C3,H32,no,N,18,,149215,27069,MPO
19,,SING,C4,C5,no,N,19,,149215,27069,MPO
20,,SING,C4,H41,no,N,20,,149215,27069,MPO
21,,SING,C4,H42,no,N,21,,149215,27069,MPO
22,,SING,C5,H51,no,N,22,,149215,27069,MPO
23,,SING,C5,H52,no,N,23,,149215,27069,MPO
24,,SING,C6,C7,no,N,24,,149215,27069,MPO
25,,SING,C6,H61,no,N,25,,149215,27069,MPO
26,,SING,C6,H62,no,N,26,,149215,27069,MPO
27,,SING,C7,H71,no,N,27,,149215,27069,MPO
28,,SING,C7,H72,no,N,28,,149215,27069,MPO
1,,SING,N,CA,no,N,1,,149336,27075,SEP
2,,SING,N,H,no,N,2,,149336,27075,SEP
3,,SING,N,H2,no,N,3,,149336,27075,SEP
4,,SING,CA,CB,no,N,4,,149336,27075,SEP
5,,SING,CA,C,no,N,5,,149336,27075,SEP
6,,SING,CA,HA,no,N,6,,149336,27075,SEP
7,,SING,CB,OG,no,N,7,,149336,27075,SEP
8,,SING,CB,HB2,no,N,8,,149336,27075,SEP
9,,SING,CB,HB3,no,N,9,,149336,27075,SEP
10,,SING,OG,P,no,N,10,,149336,27075,SEP
11,,DOUB,C,O,no,N,11,,149336,27075,SEP
12,,SING,C,OXT,no,N,12,,149336,27075,SEP
13,,SING,OXT,HXT,no,N,13,,149336,27075,SEP
14,,DOUB,P,O1P,no,N,14,,149336,27075,SEP
15,,SING,P,O2P,no,N,15,,149336,27075,SEP
16,,SING,P,O3P,no,N,16,,149336,27075,SEP
17,,SING,O2P,HOP2,no,N,17,,149336,27075,SEP
18,,SING,O3P,HOP3,no,N,18,,149336,27075,SEP
1,,SING,N,CA,no,N,1,,149367,27077,PTR
2,,SING,N,H,no,N,2,,149367,27077,PTR
3,,SING,N,HN2,no,N,3,,149367,27077,PTR
4,,SING,CA,C,no,N,4,,149367,27077,PTR
5,,SING,CA,CB,no,N,5,,149367,27077,PTR
6,,SING,CA,HA,no,N,6,,149367,27077,PTR
7,,DOUB,C,O,no,N,7,,149367,27077,PTR
8,,SING,C,OXT,no,N,8,,149367,27077,PTR
9,,SING,OXT,HXT,no,N,9,,149367,27077,PTR
10,,SING,CB,CG,no,N,10,,149367,27077,PTR
11,,SING,CB,HB2,no,N,11,,149367,27077,PTR
12,,SING,CB,HB3,no,N,12,,149367,27077,PTR
13,,DOUB,CG,CD1,yes,N,13,,149367,27077,PTR
14,,SING,CG,CD2,yes,N,14,,149367,27077,PTR
15,,SING,CD1,CE1,yes,N,15,,149367,27077,PTR
16,,SING,CD1,HD1,no,N,16,,149367,27077,PTR
17,,DOUB,CD2,CE2,yes,N,17,,149367,27077,PTR
18,,SING,CD2,HD2,no,N,18,,149367,27077,PTR
19,,DOUB,CE1,CZ,yes,N,19,,149367,27077,PTR
20,,SING,CE1,HE1,no,N,20,,149367,27077,PTR
21,,SING,CE2,CZ,yes,N,21,,149367,27077,PTR
22,,SING,CE2,HE2,no,N,22,,149367,27077,PTR
23,,SING,CZ,OH,no,N,23,,149367,27077,PTR
24,,SING,OH,P,no,N,24,,149367,27077,PTR
25,,DOUB,P,O1P,no,N,25,,149367,27077,PTR
26,,SING,P,O2P,no,N,26,,149367,27077,PTR
27,,SING,P,O3P,no,N,27,,149367,27077,PTR
28,,SING,O2P,HO2P,no,N,28,,149367,27077,PTR
29,,SING,O3P,HO3P,no,N,29,,149367,27077,PTR
1,,SING,C1,C2,no,N,1,,149493,27083,PD1
2,,SING,C1,H11,no,N,2,,149493,27083,PD1
3,,SING,C1,H12,no,N,3,,149493,27083,PD1
4,,SING,C1,H13A,no,N,4,,149493,27083,PD1
5,,SING,C2,N1,no,N,5,,149493,27083,PD1
6,,SING,C2,H21A,no,N,6,,149493,27083,PD1
7,,SING,C2,H22,no,N,7,,149493,27083,PD1
8,,SING,C3,C4,no,N,8,,149493,27083,PD1
9,,SING,C3,H31,no,N,9,,149493,27083,PD1
10,,SING,C3,H32,no,N,10,,149493,27083,PD1
11,,SING,C3,H33,no,N,11,,149493,27083,PD1
12,,SING,C4,N1,no,N,12,,149493,27083,PD1
13,,SING,C4,H41,no,N,13,,149493,27083,PD1
14,,SING,C4,H42,no,N,14,,149493,27083,PD1
15,,SING,C5,C6,no,N,15,,149493,27083,PD1
16,,SING,C5,N1,no,N,16,,149493,27083,PD1
17,,SING,C5,H51,no,N,17,,149493,27083,PD1
18,,SING,C5,H52,no,N,18,,149493,27083,PD1
19,,SING,C6,C7,no,N,19,,149493,27083,PD1
20,,SING,C6,H61,no,N,20,,149493,27083,PD1
21,,SING,C6,H62,no,N,21,,149493,27083,PD1
22,,SING,C7,C8,no,N,22,,149493,27083,PD1
23,,SING,C7,H71,no,N,23,,149493,27083,PD1
24,,SING,C7,H72,no,N,24,,149493,27083,PD1
25,,SING,C8,N2,no,N,25,,149493,27083,PD1
26,,SING,C8,H81,no,N,26,,149493,27083,PD1
27,,SING,C8,H82,no,N,27,,149493,27083,PD1
28,,SING,C9,N2,no,N,28,,149493,27083,PD1
29,,DOUB,C9,N3,yes,N,29,,149493,27083,PD1
30,,SING,C9,N4,yes,N,30,,149493,27083,PD1
31,,DOUB,C10,C11,yes,N,31,,149493,27083,PD1
32,,SING,C10,N3,yes,N,32,,149493,27083,PD1
33,,SING,C10,H10,no,N,33,,149493,27083,PD1
34,,SING,C11,C12,yes,N,34,,149493,27083,PD1
35,,SING,C11,C13,yes,N,35,,149493,27083,PD1
36,,DOUB,C12,N4,yes,N,36,,149493,27083,PD1
37,,SING,C12,N5,yes,N,37,,149493,27083,PD1
38,,DOUB,C13,C14,yes,N,38,,149493,27083,PD1
39,,SING,C13,H13,no,N,39,,149493,27083,PD1
40,,SING,C14,C15,yes,N,40,,149493,27083,PD1
41,,SING,C14,C16,yes,N,41,,149493,27083,PD1
42,,DOUB,C15,N5,yes,N,42,,149493,27083,PD1
43,,SING,C15,N6,no,N,43,,149493,27083,PD1
44,,DOUB,C16,C17,yes,N,44,,149493,27083,PD1
45,,SING,C16,C21,yes,N,45,,149493,27083,PD1
46,,SING,C17,C18,yes,N,46,,149493,27083,PD1
47,,SING,C17,H17,no,N,47,,149493,27083,PD1
48,,DOUB,C18,C19,yes,N,48,,149493,27083,PD1
49,,SING,C18,O1,no,N,49,,149493,27083,PD1
50,,SING,C19,C20,yes,N,50,,149493,27083,PD1
51,,SING,C19,H19,no,N,51,,149493,27083,PD1
52,,DOUB,C20,C21,yes,N,52,,149493,27083,PD1
53,,SING,C20,O2,no,N,53,,149493,27083,PD1
54,,SING,C21,H21,no,N,54,,149493,27083,PD1
55,,SING,C22,O1,no,N,55,,149493,27083,PD1
56,,SING,C22,H221,no,N,56,,149493,27083,PD1
57,,SING,C22,H222,no,N,57,,149493,27083,PD1
58,,SING,C22,H223,no,N,58,,149493,27083,PD1
59,,SING,C23,O2,no,N,59,,149493,27083,PD1
60,,SING,C23,H231,no,N,60,,149493,27083,PD1
61,,SING,C23,H232,no,N,61,,149493,27083,PD1
62,,SING,C23,H233,no,N,62,,149493,27083,PD1
63,,SING,C24,N6,no,N,63,,149493,27083,PD1
64,,SING,C24,N7,no,N,64,,149493,27083,PD1
65,,DOUB,C24,O3,no,N,65,,149493,27083,PD1
66,,SING,C25,C26,no,N,66,,149493,27083,PD1
67,,SING,C25,C27,no,N,67,,149493,27083,PD1
68,,SING,C25,C28,no,N,68,,149493,27083,PD1
69,,SING,C25,N7,no,N,69,,149493,27083,PD1
70,,SING,C26,H261,no,N,70,,149493,27083,PD1
71,,SING,C26,H262,no,N,71,,149493,27083,PD1
72,,SING,C26,H263,no,N,72,,149493,27083,PD1
73,,SING,C27,H271,no,N,73,,149493,27083,PD1
74,,SING,C27,H272,no,N,74,,149493,27083,PD1
75,,SING,C27,H273,no,N,75,,149493,27083,PD1
76,,SING,C28,H281,no,N,76,,149493,27083,PD1
77,,SING,C28,H282,no,N,77,,149493,27083,PD1
78,,SING,C28,H283,no,N,78,,149493,27083,PD1
79,,SING,N2,HN2,no,N,79,,149493,27083,PD1
80,,SING,N6,HN6,no,N,80,,149493,27083,PD1
81,,SING,N7,HN7,no,N,81,,149493,27083,PD1
1,,DOUB,C,O,no,N,1,,149670,27092,ACE
2,,SING,C,CH3,no,N,2,,149670,27092,ACE
3,,SING,C,H,no,N,3,,149670,27092,ACE
4,,SING,CH3,H1,no,N,4,,149670,27092,ACE
5,,SING,CH3,H2,no,N,5,,149670,27092,ACE
6,,SING,CH3,H3,no,N,6,,149670,27092,ACE
1,,SING,N,HN1,no,N,1,,149671,27092,NH2
2,,SING,N,HN2,no,N,2,,149671,27092,NH2
1,,DOUB,C1,O1,no,N,1,,149934,27112,OLA
2,,SING,C1,O2,no,N,2,,149934,27112,OLA
3,,SING,C1,C2,no,N,3,,149934,27112,OLA
4,,SING,O2,HO2,no,N,4,,149934,27112,OLA
5,,SING,C2,C3,no,N,5,,149934,27112,OLA
6,,SING,C2,H21,no,N,6,,149934,27112,OLA
7,,SING,C2,H22,no,N,7,,149934,27112,OLA
8,,SING,C3,C4,no,N,8,,149934,27112,OLA
9,,SING,C3,H31,no,N,9,,149934,27112,OLA
10,,SING,C3,H32,no,N,10,,149934,27112,OLA
11,,SING,C4,C5,no,N,11,,149934,27112,OLA
12,,SING,C4,H41,no,N,12,,149934,27112,OLA
13,,SING,C4,H42,no,N,13,,149934,27112,OLA
14,,SING,C5,C6,no,N,14,,149934,27112,OLA
15,,SING,C5,H51,no,N,15,,149934,27112,OLA
16,,SING,C5,H52,no,N,16,,149934,27112,OLA
17,,SING,C6,C7,no,N,17,,149934,27112,OLA
18,,SING,C6,H61,no,N,18,,149934,27112,OLA
19,,SING,C6,H62,no,N,19,,149934,27112,OLA
20,,SING,C7,C8,no,N,20,,149934,27112,OLA
21,,SING,C7,H71,no,N,21,,149934,27112,OLA
22,,SING,C7,H72,no,N,22,,149934,27112,OLA
23,,SING,C8,C9,no,N,23,,149934,27112,OLA
24,,SING,C8,H81,no,N,24,,149934,27112,OLA
25,,SING,C8,H82,no,N,25,,149934,27112,OLA
26,,DOUB,C9,C10,no,Z,26,,149934,27112,OLA
27,,SING,C9,H9,no,N,27,,149934,27112,OLA
28,,SING,C10,C11,no,N,28,,149934,27112,OLA
29,,SING,C10,H10,no,N,29,,149934,27112,OLA
30,,SING,C11,C12,no,N,30,,149934,27112,OLA
31,,SING,C11,H111,no,N,31,,149934,27112,OLA
32,,SING,C11,H112,no,N,32,,149934,27112,OLA
33,,SING,C12,C13,no,N,33,,149934,27112,OLA
34,,SING,C12,H121,no,N,34,,149934,27112,OLA
35,,SING,C12,H122,no,N,35,,149934,27112,OLA
36,,SING,C13,C14,no,N,36,,149934,27112,OLA
37,,SING,C13,H131,no,N,37,,149934,27112,OLA
38,,SING,C13,H132,no,N,38,,149934,27112,OLA
39,,SING,C14,C15,no,N,39,,149934,27112,OLA
40,,SING,C14,H141,no,N,40,,149934,27112,OLA
41,,SING,C14,H142,no,N,41,,149934,27112,OLA
42,,SING,C15,C16,no,N,42,,149934,27112,OLA
43,,SING,C15,H151,no,N,43,,149934,27112,OLA
44,,SING,C15,H152,no,N,44,,149934,27112,OLA
45,,SING,C16,C17,no,N,45,,149934,27112,OLA
46,,SING,C16,H161,no,N,46,,149934,27112,OLA
47,,SING,C16,H162,no,N,47,,149934,27112,OLA
48,,SING,C17,C18,no,N,48,,149934,27112,OLA
49,,SING,C17,H171,no,N,49,,149934,27112,OLA
50,,SING,C17,H172,no,N,50,,149934,27112,OLA
51,,SING,C18,H181,no,N,51,,149934,27112,OLA
52,,SING,C18,H182,no,N,52,,149934,27112,OLA
53,,SING,C18,H183,no,N,53,,149934,27112,OLA
1,,DOUB,V,O1,no,N,1,,150022,27122,VO4
2,,SING,V,O2,no,N,2,,150022,27122,VO4
3,,SING,V,O3,no,N,3,,150022,27122,VO4
4,,SING,V,O4,no,N,4,,150022,27122,VO4
1,,SING,C,O,no,N,1,,150246,27136,GCH
2,,SING,C,C1,no,N,2,,150246,27136,GCH
3,,SING,C,C5,no,N,3,,150246,27136,GCH
4,,SING,C,H12,no,N,4,,150246,27136,GCH
5,,SING,O,H1,no,N,5,,150246,27136,GCH
6,,SING,C1,C2,no,N,6,,150246,27136,GCH
7,,SING,C1,H10,no,N,7,,150246,27136,GCH
8,,SING,C1,H11,no,N,8,,150246,27136,GCH
9,,SING,C2,C3,no,N,9,,150246,27136,GCH
10,,SING,C2,C7,no,N,10,,150246,27136,GCH
11,,SING,C2,H9,no,N,11,,150246,27136,GCH
12,,SING,C3,C4,no,N,12,,150246,27136,GCH
13,,SING,C3,C6,no,N,13,,150246,27136,GCH
14,,SING,C3,C10,no,N,14,,150246,27136,GCH
15,,SING,C4,C5,no,N,15,,150246,27136,GCH
16,,SING,C4,H4,no,N,16,,150246,27136,GCH
17,,SING,C4,H5,no,N,17,,150246,27136,GCH
18,,SING,C5,H2,no,N,18,,150246,27136,GCH
19,,SING,C5,H3,no,N,19,,150246,27136,GCH
20,,SING,C6,H6,no,N,20,,150246,27136,GCH
21,,SING,C6,H7,no,N,21,,150246,27136,GCH
22,,SING,C6,H8,no,N,22,,150246,27136,GCH
23,,SING,C7,C8,no,N,23,,150246,27136,GCH
24,,SING,C7,H17,no,N,24,,150246,27136,GCH
25,,SING,C7,H18,no,N,25,,150246,27136,GCH
26,,SING,C8,O1,no,N,26,,150246,27136,GCH
27,,SING,C8,C9,no,N,27,,150246,27136,GCH
28,,SING,C8,H16,no,N,28,,150246,27136,GCH
29,,SING,O1,H13,no,N,29,,150246,27136,GCH
30,,SING,C9,C10,no,N,30,,150246,27136,GCH
31,,SING,C9,C14,no,N,31,,150246,27136,GCH
32,,SING,C9,H15,no,N,32,,150246,27136,GCH
33,,SING,C10,C11,no,N,33,,150246,27136,GCH
34,,SING,C10,H14,no,N,34,,150246,27136,GCH
35,,SING,C11,C12,no,N,35,,150246,27136,GCH
36,,SING,C11,H41,no,N,36,,150246,27136,GCH
37,,SING,C11,H42,no,N,37,,150246,27136,GCH
38,,SING,C12,C13,no,N,38,,150246,27136,GCH
39,,SING,C12,O3,no,N,39,,150246,27136,GCH
40,,SING,C12,H40,no,N,40,,150246,27136,GCH
41,,SING,C13,C14,no,N,41,,150246,27136,GCH
42,,SING,C13,C17,no,N,42,,150246,27136,GCH
43,,SING,C13,C23,no,N,43,,150246,27136,GCH
44,,SING,C14,C15,no,N,44,,150246,27136,GCH
45,,SING,C14,H35,no,N,45,,150246,27136,GCH
46,,SING,C15,C16,no,N,46,,150246,27136,GCH
47,,SING,C15,H33,no,N,47,,150246,27136,GCH
48,,SING,C15,H34,no,N,48,,150246,27136,GCH
49,,SING,C16,C17,no,N,49,,150246,27136,GCH
50,,SING,C16,H31,no,N,50,,150246,27136,GCH
51,,SING,C16,H32,no,N,51,,150246,27136,GCH
52,,SING,C17,C18,no,N,52,,150246,27136,GCH
53,,SING,C17,H30,no,N,53,,150246,27136,GCH
54,,SING,C18,C19,no,N,54,,150246,27136,GCH
55,,SING,C18,C20,no,N,55,,150246,27136,GCH
56,,SING,C18,H29,no,N,56,,150246,27136,GCH
57,,SING,C19,H19,no,N,57,,150246,27136,GCH
58,,SING,C19,H20,no,N,58,,150246,27136,GCH
59,,SING,C19,H21,no,N,59,,150246,27136,GCH
60,,SING,C20,C21,no,N,60,,150246,27136,GCH
61,,SING,C20,H27,no,N,61,,150246,27136,GCH
62,,SING,C20,H28,no,N,62,,150246,27136,GCH
63,,SING,C21,C22,no,N,63,,150246,27136,GCH
64,,SING,C21,H25,no,N,64,,150246,27136,GCH
65,,SING,C21,H26,no,N,65,,150246,27136,GCH
66,,SING,C22,N,no,N,66,,150246,27136,GCH
67,,DOUB,C22,O2,no,N,67,,150246,27136,GCH
68,,SING,N,CA,no,N,68,,150246,27136,GCH
69,,SING,N,H24,no,N,69,,150246,27136,GCH
70,,SING,CA,C24,no,N,70,,150246,27136,GCH
71,,SING,CA,H22,no,N,71,,150246,27136,GCH
72,,SING,CA,H23,no,N,72,,150246,27136,GCH
73,,SING,C23,H36,no,N,73,,150246,27136,GCH
74,,SING,C23,H37,no,N,74,,150246,27136,GCH
75,,SING,C23,H38,no,N,75,,150246,27136,GCH
76,,SING,O3,H39,no,N,76,,150246,27136,GCH
77,,SING,C24,O4,no,N,77,,150246,27136,GCH
78,,DOUB,C24,O5,no,N,78,,150246,27136,GCH
79,,SING,O4,H43,no,N,79,,150246,27136,GCH
1,,SING,F3,C17,no,N,1,,150388,27144,9WP
2,,DOUB,O3,C10,no,N,2,,150388,27144,9WP
3,,SING,C5,C4,no,N,3,,150388,27144,9WP
4,,SING,C5,N2,no,N,4,,150388,27144,9WP
5,,SING,C17,F1,no,N,5,,150388,27144,9WP
6,,SING,C17,C11,no,N,6,,150388,27144,9WP
7,,SING,C17,F2,no,N,7,,150388,27144,9WP
8,,SING,O1,C3,no,N,8,,150388,27144,9WP
9,,DOUB,C12,C11,yes,N,9,,150388,27144,9WP
10,,SING,C12,C13,yes,N,10,,150388,27144,9WP
11,,SING,C11,C16,yes,N,11,,150388,27144,9WP
12,,DOUB,C4,C3,yes,N,12,,150388,27144,9WP
13,,SING,C4,C8,yes,N,13,,150388,27144,9WP
14,,SING,C3,C2,yes,N,14,,150388,27144,9WP
15,,SING,C19,N2,no,N,15,,150388,27144,9WP
16,,SING,C19,C20,no,N,16,,150388,27144,9WP
17,,DOUB,C13,C14,yes,N,17,,150388,27144,9WP
18,,SING,N2,C24,no,N,18,,150388,27144,9WP
19,,SING,C10,C7,no,N,19,,150388,27144,9WP
20,,SING,C10,N1,no,N,20,,150388,27144,9WP
21,,SING,C24,C23,no,N,21,,150388,27144,9WP
22,,SING,C8,C7,yes,N,22,,150388,27144,9WP
23,,DOUB,C8,C9,yes,N,23,,150388,27144,9WP
24,,DOUB,C16,C15,yes,N,24,,150388,27144,9WP
25,,DOUB,C2,C1,yes,N,25,,150388,27144,9WP
26,,SING,C14,C15,yes,N,26,,150388,27144,9WP
27,,SING,C14,N1,no,N,27,,150388,27144,9WP
28,,DOUB,C7,C6,yes,N,28,,150388,27144,9WP
29,,SING,C9,C1,yes,N,29,,150388,27144,9WP
30,,SING,C9,O2,yes,N,30,,150388,27144,9WP
31,,SING,C20,C21,no,N,31,,150388,27144,9WP
32,,SING,C6,O2,yes,N,32,,150388,27144,9WP
33,,SING,C6,C18,no,N,33,,150388,27144,9WP
34,,SING,C23,C22,no,N,34,,150388,27144,9WP
35,,SING,C22,C21,no,N,35,,150388,27144,9WP
36,,SING,C1,H11,no,N,36,,150388,27144,9WP
37,,SING,N1,H17,no,N,37,,150388,27144,9WP
38,,SING,O1,H14,no,N,38,,150388,27144,9WP
39,,SING,C2,H2,no,N,39,,150388,27144,9WP
40,,SING,C5,H51,no,N,40,,150388,27144,9WP
41,,SING,C5,H52,no,N,41,,150388,27144,9WP
42,,SING,C12,H12,no,N,42,,150388,27144,9WP
43,,SING,C13,H13,no,N,43,,150388,27144,9WP
44,,SING,C15,H15,no,N,44,,150388,27144,9WP
45,,SING,C16,H16,no,N,45,,150388,27144,9WP
46,,SING,C18,H54,no,N,46,,150388,27144,9WP
47,,SING,C18,H18,no,N,47,,150388,27144,9WP
48,,SING,C18,H53,no,N,48,,150388,27144,9WP
49,,SING,C19,H19,no,N,49,,150388,27144,9WP
50,,SING,C19,H55,no,N,50,,150388,27144,9WP
51,,SING,C20,H20,no,N,51,,150388,27144,9WP
52,,SING,C20,H56,no,N,52,,150388,27144,9WP
53,,SING,C21,H21,no,N,53,,150388,27144,9WP
54,,SING,C21,H57,no,N,54,,150388,27144,9WP
55,,SING,C22,H58,no,N,55,,150388,27144,9WP
56,,SING,C22,H22,no,N,56,,150388,27144,9WP
57,,SING,C23,H59,no,N,57,,150388,27144,9WP
58,,SING,C23,H23,no,N,58,,150388,27144,9WP
59,,SING,C24,H24,no,N,59,,150388,27144,9WP
60,,SING,C24,H6A,no,N,60,,150388,27144,9WP
1,,SING,P,O6,no,N,1,,150853,27174,B16
2,,SING,P,O1P,no,N,2,,150853,27174,B16
3,,SING,P,O2P,no,N,3,,150853,27174,B16
4,,DOUB,P,O3P,no,N,4,,150853,27174,B16
5,,SING,P',O1,no,N,5,,150853,27174,B16
6,,SING,P',O1X,no,N,6,,150853,27174,B16
7,,DOUB,P',O2X,no,N,7,,150853,27174,B16
8,,SING,P',O3X,no,N,8,,150853,27174,B16
9,,SING,C1,O1,no,N,9,,150853,27174,B16
10,,SING,C1,C2,no,N,10,,150853,27174,B16
11,,SING,C1,O5,no,N,11,,150853,27174,B16
12,,SING,C2,O2,no,N,12,,150853,27174,B16
13,,SING,C2,C3,no,N,13,,150853,27174,B16
14,,SING,C3,O3,no,N,14,,150853,27174,B16
15,,SING,C3,C4,no,N,15,,150853,27174,B16
16,,SING,C4,O4,no,N,16,,150853,27174,B16
17,,SING,C4,C5,no,N,17,,150853,27174,B16
18,,SING,C5,O5,no,N,18,,150853,27174,B16
19,,SING,C5,C6,no,N,19,,150853,27174,B16
20,,SING,C6,O6,no,N,20,,150853,27174,B16
21,,SING,C1,H1,no,N,21,,150853,27174,B16
22,,SING,C2,H2,no,N,22,,150853,27174,B16
23,,SING,O2,HO2,no,N,23,,150853,27174,B16
24,,SING,C3,H3,no,N,24,,150853,27174,B16
25,,SING,O3,HO3,no,N,25,,150853,27174,B16
26,,SING,C4,H4,no,N,26,,150853,27174,B16
27,,SING,O4,HO4,no,N,27,,150853,27174,B16
28,,SING,C5,H5,no,N,28,,150853,27174,B16
29,,SING,C6,H6,no,N,29,,150853,27174,B16
30,,SING,C6,H6A,no,N,30,,150853,27174,B16
31,,SING,O1P,HO1P,no,N,31,,150853,27174,B16
32,,SING,O2P,HO2P,no,N,32,,150853,27174,B16
33,,SING,O1X,HO1X,no,N,33,,150853,27174,B16
34,,SING,O3X,HO3X,no,N,34,,150853,27174,B16
1,,SING,P,O6,no,N,1,,150871,27175,B16
2,,SING,P,O1P,no,N,2,,150871,27175,B16
3,,SING,P,O2P,no,N,3,,150871,27175,B16
4,,DOUB,P,O3P,no,N,4,,150871,27175,B16
5,,SING,P',O1,no,N,5,,150871,27175,B16
6,,SING,P',O1X,no,N,6,,150871,27175,B16
7,,DOUB,P',O2X,no,N,7,,150871,27175,B16
8,,SING,P',O3X,no,N,8,,150871,27175,B16
9,,SING,C1,O1,no,N,9,,150871,27175,B16
10,,SING,C1,C2,no,N,10,,150871,27175,B16
11,,SING,C1,O5,no,N,11,,150871,27175,B16
12,,SING,C2,O2,no,N,12,,150871,27175,B16
13,,SING,C2,C3,no,N,13,,150871,27175,B16
14,,SING,C3,O3,no,N,14,,150871,27175,B16
15,,SING,C3,C4,no,N,15,,150871,27175,B16
16,,SING,C4,O4,no,N,16,,150871,27175,B16
17,,SING,C4,C5,no,N,17,,150871,27175,B16
18,,SING,C5,O5,no,N,18,,150871,27175,B16
19,,SING,C5,C6,no,N,19,,150871,27175,B16
20,,SING,C6,O6,no,N,20,,150871,27175,B16
21,,SING,C1,H1,no,N,21,,150871,27175,B16
22,,SING,C2,H2,no,N,22,,150871,27175,B16
23,,SING,O2,HO2,no,N,23,,150871,27175,B16
24,,SING,C3,H3,no,N,24,,150871,27175,B16
25,,SING,O3,HO3,no,N,25,,150871,27175,B16
26,,SING,C4,H4,no,N,26,,150871,27175,B16
27,,SING,O4,HO4,no,N,27,,150871,27175,B16
28,,SING,C5,H5,no,N,28,,150871,27175,B16
29,,SING,C6,H6,no,N,29,,150871,27175,B16
30,,SING,C6,H6A,no,N,30,,150871,27175,B16
31,,SING,O1P,HO1P,no,N,31,,150871,27175,B16
32,,SING,O2P,HO2P,no,N,32,,150871,27175,B16
33,,SING,O1X,HO1X,no,N,33,,150871,27175,B16
34,,SING,O3X,HO3X,no,N,34,,150871,27175,B16
1,,SING,N,CA,no,N,1,,151450,27214,SEP
2,,SING,N,H,no,N,2,,151450,27214,SEP
3,,SING,N,H2,no,N,3,,151450,27214,SEP
4,,SING,CA,CB,no,N,4,,151450,27214,SEP
5,,SING,CA,C,no,N,5,,151450,27214,SEP
6,,SING,CA,HA,no,N,6,,151450,27214,SEP
7,,SING,CB,OG,no,N,7,,151450,27214,SEP
8,,SING,CB,HB2,no,N,8,,151450,27214,SEP
9,,SING,CB,HB3,no,N,9,,151450,27214,SEP
10,,SING,OG,P,no,N,10,,151450,27214,SEP
11,,DOUB,C,O,no,N,11,,151450,27214,SEP
12,,SING,C,OXT,no,N,12,,151450,27214,SEP
13,,SING,OXT,HXT,no,N,13,,151450,27214,SEP
14,,DOUB,P,O1P,no,N,14,,151450,27214,SEP
15,,SING,P,O2P,no,N,15,,151450,27214,SEP
16,,SING,P,O3P,no,N,16,,151450,27214,SEP
17,,SING,O2P,HOP2,no,N,17,,151450,27214,SEP
18,,SING,O3P,HOP3,no,N,18,,151450,27214,SEP
1,,SING,N1,C2,no,N,1,,151584,27224,FMN
2,,DOUB,N1,C10,no,N,2,,151584,27224,FMN
3,,DOUB,C2,O2,no,N,3,,151584,27224,FMN
4,,SING,C2,N3,no,N,4,,151584,27224,FMN
5,,SING,N3,C4,no,N,5,,151584,27224,FMN
6,,SING,N3,HN3,no,N,6,,151584,27224,FMN
7,,DOUB,C4,O4,no,N,7,,151584,27224,FMN
8,,SING,C4,C4A,no,N,8,,151584,27224,FMN
9,,DOUB,C4A,N5,no,N,9,,151584,27224,FMN
10,,SING,C4A,C10,no,N,10,,151584,27224,FMN
11,,SING,N5,C5A,no,N,11,,151584,27224,FMN
12,,DOUB,C5A,C6,yes,N,12,,151584,27224,FMN
13,,SING,C5A,C9A,yes,N,13,,151584,27224,FMN
14,,SING,C6,C7,yes,N,14,,151584,27224,FMN
15,,SING,C6,H6,no,N,15,,151584,27224,FMN
16,,SING,C7,C7M,no,N,16,,151584,27224,FMN
17,,DOUB,C7,C8,yes,N,17,,151584,27224,FMN
18,,SING,C7M,HM71,no,N,18,,151584,27224,FMN
19,,SING,C7M,HM72,no,N,19,,151584,27224,FMN
20,,SING,C7M,HM73,no,N,20,,151584,27224,FMN
21,,SING,C8,C8M,no,N,21,,151584,27224,FMN
22,,SING,C8,C9,yes,N,22,,151584,27224,FMN
23,,SING,C8M,HM81,no,N,23,,151584,27224,FMN
24,,SING,C8M,HM82,no,N,24,,151584,27224,FMN
25,,SING,C8M,HM83,no,N,25,,151584,27224,FMN
26,,DOUB,C9,C9A,yes,N,26,,151584,27224,FMN
27,,SING,C9,H9,no,N,27,,151584,27224,FMN
28,,SING,C9A,N10,no,N,28,,151584,27224,FMN
29,,SING,N10,C10,no,N,29,,151584,27224,FMN
30,,SING,N10,C1',no,N,30,,151584,27224,FMN
31,,SING,C1',C2',no,N,31,,151584,27224,FMN
32,,SING,C1',H1'1,no,N,32,,151584,27224,FMN
33,,SING,C1',H1'2,no,N,33,,151584,27224,FMN
34,,SING,C2',O2',no,N,34,,151584,27224,FMN
35,,SING,C2',C3',no,N,35,,151584,27224,FMN
36,,SING,C2',H2',no,N,36,,151584,27224,FMN
37,,SING,O2',HO2',no,N,37,,151584,27224,FMN
38,,SING,C3',O3',no,N,38,,151584,27224,FMN
39,,SING,C3',C4',no,N,39,,151584,27224,FMN
40,,SING,C3',H3',no,N,40,,151584,27224,FMN
41,,SING,O3',HO3',no,N,41,,151584,27224,FMN
42,,SING,C4',O4',no,N,42,,151584,27224,FMN
43,,SING,C4',C5',no,N,43,,151584,27224,FMN
44,,SING,C4',H4',no,N,44,,151584,27224,FMN
45,,SING,O4',HO4',no,N,45,,151584,27224,FMN
46,,SING,C5',O5',no,N,46,,151584,27224,FMN
47,,SING,C5',H5'1,no,N,47,,151584,27224,FMN
48,,SING,C5',H5'2,no,N,48,,151584,27224,FMN
49,,SING,O5',P,no,N,49,,151584,27224,FMN
50,,DOUB,P,O1P,no,N,50,,151584,27224,FMN
51,,SING,P,O2P,no,N,51,,151584,27224,FMN
52,,SING,P,O3P,no,N,52,,151584,27224,FMN
53,,SING,O2P,HOP2,no,N,53,,151584,27224,FMN
54,,SING,O3P,HOP3,no,N,54,,151584,27224,FMN
1,,SING,N,CA,no,N,1,,152016,27251,MLZ
2,,SING,N,H,no,N,2,,152016,27251,MLZ
3,,SING,N,H2,no,N,3,,152016,27251,MLZ
4,,SING,CA,CB,no,N,4,,152016,27251,MLZ
5,,SING,CA,C,no,N,5,,152016,27251,MLZ
6,,SING,CA,HA,no,N,6,,152016,27251,MLZ
7,,SING,CB,CG,no,N,7,,152016,27251,MLZ
8,,SING,CB,HB2,no,N,8,,152016,27251,MLZ
9,,SING,CB,HB3,no,N,9,,152016,27251,MLZ
10,,SING,CG,CD,no,N,10,,152016,27251,MLZ
11,,SING,CG,HG2,no,N,11,,152016,27251,MLZ
12,,SING,CG,HG3,no,N,12,,152016,27251,MLZ
13,,SING,CD,CE,no,N,13,,152016,27251,MLZ
14,,SING,CD,HD2,no,N,14,,152016,27251,MLZ
15,,SING,CD,HD3,no,N,15,,152016,27251,MLZ
16,,SING,CE,NZ,no,N,16,,152016,27251,MLZ
17,,SING,CE,HE2,no,N,17,,152016,27251,MLZ
18,,SING,CE,HE3,no,N,18,,152016,27251,MLZ
19,,SING,NZ,CM,no,N,19,,152016,27251,MLZ
20,,SING,NZ,HZ,no,N,20,,152016,27251,MLZ
21,,SING,CM,HCM1,no,N,21,,152016,27251,MLZ
22,,SING,CM,HCM2,no,N,22,,152016,27251,MLZ
23,,SING,CM,HCM3,no,N,23,,152016,27251,MLZ
24,,DOUB,C,O,no,N,24,,152016,27251,MLZ
25,,SING,C,OXT,no,N,25,,152016,27251,MLZ
26,,SING,OXT,HXT,no,N,26,,152016,27251,MLZ
1,,SING,FE,NA,no,N,1,,152049,27254,HEC
2,,SING,FE,NB,no,N,2,,152049,27254,HEC
3,,SING,FE,NC,no,N,3,,152049,27254,HEC
4,,SING,FE,ND,no,N,4,,152049,27254,HEC
5,,DOUB,CHA,C1A,no,N,5,,152049,27254,HEC
6,,SING,CHA,C4D,no,N,6,,152049,27254,HEC
7,,SING,CHA,HHA,no,N,7,,152049,27254,HEC
8,,DOUB,CHB,C4A,no,N,8,,152049,27254,HEC
9,,SING,CHB,C1B,no,N,9,,152049,27254,HEC
10,,SING,CHB,HHB,no,N,10,,152049,27254,HEC
11,,DOUB,CHC,C4B,no,N,11,,152049,27254,HEC
12,,SING,CHC,C1C,no,N,12,,152049,27254,HEC
13,,SING,CHC,HHC,no,N,13,,152049,27254,HEC
14,,DOUB,CHD,C4C,no,N,14,,152049,27254,HEC
15,,SING,CHD,C1D,no,N,15,,152049,27254,HEC
16,,SING,CHD,HHD,no,N,16,,152049,27254,HEC
17,,SING,NA,C1A,yes,N,17,,152049,27254,HEC
18,,SING,NA,C4A,yes,N,18,,152049,27254,HEC
19,,SING,C1A,C2A,yes,N,19,,152049,27254,HEC
20,,DOUB,C2A,C3A,yes,N,20,,152049,27254,HEC
21,,SING,C2A,CAA,no,N,21,,152049,27254,HEC
22,,SING,C3A,C4A,yes,N,22,,152049,27254,HEC
23,,SING,C3A,CMA,no,N,23,,152049,27254,HEC
24,,SING,CMA,HMA1,no,N,24,,152049,27254,HEC
25,,SING,CMA,HMA2,no,N,25,,152049,27254,HEC
26,,SING,CMA,HMA3,no,N,26,,152049,27254,HEC
27,,SING,CAA,CBA,no,N,27,,152049,27254,HEC
28,,SING,CAA,HAA1,no,N,28,,152049,27254,HEC
29,,SING,CAA,HAA2,no,N,29,,152049,27254,HEC
30,,SING,CBA,CGA,no,N,30,,152049,27254,HEC
31,,SING,CBA,HBA1,no,N,31,,152049,27254,HEC
32,,SING,CBA,HBA2,no,N,32,,152049,27254,HEC
33,,DOUB,CGA,O1A,no,N,33,,152049,27254,HEC
34,,SING,CGA,O2A,no,N,34,,152049,27254,HEC
35,,SING,O2A,H2A,no,N,35,,152049,27254,HEC
36,,SING,NB,C1B,yes,N,36,,152049,27254,HEC
37,,SING,NB,C4B,yes,N,37,,152049,27254,HEC
38,,DOUB,C1B,C2B,yes,N,38,,152049,27254,HEC
39,,SING,C2B,C3B,yes,N,39,,152049,27254,HEC
40,,SING,C2B,CMB,no,N,40,,152049,27254,HEC
41,,SING,C3B,C4B,yes,N,41,,152049,27254,HEC
42,,DOUB,C3B,CAB,no,E,42,,152049,27254,HEC
43,,SING,CMB,HMB1,no,N,43,,152049,27254,HEC
44,,SING,CMB,HMB2,no,N,44,,152049,27254,HEC
45,,SING,CMB,HMB3,no,N,45,,152049,27254,HEC
46,,SING,CAB,CBB,no,N,46,,152049,27254,HEC
47,,SING,CAB,HAB,no,N,47,,152049,27254,HEC
48,,SING,CBB,HBB1,no,N,48,,152049,27254,HEC
49,,SING,CBB,HBB2,no,N,49,,152049,27254,HEC
50,,SING,CBB,HBB3,no,N,50,,152049,27254,HEC
51,,SING,NC,C1C,yes,N,51,,152049,27254,HEC
52,,SING,NC,C4C,yes,N,52,,152049,27254,HEC
53,,DOUB,C1C,C2C,yes,N,53,,152049,27254,HEC
54,,SING,C2C,C3C,yes,N,54,,152049,27254,HEC
55,,SING,C2C,CMC,no,N,55,,152049,27254,HEC
56,,SING,C3C,C4C,yes,N,56,,152049,27254,HEC
57,,DOUB,C3C,CAC,no,E,57,,152049,27254,HEC
58,,SING,CMC,HMC1,no,N,58,,152049,27254,HEC
59,,SING,CMC,HMC2,no,N,59,,152049,27254,HEC
60,,SING,CMC,HMC3,no,N,60,,152049,27254,HEC
61,,SING,CAC,CBC,no,N,61,,152049,27254,HEC
62,,SING,CAC,HAC,no,N,62,,152049,27254,HEC
63,,SING,CBC,HBC1,no,N,63,,152049,27254,HEC
64,,SING,CBC,HBC2,no,N,64,,152049,27254,HEC
65,,SING,CBC,HBC3,no,N,65,,152049,27254,HEC
66,,SING,ND,C1D,yes,N,66,,152049,27254,HEC
67,,SING,ND,C4D,yes,N,67,,152049,27254,HEC
68,,DOUB,C1D,C2D,yes,N,68,,152049,27254,HEC
69,,SING,C2D,C3D,yes,N,69,,152049,27254,HEC
70,,SING,C2D,CMD,no,N,70,,152049,27254,HEC
71,,DOUB,C3D,C4D,yes,N,71,,152049,27254,HEC
72,,SING,C3D,CAD,no,N,72,,152049,27254,HEC
73,,SING,CMD,HMD1,no,N,73,,152049,27254,HEC
74,,SING,CMD,HMD2,no,N,74,,152049,27254,HEC
75,,SING,CMD,HMD3,no,N,75,,152049,27254,HEC
76,,SING,CAD,CBD,no,N,76,,152049,27254,HEC
77,,SING,CAD,HAD1,no,N,77,,152049,27254,HEC
78,,SING,CAD,HAD2,no,N,78,,152049,27254,HEC
79,,SING,CBD,CGD,no,N,79,,152049,27254,HEC
80,,SING,CBD,HBD1,no,N,80,,152049,27254,HEC
81,,SING,CBD,HBD2,no,N,81,,152049,27254,HEC
82,,DOUB,CGD,O1D,no,N,82,,152049,27254,HEC
83,,SING,CGD,O2D,no,N,83,,152049,27254,HEC
84,,SING,O2D,H2D,no,N,84,,152049,27254,HEC
1,,SING,C1,C2,no,N,1,,152066,27255,LAT
2,,SING,C1,O1,no,N,2,,152066,27255,LAT
3,,SING,C1,O5,no,N,3,,152066,27255,LAT
4,,SING,C1,H1,no,N,4,,152066,27255,LAT
5,,SING,C2,C3,no,N,5,,152066,27255,LAT
6,,SING,C2,O2,no,N,6,,152066,27255,LAT
7,,SING,C2,H2,no,N,7,,152066,27255,LAT
8,,SING,C3,C4,no,N,8,,152066,27255,LAT
9,,SING,C3,O3,no,N,9,,152066,27255,LAT
10,,SING,C3,H3,no,N,10,,152066,27255,LAT
11,,SING,C4,C5,no,N,11,,152066,27255,LAT
12,,SING,C4,O4,no,N,12,,152066,27255,LAT
13,,SING,C4,H4,no,N,13,,152066,27255,LAT
14,,SING,C5,C6,no,N,14,,152066,27255,LAT
15,,SING,C5,O5,no,N,15,,152066,27255,LAT
16,,SING,C5,H5,no,N,16,,152066,27255,LAT
17,,SING,C6,O6,no,N,17,,152066,27255,LAT
18,,SING,C6,H61,no,N,18,,152066,27255,LAT
19,,SING,C6,H62,no,N,19,,152066,27255,LAT
20,,SING,O1,C4',no,N,20,,152066,27255,LAT
21,,SING,O2,HO2,no,N,21,,152066,27255,LAT
22,,SING,O3,HO3,no,N,22,,152066,27255,LAT
23,,SING,O4,HO4,no,N,23,,152066,27255,LAT
24,,SING,O6,HO6,no,N,24,,152066,27255,LAT
25,,SING,C1',C2',no,N,25,,152066,27255,LAT
26,,SING,C1',O1',no,N,26,,152066,27255,LAT
27,,SING,C1',O5',no,N,27,,152066,27255,LAT
28,,SING,C1',H1',no,N,28,,152066,27255,LAT
29,,SING,C2',C3',no,N,29,,152066,27255,LAT
30,,SING,C2',O2',no,N,30,,152066,27255,LAT
31,,SING,C2',H2',no,N,31,,152066,27255,LAT
32,,SING,C3',C4',no,N,32,,152066,27255,LAT
33,,SING,C3',O3',no,N,33,,152066,27255,LAT
34,,SING,C3',H3',no,N,34,,152066,27255,LAT
35,,SING,C4',C5',no,N,35,,152066,27255,LAT
36,,SING,C4',H4',no,N,36,,152066,27255,LAT
37,,SING,C5',C6',no,N,37,,152066,27255,LAT
38,,SING,C5',O5',no,N,38,,152066,27255,LAT
39,,SING,C5',H5',no,N,39,,152066,27255,LAT
40,,SING,C6',O6',no,N,40,,152066,27255,LAT
41,,SING,C6',H6'1,no,N,41,,152066,27255,LAT
42,,SING,C6',H6'2,no,N,42,,152066,27255,LAT
43,,SING,O1',HO1',no,N,43,,152066,27255,LAT
44,,SING,O2',HO2',no,N,44,,152066,27255,LAT
45,,SING,O3',HO3',no,N,45,,152066,27255,LAT
46,,SING,O6',HO6',no,N,46,,152066,27255,LAT
1,,SING,C1,C2,no,N,1,,152084,27256,LAT
2,,SING,C1,O1,no,N,2,,152084,27256,LAT
3,,SING,C1,O5,no,N,3,,152084,27256,LAT
4,,SING,C1,H1,no,N,4,,152084,27256,LAT
5,,SING,C2,C3,no,N,5,,152084,27256,LAT
6,,SING,C2,O2,no,N,6,,152084,27256,LAT
7,,SING,C2,H2,no,N,7,,152084,27256,LAT
8,,SING,C3,C4,no,N,8,,152084,27256,LAT
9,,SING,C3,O3,no,N,9,,152084,27256,LAT
10,,SING,C3,H3,no,N,10,,152084,27256,LAT
11,,SING,C4,C5,no,N,11,,152084,27256,LAT
12,,SING,C4,O4,no,N,12,,152084,27256,LAT
13,,SING,C4,H4,no,N,13,,152084,27256,LAT
14,,SING,C5,C6,no,N,14,,152084,27256,LAT
15,,SING,C5,O5,no,N,15,,152084,27256,LAT
16,,SING,C5,H5,no,N,16,,152084,27256,LAT
17,,SING,C6,O6,no,N,17,,152084,27256,LAT
18,,SING,C6,H61,no,N,18,,152084,27256,LAT
19,,SING,C6,H62,no,N,19,,152084,27256,LAT
20,,SING,O1,C4',no,N,20,,152084,27256,LAT
21,,SING,O2,HO2,no,N,21,,152084,27256,LAT
22,,SING,O3,HO3,no,N,22,,152084,27256,LAT
23,,SING,O4,HO4,no,N,23,,152084,27256,LAT
24,,SING,O6,HO6,no,N,24,,152084,27256,LAT
25,,SING,C1',C2',no,N,25,,152084,27256,LAT
26,,SING,C1',O1',no,N,26,,152084,27256,LAT
27,,SING,C1',O5',no,N,27,,152084,27256,LAT
28,,SING,C1',H1',no,N,28,,152084,27256,LAT
29,,SING,C2',C3',no,N,29,,152084,27256,LAT
30,,SING,C2',O2',no,N,30,,152084,27256,LAT
31,,SING,C2',H2',no,N,31,,152084,27256,LAT
32,,SING,C3',C4',no,N,32,,152084,27256,LAT
33,,SING,C3',O3',no,N,33,,152084,27256,LAT
34,,SING,C3',H3',no,N,34,,152084,27256,LAT
35,,SING,C4',C5',no,N,35,,152084,27256,LAT
36,,SING,C4',H4',no,N,36,,152084,27256,LAT
37,,SING,C5',C6',no,N,37,,152084,27256,LAT
38,,SING,C5',O5',no,N,38,,152084,27256,LAT
39,,SING,C5',H5',no,N,39,,152084,27256,LAT
40,,SING,C6',O6',no,N,40,,152084,27256,LAT
41,,SING,C6',H6'1,no,N,41,,152084,27256,LAT
42,,SING,C6',H6'2,no,N,42,,152084,27256,LAT
43,,SING,O1',HO1',no,N,43,,152084,27256,LAT
9,,SING,C3,C5,,,,,240402,6146,TPL_2
44,,SING,O2',HO2',no,N,44,,152084,27256,LAT
45,,SING,O3',HO3',no,N,45,,152084,27256,LAT
46,,SING,O6',HO6',no,N,46,,152084,27256,LAT
1,,SING,C1,C2,no,N,1,,152102,27257,LAT
2,,SING,C1,O1,no,N,2,,152102,27257,LAT
3,,SING,C1,O5,no,N,3,,152102,27257,LAT
4,,SING,C1,H1,no,N,4,,152102,27257,LAT
5,,SING,C2,C3,no,N,5,,152102,27257,LAT
6,,SING,C2,O2,no,N,6,,152102,27257,LAT
7,,SING,C2,H2,no,N,7,,152102,27257,LAT
8,,SING,C3,C4,no,N,8,,152102,27257,LAT
9,,SING,C3,O3,no,N,9,,152102,27257,LAT
10,,SING,C3,H3,no,N,10,,152102,27257,LAT
11,,SING,C4,C5,no,N,11,,152102,27257,LAT
12,,SING,C4,O4,no,N,12,,152102,27257,LAT
13,,SING,C4,H4,no,N,13,,152102,27257,LAT
14,,SING,C5,C6,no,N,14,,152102,27257,LAT
15,,SING,C5,O5,no,N,15,,152102,27257,LAT
16,,SING,C5,H5,no,N,16,,152102,27257,LAT
17,,SING,C6,O6,no,N,17,,152102,27257,LAT
18,,SING,C6,H61,no,N,18,,152102,27257,LAT
19,,SING,C6,H62,no,N,19,,152102,27257,LAT
20,,SING,O1,C4',no,N,20,,152102,27257,LAT
21,,SING,O2,HO2,no,N,21,,152102,27257,LAT
22,,SING,O3,HO3,no,N,22,,152102,27257,LAT
23,,SING,O4,HO4,no,N,23,,152102,27257,LAT
24,,SING,O6,HO6,no,N,24,,152102,27257,LAT
25,,SING,C1',C2',no,N,25,,152102,27257,LAT
26,,SING,C1',O1',no,N,26,,152102,27257,LAT
27,,SING,C1',O5',no,N,27,,152102,27257,LAT
28,,SING,C1',H1',no,N,28,,152102,27257,LAT
29,,SING,C2',C3',no,N,29,,152102,27257,LAT
30,,SING,C2',O2',no,N,30,,152102,27257,LAT
31,,SING,C2',H2',no,N,31,,152102,27257,LAT
32,,SING,C3',C4',no,N,32,,152102,27257,LAT
33,,SING,C3',O3',no,N,33,,152102,27257,LAT
34,,SING,C3',H3',no,N,34,,152102,27257,LAT
35,,SING,C4',C5',no,N,35,,152102,27257,LAT
36,,SING,C4',H4',no,N,36,,152102,27257,LAT
37,,SING,C5',C6',no,N,37,,152102,27257,LAT
38,,SING,C5',O5',no,N,38,,152102,27257,LAT
39,,SING,C5',H5',no,N,39,,152102,27257,LAT
40,,SING,C6',O6',no,N,40,,152102,27257,LAT
41,,SING,C6',H6'1,no,N,41,,152102,27257,LAT
42,,SING,C6',H6'2,no,N,42,,152102,27257,LAT
43,,SING,O1',HO1',no,N,43,,152102,27257,LAT
44,,SING,O2',HO2',no,N,44,,152102,27257,LAT
45,,SING,O3',HO3',no,N,45,,152102,27257,LAT
46,,SING,O6',HO6',no,N,46,,152102,27257,LAT
1,,SING,C1,C2,no,N,1,,152120,27258,LAT
2,,SING,C1,O1,no,N,2,,152120,27258,LAT
3,,SING,C1,O5,no,N,3,,152120,27258,LAT
4,,SING,C1,H1,no,N,4,,152120,27258,LAT
5,,SING,C2,C3,no,N,5,,152120,27258,LAT
6,,SING,C2,O2,no,N,6,,152120,27258,LAT
7,,SING,C2,H2,no,N,7,,152120,27258,LAT
8,,SING,C3,C4,no,N,8,,152120,27258,LAT
9,,SING,C3,O3,no,N,9,,152120,27258,LAT
10,,SING,C3,H3,no,N,10,,152120,27258,LAT
11,,SING,C4,C5,no,N,11,,152120,27258,LAT
12,,SING,C4,O4,no,N,12,,152120,27258,LAT
13,,SING,C4,H4,no,N,13,,152120,27258,LAT
14,,SING,C5,C6,no,N,14,,152120,27258,LAT
15,,SING,C5,O5,no,N,15,,152120,27258,LAT
16,,SING,C5,H5,no,N,16,,152120,27258,LAT
17,,SING,C6,O6,no,N,17,,152120,27258,LAT
18,,SING,C6,H61,no,N,18,,152120,27258,LAT
19,,SING,C6,H62,no,N,19,,152120,27258,LAT
20,,SING,O1,C4',no,N,20,,152120,27258,LAT
21,,SING,O2,HO2,no,N,21,,152120,27258,LAT
22,,SING,O3,HO3,no,N,22,,152120,27258,LAT
23,,SING,O4,HO4,no,N,23,,152120,27258,LAT
24,,SING,O6,HO6,no,N,24,,152120,27258,LAT
25,,SING,C1',C2',no,N,25,,152120,27258,LAT
26,,SING,C1',O1',no,N,26,,152120,27258,LAT
27,,SING,C1',O5',no,N,27,,152120,27258,LAT
28,,SING,C1',H1',no,N,28,,152120,27258,LAT
29,,SING,C2',C3',no,N,29,,152120,27258,LAT
30,,SING,C2',O2',no,N,30,,152120,27258,LAT
31,,SING,C2',H2',no,N,31,,152120,27258,LAT
32,,SING,C3',C4',no,N,32,,152120,27258,LAT
33,,SING,C3',O3',no,N,33,,152120,27258,LAT
34,,SING,C3',H3',no,N,34,,152120,27258,LAT
35,,SING,C4',C5',no,N,35,,152120,27258,LAT
36,,SING,C4',H4',no,N,36,,152120,27258,LAT
37,,SING,C5',C6',no,N,37,,152120,27258,LAT
38,,SING,C5',O5',no,N,38,,152120,27258,LAT
39,,SING,C5',H5',no,N,39,,152120,27258,LAT
40,,SING,C6',O6',no,N,40,,152120,27258,LAT
41,,SING,C6',H6'1,no,N,41,,152120,27258,LAT
42,,SING,C6',H6'2,no,N,42,,152120,27258,LAT
43,,SING,O1',HO1',no,N,43,,152120,27258,LAT
44,,SING,O2',HO2',no,N,44,,152120,27258,LAT
45,,SING,O3',HO3',no,N,45,,152120,27258,LAT
46,,SING,O6',HO6',no,N,46,,152120,27258,LAT
1,,DOUB,C7,C1,yes,N,1,,152169,27261,ZMA
2,,SING,C1,C2,yes,N,2,,152169,27261,ZMA
3,,SING,C1,H1,no,N,3,,152169,27261,ZMA
4,,DOUB,C2,C3,yes,N,4,,152169,27261,ZMA
5,,SING,C2,H2,no,N,5,,152169,27261,ZMA
6,,SING,C5,C3,yes,N,6,,152169,27261,ZMA
7,,SING,C3,O4,no,N,7,,152169,27261,ZMA
8,,SING,O4,HO4,no,N,8,,152169,27261,ZMA
9,,DOUB,C6,C5,yes,N,9,,152169,27261,ZMA
10,,SING,C5,H5,no,N,10,,152169,27261,ZMA
11,,SING,C7,C6,yes,N,11,,152169,27261,ZMA
12,,SING,C6,H6,no,N,12,,152169,27261,ZMA
13,,SING,C8,C7,no,N,13,,152169,27261,ZMA
14,,SING,C9,C8,no,N,14,,152169,27261,ZMA
15,,SING,C8,H8,no,N,15,,152169,27261,ZMA
16,,SING,C8,H8A,no,N,16,,152169,27261,ZMA
17,,SING,N10,C9,no,N,17,,152169,27261,ZMA
18,,SING,C9,H9,no,N,18,,152169,27261,ZMA
19,,SING,C9,H9A,no,N,19,,152169,27261,ZMA
20,,SING,C11,N10,no,N,20,,152169,27261,ZMA
21,,SING,N10,HN10,no,N,21,,152169,27261,ZMA
22,,DOUB,N12,C11,yes,N,22,,152169,27261,ZMA
23,,SING,C11,N13,yes,N,23,,152169,27261,ZMA
24,,SING,C18,N12,yes,N,24,,152169,27261,ZMA
25,,DOUB,C14,N13,yes,N,25,,152169,27261,ZMA
26,,SING,N16,C14,yes,N,26,,152169,27261,ZMA
27,,SING,C14,N15,no,N,27,,152169,27261,ZMA
28,,SING,N15,HN15,no,N,28,,152169,27261,ZMA
29,,SING,N15,HN1A,no,N,29,,152169,27261,ZMA
30,,SING,N17,N16,yes,N,30,,152169,27261,ZMA
31,,SING,C18,N16,yes,N,31,,152169,27261,ZMA
32,,DOUB,C20,N17,yes,N,32,,152169,27261,ZMA
33,,DOUB,N19,C18,yes,N,33,,152169,27261,ZMA
34,,SING,C20,N19,yes,N,34,,152169,27261,ZMA
35,,SING,C21,C20,yes,N,35,,152169,27261,ZMA
36,,DOUB,C22,C21,yes,N,36,,152169,27261,ZMA
37,,SING,O25,C21,yes,N,37,,152169,27261,ZMA
38,,SING,C23,C22,yes,N,38,,152169,27261,ZMA
39,,SING,C22,H22,no,N,39,,152169,27261,ZMA
40,,DOUB,C23,C24,yes,N,40,,152169,27261,ZMA
41,,SING,C23,H23,no,N,41,,152169,27261,ZMA
42,,SING,C24,O25,yes,N,42,,152169,27261,ZMA
43,,SING,C24,H24,no,N,43,,152169,27261,ZMA
1,,SING,N,CA,no,N,1,,152315,27270,SEP
2,,SING,N,H,no,N,2,,152315,27270,SEP
3,,SING,N,H2,no,N,3,,152315,27270,SEP
4,,SING,CA,CB,no,N,4,,152315,27270,SEP
5,,SING,CA,C,no,N,5,,152315,27270,SEP
6,,SING,CA,HA,no,N,6,,152315,27270,SEP
7,,SING,CB,OG,no,N,7,,152315,27270,SEP
8,,SING,CB,HB2,no,N,8,,152315,27270,SEP
9,,SING,CB,HB3,no,N,9,,152315,27270,SEP
10,,SING,OG,P,no,N,10,,152315,27270,SEP
11,,DOUB,C,O,no,N,11,,152315,27270,SEP
12,,SING,C,OXT,no,N,12,,152315,27270,SEP
13,,SING,OXT,HXT,no,N,13,,152315,27270,SEP
14,,DOUB,P,O1P,no,N,14,,152315,27270,SEP
15,,SING,P,O2P,no,N,15,,152315,27270,SEP
16,,SING,P,O3P,no,N,16,,152315,27270,SEP
17,,SING,O2P,HOP2,no,N,17,,152315,27270,SEP
18,,SING,O3P,HOP3,no,N,18,,152315,27270,SEP
1,,SING,N,CA,no,N,1,,152371,27273,TPO
2,,SING,N,H,no,N,2,,152371,27273,TPO
3,,SING,N,H2,no,N,3,,152371,27273,TPO
4,,SING,CA,CB,no,N,4,,152371,27273,TPO
5,,SING,CA,C,no,N,5,,152371,27273,TPO
6,,SING,CA,HA,no,N,6,,152371,27273,TPO
7,,SING,CB,CG2,no,N,7,,152371,27273,TPO
8,,SING,CB,OG1,no,N,8,,152371,27273,TPO
9,,SING,CB,HB,no,N,9,,152371,27273,TPO
10,,SING,CG2,HG21,no,N,10,,152371,27273,TPO
11,,SING,CG2,HG22,no,N,11,,152371,27273,TPO
12,,SING,CG2,HG23,no,N,12,,152371,27273,TPO
13,,SING,OG1,P,no,N,13,,152371,27273,TPO
14,,DOUB,P,O1P,no,N,14,,152371,27273,TPO
15,,SING,P,O2P,no,N,15,,152371,27273,TPO
16,,SING,P,O3P,no,N,16,,152371,27273,TPO
17,,SING,O2P,HOP2,no,N,17,,152371,27273,TPO
18,,SING,O3P,HOP3,no,N,18,,152371,27273,TPO
19,,DOUB,C,O,no,N,19,,152371,27273,TPO
20,,SING,C,OXT,no,N,20,,152371,27273,TPO
21,,SING,OXT,HXT,no,N,21,,152371,27273,TPO
1,,SING,N,CA,no,N,1,,152372,27273,PTR
2,,SING,N,H,no,N,2,,152372,27273,PTR
3,,SING,N,HN2,no,N,3,,152372,27273,PTR
4,,SING,CA,C,no,N,4,,152372,27273,PTR
5,,SING,CA,CB,no,N,5,,152372,27273,PTR
6,,SING,CA,HA,no,N,6,,152372,27273,PTR
7,,DOUB,C,O,no,N,7,,152372,27273,PTR
8,,SING,C,OXT,no,N,8,,152372,27273,PTR
9,,SING,OXT,HXT,no,N,9,,152372,27273,PTR
10,,SING,CB,CG,no,N,10,,152372,27273,PTR
11,,SING,CB,HB2,no,N,11,,152372,27273,PTR
12,,SING,CB,HB3,no,N,12,,152372,27273,PTR
13,,DOUB,CG,CD1,yes,N,13,,152372,27273,PTR
14,,SING,CG,CD2,yes,N,14,,152372,27273,PTR
15,,SING,CD1,CE1,yes,N,15,,152372,27273,PTR
16,,SING,CD1,HD1,no,N,16,,152372,27273,PTR
17,,DOUB,CD2,CE2,yes,N,17,,152372,27273,PTR
18,,SING,CD2,HD2,no,N,18,,152372,27273,PTR
19,,DOUB,CE1,CZ,yes,N,19,,152372,27273,PTR
20,,SING,CE1,HE1,no,N,20,,152372,27273,PTR
21,,SING,CE2,CZ,yes,N,21,,152372,27273,PTR
22,,SING,CE2,HE2,no,N,22,,152372,27273,PTR
23,,SING,CZ,OH,no,N,23,,152372,27273,PTR
24,,SING,OH,P,no,N,24,,152372,27273,PTR
25,,DOUB,P,O1P,no,N,25,,152372,27273,PTR
26,,SING,P,O2P,no,N,26,,152372,27273,PTR
27,,SING,P,O3P,no,N,27,,152372,27273,PTR
28,,SING,O2P,HO2P,no,N,28,,152372,27273,PTR
29,,SING,O3P,HO3P,no,N,29,,152372,27273,PTR
1,,SING,N,CA,no,N,1,,152389,27274,TPO
2,,SING,N,H,no,N,2,,152389,27274,TPO
3,,SING,N,H2,no,N,3,,152389,27274,TPO
4,,SING,CA,CB,no,N,4,,152389,27274,TPO
5,,SING,CA,C,no,N,5,,152389,27274,TPO
6,,SING,CA,HA,no,N,6,,152389,27274,TPO
7,,SING,CB,CG2,no,N,7,,152389,27274,TPO
8,,SING,CB,OG1,no,N,8,,152389,27274,TPO
9,,SING,CB,HB,no,N,9,,152389,27274,TPO
10,,SING,CG2,HG21,no,N,10,,152389,27274,TPO
11,,SING,CG2,HG22,no,N,11,,152389,27274,TPO
12,,SING,CG2,HG23,no,N,12,,152389,27274,TPO
13,,SING,OG1,P,no,N,13,,152389,27274,TPO
14,,DOUB,P,O1P,no,N,14,,152389,27274,TPO
15,,SING,P,O2P,no,N,15,,152389,27274,TPO
16,,SING,P,O3P,no,N,16,,152389,27274,TPO
17,,SING,O2P,HOP2,no,N,17,,152389,27274,TPO
18,,SING,O3P,HOP3,no,N,18,,152389,27274,TPO
19,,DOUB,C,O,no,N,19,,152389,27274,TPO
20,,SING,C,OXT,no,N,20,,152389,27274,TPO
21,,SING,OXT,HXT,no,N,21,,152389,27274,TPO
1,,SING,N,CA,no,N,1,,152390,27274,PTR
2,,SING,N,H,no,N,2,,152390,27274,PTR
3,,SING,N,HN2,no,N,3,,152390,27274,PTR
4,,SING,CA,C,no,N,4,,152390,27274,PTR
5,,SING,CA,CB,no,N,5,,152390,27274,PTR
6,,SING,CA,HA,no,N,6,,152390,27274,PTR
7,,DOUB,C,O,no,N,7,,152390,27274,PTR
8,,SING,C,OXT,no,N,8,,152390,27274,PTR
9,,SING,OXT,HXT,no,N,9,,152390,27274,PTR
10,,SING,CB,CG,no,N,10,,152390,27274,PTR
11,,SING,CB,HB2,no,N,11,,152390,27274,PTR
12,,SING,CB,HB3,no,N,12,,152390,27274,PTR
13,,DOUB,CG,CD1,yes,N,13,,152390,27274,PTR
14,,SING,CG,CD2,yes,N,14,,152390,27274,PTR
15,,SING,CD1,CE1,yes,N,15,,152390,27274,PTR
16,,SING,CD1,HD1,no,N,16,,152390,27274,PTR
17,,DOUB,CD2,CE2,yes,N,17,,152390,27274,PTR
18,,SING,CD2,HD2,no,N,18,,152390,27274,PTR
19,,DOUB,CE1,CZ,yes,N,19,,152390,27274,PTR
20,,SING,CE1,HE1,no,N,20,,152390,27274,PTR
21,,SING,CE2,CZ,yes,N,21,,152390,27274,PTR
22,,SING,CE2,HE2,no,N,22,,152390,27274,PTR
23,,SING,CZ,OH,no,N,23,,152390,27274,PTR
24,,SING,OH,P,no,N,24,,152390,27274,PTR
25,,DOUB,P,O1P,no,N,25,,152390,27274,PTR
26,,SING,P,O2P,no,N,26,,152390,27274,PTR
27,,SING,P,O3P,no,N,27,,152390,27274,PTR
28,,SING,O2P,HO2P,no,N,28,,152390,27274,PTR
29,,SING,O3P,HO3P,no,N,29,,152390,27274,PTR
1,,SING,CHA,C1A,no,N,1,,152548,27284,HEM
2,,DOUB,CHA,C4D,no,N,2,,152548,27284,HEM
3,,SING,CHA,HHA,no,N,3,,152548,27284,HEM
4,,SING,CHB,C4A,no,N,4,,152548,27284,HEM
5,,DOUB,CHB,C1B,no,N,5,,152548,27284,HEM
6,,SING,CHB,HHB,no,N,6,,152548,27284,HEM
7,,SING,CHC,C4B,no,N,7,,152548,27284,HEM
8,,DOUB,CHC,C1C,no,N,8,,152548,27284,HEM
9,,SING,CHC,HHC,no,N,9,,152548,27284,HEM
10,,DOUB,CHD,C4C,no,N,10,,152548,27284,HEM
11,,SING,CHD,C1D,no,N,11,,152548,27284,HEM
12,,SING,CHD,HHD,no,N,12,,152548,27284,HEM
13,,DOUB,C1A,C2A,yes,N,13,,152548,27284,HEM
14,,SING,C1A,NA,yes,N,14,,152548,27284,HEM
15,,SING,C2A,C3A,yes,N,15,,152548,27284,HEM
16,,SING,C2A,CAA,no,N,16,,152548,27284,HEM
17,,DOUB,C3A,C4A,yes,N,17,,152548,27284,HEM
18,,SING,C3A,CMA,no,N,18,,152548,27284,HEM
19,,SING,C4A,NA,yes,N,19,,152548,27284,HEM
20,,SING,CMA,HMA,no,N,20,,152548,27284,HEM
21,,SING,CMA,HMAA,no,N,21,,152548,27284,HEM
22,,SING,CMA,HMAB,no,N,22,,152548,27284,HEM
23,,SING,CAA,CBA,no,N,23,,152548,27284,HEM
24,,SING,CAA,HAA,no,N,24,,152548,27284,HEM
25,,SING,CAA,HAAA,no,N,25,,152548,27284,HEM
26,,SING,CBA,CGA,no,N,26,,152548,27284,HEM
27,,SING,CBA,HBA,no,N,27,,152548,27284,HEM
28,,SING,CBA,HBAA,no,N,28,,152548,27284,HEM
29,,DOUB,CGA,O1A,no,N,29,,152548,27284,HEM
30,,SING,CGA,O2A,no,N,30,,152548,27284,HEM
31,,SING,C1B,C2B,no,N,31,,152548,27284,HEM
32,,SING,C1B,NB,no,N,32,,152548,27284,HEM
33,,DOUB,C2B,C3B,no,N,33,,152548,27284,HEM
34,,SING,C2B,CMB,no,N,34,,152548,27284,HEM
35,,SING,C3B,C4B,no,N,35,,152548,27284,HEM
36,,SING,C3B,CAB,no,N,36,,152548,27284,HEM
37,,DOUB,C4B,NB,no,N,37,,152548,27284,HEM
38,,SING,CMB,HMB,no,N,38,,152548,27284,HEM
39,,SING,CMB,HMBA,no,N,39,,152548,27284,HEM
40,,SING,CMB,HMBB,no,N,40,,152548,27284,HEM
41,,DOUB,CAB,CBB,no,N,41,,152548,27284,HEM
42,,SING,CAB,HAB,no,N,42,,152548,27284,HEM
43,,SING,CBB,HBB,no,N,43,,152548,27284,HEM
44,,SING,CBB,HBBA,no,N,44,,152548,27284,HEM
45,,SING,C1C,C2C,yes,N,45,,152548,27284,HEM
46,,SING,C1C,NC,yes,N,46,,152548,27284,HEM
47,,DOUB,C2C,C3C,yes,N,47,,152548,27284,HEM
48,,SING,C2C,CMC,no,N,48,,152548,27284,HEM
49,,SING,C3C,C4C,yes,N,49,,152548,27284,HEM
50,,SING,C3C,CAC,no,N,50,,152548,27284,HEM
51,,SING,C4C,NC,yes,N,51,,152548,27284,HEM
52,,SING,CMC,HMC,no,N,52,,152548,27284,HEM
53,,SING,CMC,HMCA,no,N,53,,152548,27284,HEM
54,,SING,CMC,HMCB,no,N,54,,152548,27284,HEM
55,,DOUB,CAC,CBC,no,N,55,,152548,27284,HEM
56,,SING,CAC,HAC,no,N,56,,152548,27284,HEM
57,,SING,CBC,HBC,no,N,57,,152548,27284,HEM
58,,SING,CBC,HBCA,no,N,58,,152548,27284,HEM
59,,SING,C1D,C2D,no,N,59,,152548,27284,HEM
60,,DOUB,C1D,ND,no,N,60,,152548,27284,HEM
61,,DOUB,C2D,C3D,no,N,61,,152548,27284,HEM
62,,SING,C2D,CMD,no,N,62,,152548,27284,HEM
63,,SING,C3D,C4D,no,N,63,,152548,27284,HEM
64,,SING,C3D,CAD,no,N,64,,152548,27284,HEM
65,,SING,C4D,ND,no,N,65,,152548,27284,HEM
66,,SING,CMD,HMD,no,N,66,,152548,27284,HEM
67,,SING,CMD,HMDA,no,N,67,,152548,27284,HEM
68,,SING,CMD,HMDB,no,N,68,,152548,27284,HEM
69,,SING,CAD,CBD,no,N,69,,152548,27284,HEM
70,,SING,CAD,HAD,no,N,70,,152548,27284,HEM
71,,SING,CAD,HADA,no,N,71,,152548,27284,HEM
72,,SING,CBD,CGD,no,N,72,,152548,27284,HEM
73,,SING,CBD,HBD,no,N,73,,152548,27284,HEM
74,,SING,CBD,HBDA,no,N,74,,152548,27284,HEM
75,,DOUB,CGD,O1D,no,N,75,,152548,27284,HEM
76,,SING,CGD,O2D,no,N,76,,152548,27284,HEM
77,,SING,O2A,H2A,no,N,77,,152548,27284,HEM
78,,SING,O2D,H2D,no,N,78,,152548,27284,HEM
79,,SING,FE,NA,no,N,79,,152548,27284,HEM
80,,SING,FE,NB,no,N,80,,152548,27284,HEM
81,,SING,FE,NC,no,N,81,,152548,27284,HEM
82,,SING,FE,ND,no,N,82,,152548,27284,HEM
1,,TRIP,C,O,no,N,1,,152549,27284,CMO
1,,SING,CAI,CAG,no,N,1,,152691,27293,5FW
2,,SING,CAG,CAJ,no,N,2,,152691,27293,5FW
3,,SING,CAG,NAD,no,N,3,,152691,27293,5FW
4,,SING,NAD,CAF,no,N,4,,152691,27293,5FW
5,,SING,CAF,CAE,no,N,5,,152691,27293,5FW
6,,SING,CAE,OAA,no,N,6,,152691,27293,5FW
7,,SING,CAE,CAH,no,N,7,,152691,27293,5FW
8,,SING,CAH,CAK,yes,N,8,,152691,27293,5FW
9,,DOUB,CAH,CAL,yes,N,9,,152691,27293,5FW
10,,DOUB,CAK,CAM,yes,N,10,,152691,27293,5FW
11,,SING,CAL,CAN,yes,N,11,,152691,27293,5FW
12,,DOUB,CAN,CAO,yes,N,12,,152691,27293,5FW
13,,SING,CAO,OAC,no,N,13,,152691,27293,5FW
14,,SING,CAO,CAM,yes,N,14,,152691,27293,5FW
15,,SING,CAM,OAB,no,N,15,,152691,27293,5FW
16,,SING,CAI,HAI1,no,N,16,,152691,27293,5FW
17,,SING,CAI,HAI2,no,N,17,,152691,27293,5FW
18,,SING,CAI,HAI3,no,N,18,,152691,27293,5FW
19,,SING,CAG,HAG,no,N,19,,152691,27293,5FW
20,,SING,CAJ,HAJ1,no,N,20,,152691,27293,5FW
21,,SING,CAJ,HAJ2,no,N,21,,152691,27293,5FW
22,,SING,CAJ,HAJ3,no,N,22,,152691,27293,5FW
23,,SING,NAD,HAD,no,N,23,,152691,27293,5FW
24,,SING,CAF,HAF1,no,N,24,,152691,27293,5FW
25,,SING,CAF,HAF2,no,N,25,,152691,27293,5FW
26,,SING,CAE,HAE,no,N,26,,152691,27293,5FW
27,,SING,OAA,HAA,no,N,27,,152691,27293,5FW
28,,SING,CAK,HAK,no,N,28,,152691,27293,5FW
29,,SING,CAL,HAL,no,N,29,,152691,27293,5FW
30,,SING,CAN,HAN,no,N,30,,152691,27293,5FW
31,,SING,OAC,HAC,no,N,31,,152691,27293,5FW
32,,SING,OAB,HAB,no,N,32,,152691,27293,5FW
1,,SING,CAI,CAG,no,N,1,,152723,27295,5FW
2,,SING,CAG,CAJ,no,N,2,,152723,27295,5FW
3,,SING,CAG,NAD,no,N,3,,152723,27295,5FW
4,,SING,NAD,CAF,no,N,4,,152723,27295,5FW
5,,SING,CAF,CAE,no,N,5,,152723,27295,5FW
6,,SING,CAE,OAA,no,N,6,,152723,27295,5FW
7,,SING,CAE,CAH,no,N,7,,152723,27295,5FW
8,,SING,CAH,CAK,yes,N,8,,152723,27295,5FW
9,,DOUB,CAH,CAL,yes,N,9,,152723,27295,5FW
10,,DOUB,CAK,CAM,yes,N,10,,152723,27295,5FW
11,,SING,CAL,CAN,yes,N,11,,152723,27295,5FW
12,,DOUB,CAN,CAO,yes,N,12,,152723,27295,5FW
13,,SING,CAO,OAC,no,N,13,,152723,27295,5FW
14,,SING,CAO,CAM,yes,N,14,,152723,27295,5FW
15,,SING,CAM,OAB,no,N,15,,152723,27295,5FW
16,,SING,CAI,HAI1,no,N,16,,152723,27295,5FW
17,,SING,CAI,HAI2,no,N,17,,152723,27295,5FW
18,,SING,CAI,HAI3,no,N,18,,152723,27295,5FW
19,,SING,CAG,HAG,no,N,19,,152723,27295,5FW
20,,SING,CAJ,HAJ1,no,N,20,,152723,27295,5FW
21,,SING,CAJ,HAJ2,no,N,21,,152723,27295,5FW
22,,SING,CAJ,HAJ3,no,N,22,,152723,27295,5FW
23,,SING,NAD,HAD,no,N,23,,152723,27295,5FW
24,,SING,CAF,HAF1,no,N,24,,152723,27295,5FW
25,,SING,CAF,HAF2,no,N,25,,152723,27295,5FW
26,,SING,CAE,HAE,no,N,26,,152723,27295,5FW
27,,SING,OAA,HAA,no,N,27,,152723,27295,5FW
28,,SING,CAK,HAK,no,N,28,,152723,27295,5FW
29,,SING,CAL,HAL,no,N,29,,152723,27295,5FW
30,,SING,CAN,HAN,no,N,30,,152723,27295,5FW
31,,SING,OAC,HAC,no,N,31,,152723,27295,5FW
32,,SING,OAB,HAB,no,N,32,,152723,27295,5FW
1,,SING,CAI,CAG,no,N,1,,152757,27297,5FW
2,,SING,CAG,CAJ,no,N,2,,152757,27297,5FW
3,,SING,CAG,NAD,no,N,3,,152757,27297,5FW
4,,SING,NAD,CAF,no,N,4,,152757,27297,5FW
5,,SING,CAF,CAE,no,N,5,,152757,27297,5FW
6,,SING,CAE,OAA,no,N,6,,152757,27297,5FW
7,,SING,CAE,CAH,no,N,7,,152757,27297,5FW
8,,SING,CAH,CAK,yes,N,8,,152757,27297,5FW
9,,DOUB,CAH,CAL,yes,N,9,,152757,27297,5FW
10,,DOUB,CAK,CAM,yes,N,10,,152757,27297,5FW
11,,SING,CAL,CAN,yes,N,11,,152757,27297,5FW
12,,DOUB,CAN,CAO,yes,N,12,,152757,27297,5FW
13,,SING,CAO,OAC,no,N,13,,152757,27297,5FW
14,,SING,CAO,CAM,yes,N,14,,152757,27297,5FW
15,,SING,CAM,OAB,no,N,15,,152757,27297,5FW
16,,SING,CAI,HAI1,no,N,16,,152757,27297,5FW
17,,SING,CAI,HAI2,no,N,17,,152757,27297,5FW
18,,SING,CAI,HAI3,no,N,18,,152757,27297,5FW
19,,SING,CAG,HAG,no,N,19,,152757,27297,5FW
20,,SING,CAJ,HAJ1,no,N,20,,152757,27297,5FW
21,,SING,CAJ,HAJ2,no,N,21,,152757,27297,5FW
22,,SING,CAJ,HAJ3,no,N,22,,152757,27297,5FW
23,,SING,NAD,HAD,no,N,23,,152757,27297,5FW
24,,SING,CAF,HAF1,no,N,24,,152757,27297,5FW
25,,SING,CAF,HAF2,no,N,25,,152757,27297,5FW
26,,SING,CAE,HAE,no,N,26,,152757,27297,5FW
27,,SING,OAA,HAA,no,N,27,,152757,27297,5FW
28,,SING,CAK,HAK,no,N,28,,152757,27297,5FW
29,,SING,CAL,HAL,no,N,29,,152757,27297,5FW
30,,SING,CAN,HAN,no,N,30,,152757,27297,5FW
31,,SING,OAC,HAC,no,N,31,,152757,27297,5FW
32,,SING,OAB,HAB,no,N,32,,152757,27297,5FW
1,,SING,P24,O25,no,N,1,,152774,27298,SXO
2,,SING,O25,HO25,no,N,2,,152774,27298,SXO
3,,DOUB,O23,P24,no,N,3,,152774,27298,SXO
4,,SING,P24,O27,no,N,4,,152774,27298,SXO
5,,SING,P24,O26,no,N,5,,152774,27298,SXO
6,,SING,O26,HO26,no,N,6,,152774,27298,SXO
7,,SING,O27,C28,no,N,7,,152774,27298,SXO
8,,SING,C28,H28A,no,N,8,,152774,27298,SXO
9,,SING,C28,C29,no,N,9,,152774,27298,SXO
10,,SING,C28,H28,no,N,10,,152774,27298,SXO
11,,SING,C31,C29,no,N,11,,152774,27298,SXO
12,,SING,C29,C32,no,N,12,,152774,27298,SXO
13,,SING,C29,C30,no,N,13,,152774,27298,SXO
14,,SING,H30,C30,no,N,14,,152774,27298,SXO
15,,SING,C30,H30B,no,N,15,,152774,27298,SXO
16,,SING,C30,H30A,no,N,16,,152774,27298,SXO
17,,SING,H31,C31,no,N,17,,152774,27298,SXO
18,,SING,H31A,C31,no,N,18,,152774,27298,SXO
19,,SING,C31,H31B,no,N,19,,152774,27298,SXO
20,,SING,O33,C32,no,N,20,,152774,27298,SXO
21,,SING,C32,C34,no,N,21,,152774,27298,SXO
22,,SING,C32,H32,no,N,22,,152774,27298,SXO
23,,SING,HO33,O33,no,N,23,,152774,27298,SXO
24,,DOUB,O35,C34,no,N,24,,152774,27298,SXO
25,,SING,C34,N36,no,N,25,,152774,27298,SXO
26,,SING,N36,C37,no,N,26,,152774,27298,SXO
27,,SING,N36,HN36,no,N,27,,152774,27298,SXO
28,,SING,H37,C37,no,N,28,,152774,27298,SXO
29,,SING,C37,H37A,no,N,29,,152774,27298,SXO
30,,SING,C37,C38,no,N,30,,152774,27298,SXO
31,,SING,C39,C38,no,N,31,,152774,27298,SXO
32,,SING,C38,H38A,no,N,32,,152774,27298,SXO
33,,SING,C38,H38,no,N,33,,152774,27298,SXO
34,,SING,N41,C39,no,N,34,,152774,27298,SXO
35,,DOUB,C39,O40,no,N,35,,152774,27298,SXO
36,,SING,HN41,N41,no,N,36,,152774,27298,SXO
37,,SING,C42,N41,no,N,37,,152774,27298,SXO
38,,SING,C43,C42,no,N,38,,152774,27298,SXO
39,,SING,H42,C42,no,N,39,,152774,27298,SXO
40,,SING,C42,H42A,no,N,40,,152774,27298,SXO
41,,SING,S1,C43,no,N,41,,152774,27298,SXO
42,,SING,H43A,C43,no,N,42,,152774,27298,SXO
43,,SING,C43,H43,no,N,43,,152774,27298,SXO
44,,SING,C1,S1,no,N,44,,152774,27298,SXO
45,,SING,C2,C1,no,N,45,,152774,27298,SXO
46,,DOUB,C1,O1,no,N,46,,152774,27298,SXO
47,,SING,C3,C2,no,N,47,,152774,27298,SXO
48,,SING,H2,C2,no,N,48,,152774,27298,SXO
49,,SING,C2,H2A,no,N,49,,152774,27298,SXO
50,,SING,H3A,C3,no,N,50,,152774,27298,SXO
51,,SING,H3,C3,no,N,51,,152774,27298,SXO
52,,SING,C3,C4,no,N,52,,152774,27298,SXO
53,,SING,C5,C4,no,N,53,,152774,27298,SXO
54,,SING,C4,H4,no,N,54,,152774,27298,SXO
55,,SING,C4,H4A,no,N,55,,152774,27298,SXO
56,,SING,H5A,C5,no,N,56,,152774,27298,SXO
57,,SING,H5,C5,no,N,57,,152774,27298,SXO
58,,SING,C5,C6,no,N,58,,152774,27298,SXO
59,,SING,H6,C6,no,N,59,,152774,27298,SXO
60,,SING,C6,C7,no,N,60,,152774,27298,SXO
61,,SING,C6,H6A,no,N,61,,152774,27298,SXO
62,,SING,C8,C7,no,N,62,,152774,27298,SXO
63,,SING,C7,H7,no,N,63,,152774,27298,SXO
64,,SING,C7,H7A,no,N,64,,152774,27298,SXO
65,,SING,H8A,C8,no,N,65,,152774,27298,SXO
66,,SING,H8,C8,no,N,66,,152774,27298,SXO
67,,SING,C8,H8B,no,N,67,,152774,27298,SXO
1,,SING,O23,P24,no,N,1,,152871,27304,PNS
2,,SING,O23,HOP1,no,N,2,,152871,27304,PNS
3,,SING,P24,O25,no,N,3,,152871,27304,PNS
4,,DOUB,P24,O26,no,N,4,,152871,27304,PNS
5,,SING,P24,O27,no,N,5,,152871,27304,PNS
6,,SING,O25,HOP2,no,N,6,,152871,27304,PNS
7,,SING,O27,C28,no,N,7,,152871,27304,PNS
8,,SING,C28,C29,no,N,8,,152871,27304,PNS
9,,SING,C28,H282,no,N,9,,152871,27304,PNS
10,,SING,C28,H281,no,N,10,,152871,27304,PNS
11,,SING,C29,C30,no,N,11,,152871,27304,PNS
12,,SING,C29,C31,no,N,12,,152871,27304,PNS
13,,SING,C29,C32,no,N,13,,152871,27304,PNS
14,,SING,C30,H303,no,N,14,,152871,27304,PNS
15,,SING,C30,H302,no,N,15,,152871,27304,PNS
16,,SING,C30,H301,no,N,16,,152871,27304,PNS
17,,SING,C31,H313,no,N,17,,152871,27304,PNS
18,,SING,C31,H312,no,N,18,,152871,27304,PNS
19,,SING,C31,H311,no,N,19,,152871,27304,PNS
20,,SING,C32,O33,no,N,20,,152871,27304,PNS
21,,SING,C32,C34,no,N,21,,152871,27304,PNS
22,,SING,C32,H32,no,N,22,,152871,27304,PNS
23,,SING,O33,H33,no,N,23,,152871,27304,PNS
24,,DOUB,C34,O35,no,N,24,,152871,27304,PNS
25,,SING,C34,N36,no,N,25,,152871,27304,PNS
26,,SING,N36,C37,no,N,26,,152871,27304,PNS
27,,SING,N36,H36,no,N,27,,152871,27304,PNS
28,,SING,C37,C38,no,N,28,,152871,27304,PNS
29,,SING,C37,H372,no,N,29,,152871,27304,PNS
30,,SING,C37,H371,no,N,30,,152871,27304,PNS
31,,SING,C38,C39,no,N,31,,152871,27304,PNS
32,,SING,C38,H382,no,N,32,,152871,27304,PNS
33,,SING,C38,H381,no,N,33,,152871,27304,PNS
34,,DOUB,C39,O40,no,N,34,,152871,27304,PNS
35,,SING,C39,N41,no,N,35,,152871,27304,PNS
36,,SING,N41,C42,no,N,36,,152871,27304,PNS
37,,SING,N41,H41,no,N,37,,152871,27304,PNS
38,,SING,C42,C43,no,N,38,,152871,27304,PNS
39,,SING,C42,H422,no,N,39,,152871,27304,PNS
40,,SING,C42,H421,no,N,40,,152871,27304,PNS
41,,SING,C43,S44,no,N,41,,152871,27304,PNS
42,,SING,C43,H431,no,N,42,,152871,27304,PNS
43,,SING,C43,H432,no,N,43,,152871,27304,PNS
44,,SING,S44,H44,no,N,44,,152871,27304,PNS
1,,SING,N,CA,no,N,1,,153037,27320,SEP
2,,SING,N,H,no,N,2,,153037,27320,SEP
3,,SING,N,H2,no,N,3,,153037,27320,SEP
4,,SING,CA,CB,no,N,4,,153037,27320,SEP
5,,SING,CA,C,no,N,5,,153037,27320,SEP
6,,SING,CA,HA,no,N,6,,153037,27320,SEP
7,,SING,CB,OG,no,N,7,,153037,27320,SEP
8,,SING,CB,HB2,no,N,8,,153037,27320,SEP
9,,SING,CB,HB3,no,N,9,,153037,27320,SEP
10,,SING,OG,P,no,N,10,,153037,27320,SEP
11,,DOUB,C,O,no,N,11,,153037,27320,SEP
12,,SING,C,OXT,no,N,12,,153037,27320,SEP
13,,SING,OXT,HXT,no,N,13,,153037,27320,SEP
14,,DOUB,P,O1P,no,N,14,,153037,27320,SEP
15,,SING,P,O2P,no,N,15,,153037,27320,SEP
16,,SING,P,O3P,no,N,16,,153037,27320,SEP
17,,SING,O2P,HOP2,no,N,17,,153037,27320,SEP
18,,SING,O3P,HOP3,no,N,18,,153037,27320,SEP
1,,SING,N,CA,no,N,1,,153238,27337,TPO
2,,SING,N,H,no,N,2,,153238,27337,TPO
3,,SING,N,H2,no,N,3,,153238,27337,TPO
4,,SING,CA,CB,no,N,4,,153238,27337,TPO
5,,SING,CA,C,no,N,5,,153238,27337,TPO
6,,SING,CA,HA,no,N,6,,153238,27337,TPO
7,,SING,CB,CG2,no,N,7,,153238,27337,TPO
8,,SING,CB,OG1,no,N,8,,153238,27337,TPO
9,,SING,CB,HB,no,N,9,,153238,27337,TPO
10,,SING,CG2,HG21,no,N,10,,153238,27337,TPO
11,,SING,CG2,HG22,no,N,11,,153238,27337,TPO
12,,SING,CG2,HG23,no,N,12,,153238,27337,TPO
13,,SING,OG1,P,no,N,13,,153238,27337,TPO
14,,DOUB,P,O1P,no,N,14,,153238,27337,TPO
15,,SING,P,O2P,no,N,15,,153238,27337,TPO
16,,SING,P,O3P,no,N,16,,153238,27337,TPO
17,,SING,O2P,HOP2,no,N,17,,153238,27337,TPO
18,,SING,O3P,HOP3,no,N,18,,153238,27337,TPO
19,,DOUB,C,O,no,N,19,,153238,27337,TPO
20,,SING,C,OXT,no,N,20,,153238,27337,TPO
21,,SING,OXT,HXT,no,N,21,,153238,27337,TPO
1,,SING,N,CA,no,N,1,,153627,27362,PTR
2,,SING,N,H,no,N,2,,153627,27362,PTR
3,,SING,N,HN2,no,N,3,,153627,27362,PTR
4,,SING,CA,C,no,N,4,,153627,27362,PTR
5,,SING,CA,CB,no,N,5,,153627,27362,PTR
6,,SING,CA,HA,no,N,6,,153627,27362,PTR
7,,DOUB,C,O,no,N,7,,153627,27362,PTR
8,,SING,C,OXT,no,N,8,,153627,27362,PTR
9,,SING,OXT,HXT,no,N,9,,153627,27362,PTR
10,,SING,CB,CG,no,N,10,,153627,27362,PTR
11,,SING,CB,HB2,no,N,11,,153627,27362,PTR
12,,SING,CB,HB3,no,N,12,,153627,27362,PTR
13,,DOUB,CG,CD1,yes,N,13,,153627,27362,PTR
14,,SING,CG,CD2,yes,N,14,,153627,27362,PTR
15,,SING,CD1,CE1,yes,N,15,,153627,27362,PTR
16,,SING,CD1,HD1,no,N,16,,153627,27362,PTR
17,,DOUB,CD2,CE2,yes,N,17,,153627,27362,PTR
18,,SING,CD2,HD2,no,N,18,,153627,27362,PTR
19,,DOUB,CE1,CZ,yes,N,19,,153627,27362,PTR
20,,SING,CE1,HE1,no,N,20,,153627,27362,PTR
21,,SING,CE2,CZ,yes,N,21,,153627,27362,PTR
22,,SING,CE2,HE2,no,N,22,,153627,27362,PTR
23,,SING,CZ,OH,no,N,23,,153627,27362,PTR
24,,SING,OH,P,no,N,24,,153627,27362,PTR
25,,DOUB,P,O1P,no,N,25,,153627,27362,PTR
26,,SING,P,O2P,no,N,26,,153627,27362,PTR
27,,SING,P,O3P,no,N,27,,153627,27362,PTR
28,,SING,O2P,HO2P,no,N,28,,153627,27362,PTR
29,,SING,O3P,HO3P,no,N,29,,153627,27362,PTR
1,,SING,CHA,C1A,no,N,1,,153647,27363,HEM
2,,DOUB,CHA,C4D,no,N,2,,153647,27363,HEM
3,,SING,CHA,HHA,no,N,3,,153647,27363,HEM
4,,SING,CHB,C4A,no,N,4,,153647,27363,HEM
5,,DOUB,CHB,C1B,no,N,5,,153647,27363,HEM
6,,SING,CHB,HHB,no,N,6,,153647,27363,HEM
7,,SING,CHC,C4B,no,N,7,,153647,27363,HEM
8,,DOUB,CHC,C1C,no,N,8,,153647,27363,HEM
9,,SING,CHC,HHC,no,N,9,,153647,27363,HEM
10,,DOUB,CHD,C4C,no,N,10,,153647,27363,HEM
11,,SING,CHD,C1D,no,N,11,,153647,27363,HEM
12,,SING,CHD,HHD,no,N,12,,153647,27363,HEM
13,,DOUB,C1A,C2A,yes,N,13,,153647,27363,HEM
14,,SING,C1A,NA,yes,N,14,,153647,27363,HEM
15,,SING,C2A,C3A,yes,N,15,,153647,27363,HEM
16,,SING,C2A,CAA,no,N,16,,153647,27363,HEM
17,,DOUB,C3A,C4A,yes,N,17,,153647,27363,HEM
18,,SING,C3A,CMA,no,N,18,,153647,27363,HEM
19,,SING,C4A,NA,yes,N,19,,153647,27363,HEM
20,,SING,CMA,HMA,no,N,20,,153647,27363,HEM
21,,SING,CMA,HMAA,no,N,21,,153647,27363,HEM
22,,SING,CMA,HMAB,no,N,22,,153647,27363,HEM
23,,SING,CAA,CBA,no,N,23,,153647,27363,HEM
24,,SING,CAA,HAA,no,N,24,,153647,27363,HEM
25,,SING,CAA,HAAA,no,N,25,,153647,27363,HEM
26,,SING,CBA,CGA,no,N,26,,153647,27363,HEM
27,,SING,CBA,HBA,no,N,27,,153647,27363,HEM
28,,SING,CBA,HBAA,no,N,28,,153647,27363,HEM
29,,DOUB,CGA,O1A,no,N,29,,153647,27363,HEM
30,,SING,CGA,O2A,no,N,30,,153647,27363,HEM
31,,SING,C1B,C2B,no,N,31,,153647,27363,HEM
32,,SING,C1B,NB,no,N,32,,153647,27363,HEM
33,,DOUB,C2B,C3B,no,N,33,,153647,27363,HEM
34,,SING,C2B,CMB,no,N,34,,153647,27363,HEM
35,,SING,C3B,C4B,no,N,35,,153647,27363,HEM
36,,SING,C3B,CAB,no,N,36,,153647,27363,HEM
37,,DOUB,C4B,NB,no,N,37,,153647,27363,HEM
38,,SING,CMB,HMB,no,N,38,,153647,27363,HEM
39,,SING,CMB,HMBA,no,N,39,,153647,27363,HEM
40,,SING,CMB,HMBB,no,N,40,,153647,27363,HEM
41,,DOUB,CAB,CBB,no,N,41,,153647,27363,HEM
42,,SING,CAB,HAB,no,N,42,,153647,27363,HEM
43,,SING,CBB,HBB,no,N,43,,153647,27363,HEM
44,,SING,CBB,HBBA,no,N,44,,153647,27363,HEM
45,,SING,C1C,C2C,yes,N,45,,153647,27363,HEM
46,,SING,C1C,NC,yes,N,46,,153647,27363,HEM
47,,DOUB,C2C,C3C,yes,N,47,,153647,27363,HEM
48,,SING,C2C,CMC,no,N,48,,153647,27363,HEM
49,,SING,C3C,C4C,yes,N,49,,153647,27363,HEM
50,,SING,C3C,CAC,no,N,50,,153647,27363,HEM
51,,SING,C4C,NC,yes,N,51,,153647,27363,HEM
52,,SING,CMC,HMC,no,N,52,,153647,27363,HEM
53,,SING,CMC,HMCA,no,N,53,,153647,27363,HEM
54,,SING,CMC,HMCB,no,N,54,,153647,27363,HEM
55,,DOUB,CAC,CBC,no,N,55,,153647,27363,HEM
56,,SING,CAC,HAC,no,N,56,,153647,27363,HEM
57,,SING,CBC,HBC,no,N,57,,153647,27363,HEM
58,,SING,CBC,HBCA,no,N,58,,153647,27363,HEM
59,,SING,C1D,C2D,no,N,59,,153647,27363,HEM
60,,DOUB,C1D,ND,no,N,60,,153647,27363,HEM
61,,DOUB,C2D,C3D,no,N,61,,153647,27363,HEM
62,,SING,C2D,CMD,no,N,62,,153647,27363,HEM
63,,SING,C3D,C4D,no,N,63,,153647,27363,HEM
64,,SING,C3D,CAD,no,N,64,,153647,27363,HEM
65,,SING,C4D,ND,no,N,65,,153647,27363,HEM
66,,SING,CMD,HMD,no,N,66,,153647,27363,HEM
67,,SING,CMD,HMDA,no,N,67,,153647,27363,HEM
68,,SING,CMD,HMDB,no,N,68,,153647,27363,HEM
69,,SING,CAD,CBD,no,N,69,,153647,27363,HEM
70,,SING,CAD,HAD,no,N,70,,153647,27363,HEM
71,,SING,CAD,HADA,no,N,71,,153647,27363,HEM
72,,SING,CBD,CGD,no,N,72,,153647,27363,HEM
73,,SING,CBD,HBD,no,N,73,,153647,27363,HEM
74,,SING,CBD,HBDA,no,N,74,,153647,27363,HEM
75,,DOUB,CGD,O1D,no,N,75,,153647,27363,HEM
76,,SING,CGD,O2D,no,N,76,,153647,27363,HEM
77,,SING,O2A,H2A,no,N,77,,153647,27363,HEM
78,,SING,O2D,H2D,no,N,78,,153647,27363,HEM
79,,SING,FE,NA,no,N,79,,153647,27363,HEM
80,,SING,FE,NB,no,N,80,,153647,27363,HEM
81,,SING,FE,NC,no,N,81,,153647,27363,HEM
82,,SING,FE,ND,no,N,82,,153647,27363,HEM
1,,SING,N1,C2,no,N,1,,153667,27364,5CM
2,,SING,N1,C6,no,N,2,,153667,27364,5CM
3,,SING,N1,C1',no,N,3,,153667,27364,5CM
4,,SING,C2,N3,no,N,4,,153667,27364,5CM
5,,DOUB,C2,O2,no,N,5,,153667,27364,5CM
6,,DOUB,N3,C4,no,N,6,,153667,27364,5CM
7,,SING,C4,C5,no,N,7,,153667,27364,5CM
8,,SING,C4,N4,no,N,8,,153667,27364,5CM
9,,SING,C5,C5A,no,N,9,,153667,27364,5CM
10,,DOUB,C5,C6,no,N,10,,153667,27364,5CM
11,,SING,C5A,H5A1,no,N,11,,153667,27364,5CM
12,,SING,C5A,H5A2,no,N,12,,153667,27364,5CM
13,,SING,C5A,H5A3,no,N,13,,153667,27364,5CM
14,,SING,C6,H6,no,N,14,,153667,27364,5CM
15,,SING,N4,HN41,no,N,15,,153667,27364,5CM
16,,SING,N4,HN42,no,N,16,,153667,27364,5CM
17,,SING,C1',C2',no,N,17,,153667,27364,5CM
18,,SING,C1',O4',no,N,18,,153667,27364,5CM
19,,SING,C1',H1',no,N,19,,153667,27364,5CM
20,,SING,C2',C3',no,N,20,,153667,27364,5CM
21,,SING,C2',H2',no,N,21,,153667,27364,5CM
22,,SING,C2',H2'',no,N,22,,153667,27364,5CM
23,,SING,C3',C4',no,N,23,,153667,27364,5CM
24,,SING,C3',O3',no,N,24,,153667,27364,5CM
25,,SING,C3',H3',no,N,25,,153667,27364,5CM
26,,SING,C4',O4',no,N,26,,153667,27364,5CM
27,,SING,C4',C5',no,N,27,,153667,27364,5CM
28,,SING,C4',H4',no,N,28,,153667,27364,5CM
29,,SING,O3',HO3',no,N,29,,153667,27364,5CM
30,,SING,C5',O5',no,N,30,,153667,27364,5CM
31,,SING,C5',H5',no,N,31,,153667,27364,5CM
32,,SING,C5',H5'',no,N,32,,153667,27364,5CM
33,,SING,O5',P,no,N,33,,153667,27364,5CM
34,,DOUB,P,OP1,no,N,34,,153667,27364,5CM
35,,SING,P,OP2,no,N,35,,153667,27364,5CM
36,,SING,P,OP3,no,N,36,,153667,27364,5CM
37,,SING,OP2,HOP2,no,N,37,,153667,27364,5CM
38,,SING,OP3,HOP3,no,N,38,,153667,27364,5CM
1,,SING,N1,C2,no,N,1,,153702,27366,5CM
2,,SING,N1,C6,no,N,2,,153702,27366,5CM
3,,SING,N1,C1',no,N,3,,153702,27366,5CM
4,,SING,C2,N3,no,N,4,,153702,27366,5CM
5,,DOUB,C2,O2,no,N,5,,153702,27366,5CM
6,,DOUB,N3,C4,no,N,6,,153702,27366,5CM
7,,SING,C4,C5,no,N,7,,153702,27366,5CM
8,,SING,C4,N4,no,N,8,,153702,27366,5CM
9,,SING,C5,C5A,no,N,9,,153702,27366,5CM
10,,DOUB,C5,C6,no,N,10,,153702,27366,5CM
11,,SING,C5A,H5A1,no,N,11,,153702,27366,5CM
12,,SING,C5A,H5A2,no,N,12,,153702,27366,5CM
13,,SING,C5A,H5A3,no,N,13,,153702,27366,5CM
14,,SING,C6,H6,no,N,14,,153702,27366,5CM
15,,SING,N4,HN41,no,N,15,,153702,27366,5CM
16,,SING,N4,HN42,no,N,16,,153702,27366,5CM
17,,SING,C1',C2',no,N,17,,153702,27366,5CM
18,,SING,C1',O4',no,N,18,,153702,27366,5CM
19,,SING,C1',H1',no,N,19,,153702,27366,5CM
20,,SING,C2',C3',no,N,20,,153702,27366,5CM
21,,SING,C2',H2',no,N,21,,153702,27366,5CM
22,,SING,C2',H2'',no,N,22,,153702,27366,5CM
23,,SING,C3',C4',no,N,23,,153702,27366,5CM
24,,SING,C3',O3',no,N,24,,153702,27366,5CM
25,,SING,C3',H3',no,N,25,,153702,27366,5CM
26,,SING,C4',O4',no,N,26,,153702,27366,5CM
27,,SING,C4',C5',no,N,27,,153702,27366,5CM
28,,SING,C4',H4',no,N,28,,153702,27366,5CM
29,,SING,O3',HO3',no,N,29,,153702,27366,5CM
30,,SING,C5',O5',no,N,30,,153702,27366,5CM
31,,SING,C5',H5',no,N,31,,153702,27366,5CM
32,,SING,C5',H5'',no,N,32,,153702,27366,5CM
33,,SING,O5',P,no,N,33,,153702,27366,5CM
34,,DOUB,P,OP1,no,N,34,,153702,27366,5CM
35,,SING,P,OP2,no,N,35,,153702,27366,5CM
36,,SING,P,OP3,no,N,36,,153702,27366,5CM
37,,SING,OP2,HOP2,no,N,37,,153702,27366,5CM
38,,SING,OP3,HOP3,no,N,38,,153702,27366,5CM
1,,SING,N1,C2,no,N,1,,153722,27367,5CM
2,,SING,N1,C6,no,N,2,,153722,27367,5CM
3,,SING,N1,C1',no,N,3,,153722,27367,5CM
4,,SING,C2,N3,no,N,4,,153722,27367,5CM
5,,DOUB,C2,O2,no,N,5,,153722,27367,5CM
6,,DOUB,N3,C4,no,N,6,,153722,27367,5CM
7,,SING,C4,C5,no,N,7,,153722,27367,5CM
8,,SING,C4,N4,no,N,8,,153722,27367,5CM
9,,SING,C5,C5A,no,N,9,,153722,27367,5CM
10,,DOUB,C5,C6,no,N,10,,153722,27367,5CM
11,,SING,C5A,H5A1,no,N,11,,153722,27367,5CM
12,,SING,C5A,H5A2,no,N,12,,153722,27367,5CM
13,,SING,C5A,H5A3,no,N,13,,153722,27367,5CM
14,,SING,C6,H6,no,N,14,,153722,27367,5CM
15,,SING,N4,HN41,no,N,15,,153722,27367,5CM
16,,SING,N4,HN42,no,N,16,,153722,27367,5CM
17,,SING,C1',C2',no,N,17,,153722,27367,5CM
18,,SING,C1',O4',no,N,18,,153722,27367,5CM
19,,SING,C1',H1',no,N,19,,153722,27367,5CM
20,,SING,C2',C3',no,N,20,,153722,27367,5CM
21,,SING,C2',H2',no,N,21,,153722,27367,5CM
22,,SING,C2',H2'',no,N,22,,153722,27367,5CM
23,,SING,C3',C4',no,N,23,,153722,27367,5CM
24,,SING,C3',O3',no,N,24,,153722,27367,5CM
25,,SING,C3',H3',no,N,25,,153722,27367,5CM
26,,SING,C4',O4',no,N,26,,153722,27367,5CM
27,,SING,C4',C5',no,N,27,,153722,27367,5CM
28,,SING,C4',H4',no,N,28,,153722,27367,5CM
29,,SING,O3',HO3',no,N,29,,153722,27367,5CM
30,,SING,C5',O5',no,N,30,,153722,27367,5CM
31,,SING,C5',H5',no,N,31,,153722,27367,5CM
32,,SING,C5',H5'',no,N,32,,153722,27367,5CM
33,,SING,O5',P,no,N,33,,153722,27367,5CM
34,,DOUB,P,OP1,no,N,34,,153722,27367,5CM
35,,SING,P,OP2,no,N,35,,153722,27367,5CM
36,,SING,P,OP3,no,N,36,,153722,27367,5CM
37,,SING,OP2,HOP2,no,N,37,,153722,27367,5CM
38,,SING,OP3,HOP3,no,N,38,,153722,27367,5CM
1,,SING,N1,C2,no,N,1,,153742,27368,5CM
2,,SING,N1,C6,no,N,2,,153742,27368,5CM
3,,SING,N1,C1',no,N,3,,153742,27368,5CM
4,,SING,C2,N3,no,N,4,,153742,27368,5CM
5,,DOUB,C2,O2,no,N,5,,153742,27368,5CM
6,,DOUB,N3,C4,no,N,6,,153742,27368,5CM
7,,SING,C4,C5,no,N,7,,153742,27368,5CM
8,,SING,C4,N4,no,N,8,,153742,27368,5CM
9,,SING,C5,C5A,no,N,9,,153742,27368,5CM
10,,DOUB,C5,C6,no,N,10,,153742,27368,5CM
11,,SING,C5A,H5A1,no,N,11,,153742,27368,5CM
12,,SING,C5A,H5A2,no,N,12,,153742,27368,5CM
13,,SING,C5A,H5A3,no,N,13,,153742,27368,5CM
14,,SING,C6,H6,no,N,14,,153742,27368,5CM
15,,SING,N4,HN41,no,N,15,,153742,27368,5CM
16,,SING,N4,HN42,no,N,16,,153742,27368,5CM
17,,SING,C1',C2',no,N,17,,153742,27368,5CM
18,,SING,C1',O4',no,N,18,,153742,27368,5CM
19,,SING,C1',H1',no,N,19,,153742,27368,5CM
20,,SING,C2',C3',no,N,20,,153742,27368,5CM
21,,SING,C2',H2',no,N,21,,153742,27368,5CM
22,,SING,C2',H2'',no,N,22,,153742,27368,5CM
23,,SING,C3',C4',no,N,23,,153742,27368,5CM
24,,SING,C3',O3',no,N,24,,153742,27368,5CM
25,,SING,C3',H3',no,N,25,,153742,27368,5CM
26,,SING,C4',O4',no,N,26,,153742,27368,5CM
27,,SING,C4',C5',no,N,27,,153742,27368,5CM
28,,SING,C4',H4',no,N,28,,153742,27368,5CM
29,,SING,O3',HO3',no,N,29,,153742,27368,5CM
30,,SING,C5',O5',no,N,30,,153742,27368,5CM
31,,SING,C5',H5',no,N,31,,153742,27368,5CM
32,,SING,C5',H5'',no,N,32,,153742,27368,5CM
33,,SING,O5',P,no,N,33,,153742,27368,5CM
34,,DOUB,P,OP1,no,N,34,,153742,27368,5CM
35,,SING,P,OP2,no,N,35,,153742,27368,5CM
36,,SING,P,OP3,no,N,36,,153742,27368,5CM
37,,SING,OP2,HOP2,no,N,37,,153742,27368,5CM
38,,SING,OP3,HOP3,no,N,38,,153742,27368,5CM
1,,SING,N1,C2,no,N,1,,153763,27369,5CM
2,,SING,N1,C6,no,N,2,,153763,27369,5CM
3,,SING,N1,C1',no,N,3,,153763,27369,5CM
4,,SING,C2,N3,no,N,4,,153763,27369,5CM
5,,DOUB,C2,O2,no,N,5,,153763,27369,5CM
6,,DOUB,N3,C4,no,N,6,,153763,27369,5CM
7,,SING,C4,C5,no,N,7,,153763,27369,5CM
8,,SING,C4,N4,no,N,8,,153763,27369,5CM
9,,SING,C5,C5A,no,N,9,,153763,27369,5CM
10,,DOUB,C5,C6,no,N,10,,153763,27369,5CM
11,,SING,C5A,H5A1,no,N,11,,153763,27369,5CM
12,,SING,C5A,H5A2,no,N,12,,153763,27369,5CM
13,,SING,C5A,H5A3,no,N,13,,153763,27369,5CM
14,,SING,C6,H6,no,N,14,,153763,27369,5CM
15,,SING,N4,HN41,no,N,15,,153763,27369,5CM
16,,SING,N4,HN42,no,N,16,,153763,27369,5CM
17,,SING,C1',C2',no,N,17,,153763,27369,5CM
18,,SING,C1',O4',no,N,18,,153763,27369,5CM
19,,SING,C1',H1',no,N,19,,153763,27369,5CM
20,,SING,C2',C3',no,N,20,,153763,27369,5CM
21,,SING,C2',H2',no,N,21,,153763,27369,5CM
22,,SING,C2',H2'',no,N,22,,153763,27369,5CM
23,,SING,C3',C4',no,N,23,,153763,27369,5CM
24,,SING,C3',O3',no,N,24,,153763,27369,5CM
25,,SING,C3',H3',no,N,25,,153763,27369,5CM
26,,SING,C4',O4',no,N,26,,153763,27369,5CM
27,,SING,C4',C5',no,N,27,,153763,27369,5CM
28,,SING,C4',H4',no,N,28,,153763,27369,5CM
29,,SING,O3',HO3',no,N,29,,153763,27369,5CM
30,,SING,C5',O5',no,N,30,,153763,27369,5CM
31,,SING,C5',H5',no,N,31,,153763,27369,5CM
32,,SING,C5',H5'',no,N,32,,153763,27369,5CM
33,,SING,O5',P,no,N,33,,153763,27369,5CM
34,,DOUB,P,OP1,no,N,34,,153763,27369,5CM
35,,SING,P,OP2,no,N,35,,153763,27369,5CM
36,,SING,P,OP3,no,N,36,,153763,27369,5CM
37,,SING,OP2,HOP2,no,N,37,,153763,27369,5CM
38,,SING,OP3,HOP3,no,N,38,,153763,27369,5CM
1,,SING,N1,C2,no,N,1,,153784,27370,5CM
2,,SING,N1,C6,no,N,2,,153784,27370,5CM
3,,SING,N1,C1',no,N,3,,153784,27370,5CM
4,,SING,C2,N3,no,N,4,,153784,27370,5CM
5,,DOUB,C2,O2,no,N,5,,153784,27370,5CM
6,,DOUB,N3,C4,no,N,6,,153784,27370,5CM
7,,SING,C4,C5,no,N,7,,153784,27370,5CM
8,,SING,C4,N4,no,N,8,,153784,27370,5CM
9,,SING,C5,C5A,no,N,9,,153784,27370,5CM
10,,DOUB,C5,C6,no,N,10,,153784,27370,5CM
11,,SING,C5A,H5A1,no,N,11,,153784,27370,5CM
12,,SING,C5A,H5A2,no,N,12,,153784,27370,5CM
13,,SING,C5A,H5A3,no,N,13,,153784,27370,5CM
14,,SING,C6,H6,no,N,14,,153784,27370,5CM
15,,SING,N4,HN41,no,N,15,,153784,27370,5CM
16,,SING,N4,HN42,no,N,16,,153784,27370,5CM
17,,SING,C1',C2',no,N,17,,153784,27370,5CM
18,,SING,C1',O4',no,N,18,,153784,27370,5CM
19,,SING,C1',H1',no,N,19,,153784,27370,5CM
20,,SING,C2',C3',no,N,20,,153784,27370,5CM
21,,SING,C2',H2',no,N,21,,153784,27370,5CM
22,,SING,C2',H2'',no,N,22,,153784,27370,5CM
23,,SING,C3',C4',no,N,23,,153784,27370,5CM
24,,SING,C3',O3',no,N,24,,153784,27370,5CM
25,,SING,C3',H3',no,N,25,,153784,27370,5CM
26,,SING,C4',O4',no,N,26,,153784,27370,5CM
27,,SING,C4',C5',no,N,27,,153784,27370,5CM
28,,SING,C4',H4',no,N,28,,153784,27370,5CM
29,,SING,O3',HO3',no,N,29,,153784,27370,5CM
30,,SING,C5',O5',no,N,30,,153784,27370,5CM
31,,SING,C5',H5',no,N,31,,153784,27370,5CM
32,,SING,C5',H5'',no,N,32,,153784,27370,5CM
33,,SING,O5',P,no,N,33,,153784,27370,5CM
34,,DOUB,P,OP1,no,N,34,,153784,27370,5CM
35,,SING,P,OP2,no,N,35,,153784,27370,5CM
36,,SING,P,OP3,no,N,36,,153784,27370,5CM
37,,SING,OP2,HOP2,no,N,37,,153784,27370,5CM
38,,SING,OP3,HOP3,no,N,38,,153784,27370,5CM
1,,SING,N1,C2,no,N,1,,153805,27371,5CM
2,,SING,N1,C6,no,N,2,,153805,27371,5CM
3,,SING,N1,C1',no,N,3,,153805,27371,5CM
4,,SING,C2,N3,no,N,4,,153805,27371,5CM
5,,DOUB,C2,O2,no,N,5,,153805,27371,5CM
6,,DOUB,N3,C4,no,N,6,,153805,27371,5CM
7,,SING,C4,C5,no,N,7,,153805,27371,5CM
8,,SING,C4,N4,no,N,8,,153805,27371,5CM
9,,SING,C5,C5A,no,N,9,,153805,27371,5CM
10,,DOUB,C5,C6,no,N,10,,153805,27371,5CM
11,,SING,C5A,H5A1,no,N,11,,153805,27371,5CM
12,,SING,C5A,H5A2,no,N,12,,153805,27371,5CM
13,,SING,C5A,H5A3,no,N,13,,153805,27371,5CM
14,,SING,C6,H6,no,N,14,,153805,27371,5CM
15,,SING,N4,HN41,no,N,15,,153805,27371,5CM
16,,SING,N4,HN42,no,N,16,,153805,27371,5CM
17,,SING,C1',C2',no,N,17,,153805,27371,5CM
18,,SING,C1',O4',no,N,18,,153805,27371,5CM
19,,SING,C1',H1',no,N,19,,153805,27371,5CM
20,,SING,C2',C3',no,N,20,,153805,27371,5CM
21,,SING,C2',H2',no,N,21,,153805,27371,5CM
22,,SING,C2',H2'',no,N,22,,153805,27371,5CM
23,,SING,C3',C4',no,N,23,,153805,27371,5CM
24,,SING,C3',O3',no,N,24,,153805,27371,5CM
25,,SING,C3',H3',no,N,25,,153805,27371,5CM
26,,SING,C4',O4',no,N,26,,153805,27371,5CM
27,,SING,C4',C5',no,N,27,,153805,27371,5CM
28,,SING,C4',H4',no,N,28,,153805,27371,5CM
29,,SING,O3',HO3',no,N,29,,153805,27371,5CM
30,,SING,C5',O5',no,N,30,,153805,27371,5CM
31,,SING,C5',H5',no,N,31,,153805,27371,5CM
32,,SING,C5',H5'',no,N,32,,153805,27371,5CM
33,,SING,O5',P,no,N,33,,153805,27371,5CM
34,,DOUB,P,OP1,no,N,34,,153805,27371,5CM
35,,SING,P,OP2,no,N,35,,153805,27371,5CM
36,,SING,P,OP3,no,N,36,,153805,27371,5CM
37,,SING,OP2,HOP2,no,N,37,,153805,27371,5CM
38,,SING,OP3,HOP3,no,N,38,,153805,27371,5CM
1,,SING,N1,C2,no,N,1,,153826,27372,5CM
2,,SING,N1,C6,no,N,2,,153826,27372,5CM
3,,SING,N1,C1',no,N,3,,153826,27372,5CM
4,,SING,C2,N3,no,N,4,,153826,27372,5CM
5,,DOUB,C2,O2,no,N,5,,153826,27372,5CM
6,,DOUB,N3,C4,no,N,6,,153826,27372,5CM
7,,SING,C4,C5,no,N,7,,153826,27372,5CM
8,,SING,C4,N4,no,N,8,,153826,27372,5CM
9,,SING,C5,C5A,no,N,9,,153826,27372,5CM
10,,DOUB,C5,C6,no,N,10,,153826,27372,5CM
11,,SING,C5A,H5A1,no,N,11,,153826,27372,5CM
12,,SING,C5A,H5A2,no,N,12,,153826,27372,5CM
13,,SING,C5A,H5A3,no,N,13,,153826,27372,5CM
14,,SING,C6,H6,no,N,14,,153826,27372,5CM
15,,SING,N4,HN41,no,N,15,,153826,27372,5CM
16,,SING,N4,HN42,no,N,16,,153826,27372,5CM
17,,SING,C1',C2',no,N,17,,153826,27372,5CM
18,,SING,C1',O4',no,N,18,,153826,27372,5CM
19,,SING,C1',H1',no,N,19,,153826,27372,5CM
20,,SING,C2',C3',no,N,20,,153826,27372,5CM
21,,SING,C2',H2',no,N,21,,153826,27372,5CM
22,,SING,C2',H2'',no,N,22,,153826,27372,5CM
23,,SING,C3',C4',no,N,23,,153826,27372,5CM
24,,SING,C3',O3',no,N,24,,153826,27372,5CM
25,,SING,C3',H3',no,N,25,,153826,27372,5CM
26,,SING,C4',O4',no,N,26,,153826,27372,5CM
27,,SING,C4',C5',no,N,27,,153826,27372,5CM
28,,SING,C4',H4',no,N,28,,153826,27372,5CM
29,,SING,O3',HO3',no,N,29,,153826,27372,5CM
30,,SING,C5',O5',no,N,30,,153826,27372,5CM
31,,SING,C5',H5',no,N,31,,153826,27372,5CM
32,,SING,C5',H5'',no,N,32,,153826,27372,5CM
33,,SING,O5',P,no,N,33,,153826,27372,5CM
34,,DOUB,P,OP1,no,N,34,,153826,27372,5CM
35,,SING,P,OP2,no,N,35,,153826,27372,5CM
36,,SING,P,OP3,no,N,36,,153826,27372,5CM
37,,SING,OP2,HOP2,no,N,37,,153826,27372,5CM
38,,SING,OP3,HOP3,no,N,38,,153826,27372,5CM
1,,DOUB,C1,C2,yes,N,1,,153844,27373,1N1
2,,SING,C1,N1,yes,N,2,,153844,27373,1N1
3,,SING,C1,H1,no,N,3,,153844,27373,1N1
4,,SING,C2,C3,no,N,4,,153844,27373,1N1
5,,SING,C2,S,yes,N,5,,153844,27373,1N1
6,,SING,C3,N2,no,N,6,,153844,27373,1N1
7,,DOUB,C3,O,no,N,7,,153844,27373,1N1
8,,SING,N6,C20,no,N,8,,153844,27373,1N1
9,,SING,N6,C17,no,N,9,,153844,27373,1N1
10,,SING,N6,C18,no,N,10,,153844,27373,1N1
11,,DOUB,C7,C8,yes,N,11,,153844,27373,1N1
12,,SING,C7,C6,yes,N,12,,153844,27373,1N1
13,,SING,C7,H7,no,N,13,,153844,27373,1N1
14,,SING,C8,C9,yes,N,14,,153844,27373,1N1
15,,SING,C8,H8,no,N,15,,153844,27373,1N1
16,,SING,C9,C10,no,N,16,,153844,27373,1N1
17,,DOUB,C9,C4,yes,N,17,,153844,27373,1N1
18,,SING,C10,H101,no,N,18,,153844,27373,1N1
19,,SING,C10,H102,no,N,19,,153844,27373,1N1
20,,SING,C10,H103,no,N,20,,153844,27373,1N1
21,,SING,C11,C12,yes,N,21,,153844,27373,1N1
22,,SING,C11,N,no,N,22,,153844,27373,1N1
23,,DOUB,C11,N4,yes,N,23,,153844,27373,1N1
24,,DOUB,C12,C13,yes,N,24,,153844,27373,1N1
25,,SING,C12,H12,no,N,25,,153844,27373,1N1
26,,SING,C13,N3,yes,N,26,,153844,27373,1N1
27,,SING,C13,N5,no,N,27,,153844,27373,1N1
28,,SING,C14,C15,no,N,28,,153844,27373,1N1
29,,DOUB,C14,N3,yes,N,29,,153844,27373,1N1
30,,SING,C14,N4,yes,N,30,,153844,27373,1N1
31,,SING,C15,H151,no,N,31,,153844,27373,1N1
32,,SING,C15,H152,no,N,32,,153844,27373,1N1
33,,SING,C15,H153,no,N,33,,153844,27373,1N1
34,,SING,C16,N5,no,N,34,,153844,27373,1N1
35,,SING,C16,C17,no,N,35,,153844,27373,1N1
36,,SING,C16,H161,no,N,36,,153844,27373,1N1
37,,SING,C16,H162,no,N,37,,153844,27373,1N1
38,,SING,C19,N5,no,N,38,,153844,27373,1N1
39,,SING,C19,C18,no,N,39,,153844,27373,1N1
40,,SING,C19,H191,no,N,40,,153844,27373,1N1
41,,SING,C19,H192,no,N,41,,153844,27373,1N1
42,,SING,C20,C21,no,N,42,,153844,27373,1N1
43,,SING,C20,H201,no,N,43,,153844,27373,1N1
44,,SING,C20,H202,no,N,44,,153844,27373,1N1
45,,SING,C21,O1,no,N,45,,153844,27373,1N1
46,,SING,C21,H211,no,N,46,,153844,27373,1N1
47,,SING,C21,H212,no,N,47,,153844,27373,1N1
48,,SING,N,C,no,N,48,,153844,27373,1N1
49,,SING,N,HN,no,N,49,,153844,27373,1N1
50,,DOUB,C,N1,yes,N,50,,153844,27373,1N1
51,,SING,C,S,yes,N,51,,153844,27373,1N1
52,,SING,N2,C4,no,N,52,,153844,27373,1N1
53,,SING,N2,HN2,no,N,53,,153844,27373,1N1
54,,SING,C4,C5,yes,N,54,,153844,27373,1N1
55,,DOUB,C5,C6,yes,N,55,,153844,27373,1N1
56,,SING,C5,CL,no,N,56,,153844,27373,1N1
57,,SING,C6,H6,no,N,57,,153844,27373,1N1
58,,SING,C17,H171,no,N,58,,153844,27373,1N1
59,,SING,C17,H172,no,N,59,,153844,27373,1N1
60,,SING,C18,H181,no,N,60,,153844,27373,1N1
61,,SING,C18,H182,no,N,61,,153844,27373,1N1
62,,SING,O1,HO1,no,N,62,,153844,27373,1N1
1,,SING,N1,C2,no,N,1,,153910,27377,K13
2,,DOUB,C2,C3,yes,N,2,,153910,27377,K13
3,,SING,C2,C7,yes,N,3,,153910,27377,K13
4,,SING,C3,C4,yes,N,4,,153910,27377,K13
5,,DOUB,C4,C5,yes,N,5,,153910,27377,K13
6,,SING,C5,C6,yes,N,6,,153910,27377,K13
7,,SING,C5,S8,no,N,7,,153910,27377,K13
8,,DOUB,C6,C7,yes,N,8,,153910,27377,K13
9,,DOUB,S8,O9,no,N,9,,153910,27377,K13
10,,DOUB,S8,O10,no,N,10,,153910,27377,K13
11,,SING,S8,N11,no,N,11,,153910,27377,K13
12,,SING,N11,C12,no,N,12,,153910,27377,K13
13,,SING,N11,C16,no,N,13,,153910,27377,K13
14,,SING,C12,C13,no,N,14,,153910,27377,K13
15,,SING,C13,C14,no,N,15,,153910,27377,K13
16,,SING,C13,C15,no,N,16,,153910,27377,K13
17,,SING,C15,C18,no,N,17,,153910,27377,K13
18,,SING,C16,C17,no,N,18,,153910,27377,K13
19,,SING,C17,O18,no,N,19,,153910,27377,K13
20,,SING,C17,C19,no,N,20,,153910,27377,K13
21,,SING,C19,N20,no,N,21,,153910,27377,K13
22,,SING,C19,C32,no,N,22,,153910,27377,K13
23,,SING,N20,C21,no,N,23,,153910,27377,K13
24,,DOUB,C21,O22,no,N,24,,153910,27377,K13
25,,SING,C21,O23,no,N,25,,153910,27377,K13
26,,SING,O23,C24,no,N,26,,153910,27377,K13
27,,SING,C24,C25,no,N,27,,153910,27377,K13
28,,SING,C24,C31,no,N,28,,153910,27377,K13
29,,SING,C25,O26,no,N,29,,153910,27377,K13
30,,SING,O26,C27,no,N,30,,153910,27377,K13
31,,SING,C27,O28,no,N,31,,153910,27377,K13
32,,SING,C27,C31,no,N,32,,153910,27377,K13
33,,SING,O28,C29,no,N,33,,153910,27377,K13
34,,SING,C29,C30,no,N,34,,153910,27377,K13
35,,SING,C30,C31,no,N,35,,153910,27377,K13
36,,SING,C32,C38,no,N,36,,153910,27377,K13
37,,DOUB,C33,C34,yes,N,37,,153910,27377,K13
38,,SING,C33,C38,yes,N,38,,153910,27377,K13
39,,SING,C34,C35,yes,N,39,,153910,27377,K13
40,,DOUB,C35,C36,yes,N,40,,153910,27377,K13
41,,SING,C36,C37,yes,N,41,,153910,27377,K13
42,,DOUB,C37,C38,yes,N,42,,153910,27377,K13
43,,SING,N1,HN1,no,N,43,,153910,27377,K13
44,,SING,N1,HN1A,no,N,44,,153910,27377,K13
45,,SING,C3,H3,no,N,45,,153910,27377,K13
46,,SING,C4,H4,no,N,46,,153910,27377,K13
47,,SING,C6,H6,no,N,47,,153910,27377,K13
48,,SING,C7,H7,no,N,48,,153910,27377,K13
49,,SING,C12,H12,no,N,49,,153910,27377,K13
50,,SING,C12,H12A,no,N,50,,153910,27377,K13
51,,SING,C13,H13,no,N,51,,153910,27377,K13
52,,SING,C14,H14,no,N,52,,153910,27377,K13
53,,SING,C14,H14A,no,N,53,,153910,27377,K13
54,,SING,C14,H14B,no,N,54,,153910,27377,K13
55,,SING,C15,H15,no,N,55,,153910,27377,K13
56,,SING,C15,H15A,no,N,56,,153910,27377,K13
57,,SING,C16,H16,no,N,57,,153910,27377,K13
58,,SING,C16,H16A,no,N,58,,153910,27377,K13
59,,SING,C17,H17,no,N,59,,153910,27377,K13
60,,SING,C18,H18,no,N,60,,153910,27377,K13
61,,SING,C18,H18A,no,N,61,,153910,27377,K13
62,,SING,C18,H18B,no,N,62,,153910,27377,K13
63,,SING,O18,HO18,no,N,63,,153910,27377,K13
64,,SING,C19,H19,no,N,64,,153910,27377,K13
65,,SING,N20,HN20,no,N,65,,153910,27377,K13
66,,SING,C24,H24,no,N,66,,153910,27377,K13
67,,SING,C25,H25,no,N,67,,153910,27377,K13
68,,SING,C25,H25A,no,N,68,,153910,27377,K13
69,,SING,C27,H27,no,N,69,,153910,27377,K13
70,,SING,C29,H29,no,N,70,,153910,27377,K13
71,,SING,C29,H29A,no,N,71,,153910,27377,K13
72,,SING,C30,H30,no,N,72,,153910,27377,K13
73,,SING,C30,H30A,no,N,73,,153910,27377,K13
74,,SING,C31,H31,no,N,74,,153910,27377,K13
75,,SING,C32,H32,no,N,75,,153910,27377,K13
76,,SING,C32,H32A,no,N,76,,153910,27377,K13
77,,SING,C33,H33,no,N,77,,153910,27377,K13
78,,SING,C34,H34,no,N,78,,153910,27377,K13
79,,SING,C35,H35,no,N,79,,153910,27377,K13
80,,SING,C36,H36,no,N,80,,153910,27377,K13
81,,SING,C37,H37,no,N,81,,153910,27377,K13
1,,SING,N1,C2,no,N,1,,153929,27378,K13
2,,DOUB,C2,C3,yes,N,2,,153929,27378,K13
3,,SING,C2,C7,yes,N,3,,153929,27378,K13
4,,SING,C3,C4,yes,N,4,,153929,27378,K13
5,,DOUB,C4,C5,yes,N,5,,153929,27378,K13
6,,SING,C5,C6,yes,N,6,,153929,27378,K13
7,,SING,C5,S8,no,N,7,,153929,27378,K13
8,,DOUB,C6,C7,yes,N,8,,153929,27378,K13
9,,DOUB,S8,O9,no,N,9,,153929,27378,K13
10,,DOUB,S8,O10,no,N,10,,153929,27378,K13
11,,SING,S8,N11,no,N,11,,153929,27378,K13
12,,SING,N11,C12,no,N,12,,153929,27378,K13
13,,SING,N11,C16,no,N,13,,153929,27378,K13
14,,SING,C12,C13,no,N,14,,153929,27378,K13
15,,SING,C13,C14,no,N,15,,153929,27378,K13
16,,SING,C13,C15,no,N,16,,153929,27378,K13
17,,SING,C15,C18,no,N,17,,153929,27378,K13
18,,SING,C16,C17,no,N,18,,153929,27378,K13
19,,SING,C17,O18,no,N,19,,153929,27378,K13
20,,SING,C17,C19,no,N,20,,153929,27378,K13
21,,SING,C19,N20,no,N,21,,153929,27378,K13
22,,SING,C19,C32,no,N,22,,153929,27378,K13
23,,SING,N20,C21,no,N,23,,153929,27378,K13
24,,DOUB,C21,O22,no,N,24,,153929,27378,K13
25,,SING,C21,O23,no,N,25,,153929,27378,K13
26,,SING,O23,C24,no,N,26,,153929,27378,K13
27,,SING,C24,C25,no,N,27,,153929,27378,K13
28,,SING,C24,C31,no,N,28,,153929,27378,K13
29,,SING,C25,O26,no,N,29,,153929,27378,K13
30,,SING,O26,C27,no,N,30,,153929,27378,K13
31,,SING,C27,O28,no,N,31,,153929,27378,K13
32,,SING,C27,C31,no,N,32,,153929,27378,K13
33,,SING,O28,C29,no,N,33,,153929,27378,K13
34,,SING,C29,C30,no,N,34,,153929,27378,K13
35,,SING,C30,C31,no,N,35,,153929,27378,K13
36,,SING,C32,C38,no,N,36,,153929,27378,K13
37,,DOUB,C33,C34,yes,N,37,,153929,27378,K13
38,,SING,C33,C38,yes,N,38,,153929,27378,K13
39,,SING,C34,C35,yes,N,39,,153929,27378,K13
40,,DOUB,C35,C36,yes,N,40,,153929,27378,K13
41,,SING,C36,C37,yes,N,41,,153929,27378,K13
42,,DOUB,C37,C38,yes,N,42,,153929,27378,K13
43,,SING,N1,HN1,no,N,43,,153929,27378,K13
44,,SING,N1,HN1A,no,N,44,,153929,27378,K13
45,,SING,C3,H3,no,N,45,,153929,27378,K13
46,,SING,C4,H4,no,N,46,,153929,27378,K13
47,,SING,C6,H6,no,N,47,,153929,27378,K13
48,,SING,C7,H7,no,N,48,,153929,27378,K13
49,,SING,C12,H12,no,N,49,,153929,27378,K13
50,,SING,C12,H12A,no,N,50,,153929,27378,K13
51,,SING,C13,H13,no,N,51,,153929,27378,K13
52,,SING,C14,H14,no,N,52,,153929,27378,K13
53,,SING,C14,H14A,no,N,53,,153929,27378,K13
54,,SING,C14,H14B,no,N,54,,153929,27378,K13
55,,SING,C15,H15,no,N,55,,153929,27378,K13
56,,SING,C15,H15A,no,N,56,,153929,27378,K13
57,,SING,C16,H16,no,N,57,,153929,27378,K13
58,,SING,C16,H16A,no,N,58,,153929,27378,K13
59,,SING,C17,H17,no,N,59,,153929,27378,K13
60,,SING,C18,H18,no,N,60,,153929,27378,K13
61,,SING,C18,H18A,no,N,61,,153929,27378,K13
62,,SING,C18,H18B,no,N,62,,153929,27378,K13
63,,SING,O18,HO18,no,N,63,,153929,27378,K13
64,,SING,C19,H19,no,N,64,,153929,27378,K13
65,,SING,N20,HN20,no,N,65,,153929,27378,K13
66,,SING,C24,H24,no,N,66,,153929,27378,K13
67,,SING,C25,H25,no,N,67,,153929,27378,K13
68,,SING,C25,H25A,no,N,68,,153929,27378,K13
69,,SING,C27,H27,no,N,69,,153929,27378,K13
70,,SING,C29,H29,no,N,70,,153929,27378,K13
71,,SING,C29,H29A,no,N,71,,153929,27378,K13
72,,SING,C30,H30,no,N,72,,153929,27378,K13
73,,SING,C30,H30A,no,N,73,,153929,27378,K13
74,,SING,C31,H31,no,N,74,,153929,27378,K13
75,,SING,C32,H32,no,N,75,,153929,27378,K13
76,,SING,C32,H32A,no,N,76,,153929,27378,K13
77,,SING,C33,H33,no,N,77,,153929,27378,K13
78,,SING,C34,H34,no,N,78,,153929,27378,K13
79,,SING,C35,H35,no,N,79,,153929,27378,K13
80,,SING,C36,H36,no,N,80,,153929,27378,K13
81,,SING,C37,H37,no,N,81,,153929,27378,K13
1,,SING,N,CA,no,N,1,,153947,27379,HYP
2,,SING,N,CD,no,N,2,,153947,27379,HYP
3,,SING,N,H,no,N,3,,153947,27379,HYP
4,,SING,CA,C,no,N,4,,153947,27379,HYP
5,,SING,CA,CB,no,N,5,,153947,27379,HYP
6,,SING,CA,HA,no,N,6,,153947,27379,HYP
7,,DOUB,C,O,no,N,7,,153947,27379,HYP
8,,SING,C,OXT,no,N,8,,153947,27379,HYP
9,,SING,CB,CG,no,N,9,,153947,27379,HYP
10,,SING,CB,HB2,no,N,10,,153947,27379,HYP
11,,SING,CB,HB3,no,N,11,,153947,27379,HYP
12,,SING,CG,CD,no,N,12,,153947,27379,HYP
13,,SING,CG,OD1,no,N,13,,153947,27379,HYP
14,,SING,CG,HG,no,N,14,,153947,27379,HYP
15,,SING,CD,HD22,no,N,15,,153947,27379,HYP
16,,SING,CD,HD23,no,N,16,,153947,27379,HYP
17,,SING,OD1,HD1,no,N,17,,153947,27379,HYP
18,,SING,OXT,HXT,no,N,18,,153947,27379,HYP
1,,SING,N,HN1,no,N,1,,153948,27379,NH2
2,,SING,N,HN2,no,N,2,,153948,27379,NH2
1,,SING,N,CA,no,N,1,,153949,27379,PCA
2,,SING,N,CD,no,N,2,,153949,27379,PCA
3,,SING,N,H,no,N,3,,153949,27379,PCA
4,,SING,CA,CB,no,N,4,,153949,27379,PCA
5,,SING,CA,C,no,N,5,,153949,27379,PCA
6,,SING,CA,HA,no,N,6,,153949,27379,PCA
7,,SING,CB,CG,no,N,7,,153949,27379,PCA
8,,SING,CB,HB2,no,N,8,,153949,27379,PCA
9,,SING,CB,HB3,no,N,9,,153949,27379,PCA
10,,SING,CG,CD,no,N,10,,153949,27379,PCA
11,,SING,CG,HG2,no,N,11,,153949,27379,PCA
12,,SING,CG,HG3,no,N,12,,153949,27379,PCA
13,,DOUB,CD,OE,no,N,13,,153949,27379,PCA
14,,DOUB,C,O,no,N,14,,153949,27379,PCA
15,,SING,C,OXT,no,N,15,,153949,27379,PCA
16,,SING,OXT,HXT,no,N,16,,153949,27379,PCA
1,,SING,N,CA,no,N,1,,154000,27382,HYP
2,,SING,N,CD,no,N,2,,154000,27382,HYP
3,,SING,N,H,no,N,3,,154000,27382,HYP
4,,SING,CA,C,no,N,4,,154000,27382,HYP
5,,SING,CA,CB,no,N,5,,154000,27382,HYP
6,,SING,CA,HA,no,N,6,,154000,27382,HYP
7,,DOUB,C,O,no,N,7,,154000,27382,HYP
8,,SING,C,OXT,no,N,8,,154000,27382,HYP
9,,SING,CB,CG,no,N,9,,154000,27382,HYP
10,,SING,CB,HB2,no,N,10,,154000,27382,HYP
11,,SING,CB,HB3,no,N,11,,154000,27382,HYP
12,,SING,CG,CD,no,N,12,,154000,27382,HYP
13,,SING,CG,OD1,no,N,13,,154000,27382,HYP
14,,SING,CG,HG,no,N,14,,154000,27382,HYP
15,,SING,CD,HD22,no,N,15,,154000,27382,HYP
16,,SING,CD,HD23,no,N,16,,154000,27382,HYP
17,,SING,OD1,HD1,no,N,17,,154000,27382,HYP
18,,SING,OXT,HXT,no,N,18,,154000,27382,HYP
1,,SING,N,HN1,no,N,1,,154001,27382,NH2
2,,SING,N,HN2,no,N,2,,154001,27382,NH2
1,,SING,N,CA,no,N,1,,154002,27382,PCA
2,,SING,N,CD,no,N,2,,154002,27382,PCA
3,,SING,N,H,no,N,3,,154002,27382,PCA
4,,SING,CA,CB,no,N,4,,154002,27382,PCA
5,,SING,CA,C,no,N,5,,154002,27382,PCA
6,,SING,CA,HA,no,N,6,,154002,27382,PCA
7,,SING,CB,CG,no,N,7,,154002,27382,PCA
8,,SING,CB,HB2,no,N,8,,154002,27382,PCA
9,,SING,CB,HB3,no,N,9,,154002,27382,PCA
10,,SING,CG,CD,no,N,10,,154002,27382,PCA
11,,SING,CG,HG2,no,N,11,,154002,27382,PCA
12,,SING,CG,HG3,no,N,12,,154002,27382,PCA
13,,DOUB,CD,OE,no,N,13,,154002,27382,PCA
14,,DOUB,C,O,no,N,14,,154002,27382,PCA
15,,SING,C,OXT,no,N,15,,154002,27382,PCA
16,,SING,OXT,HXT,no,N,16,,154002,27382,PCA
1,,SING,N,CA,no,N,1,,154019,27383,HYP
2,,SING,N,CD,no,N,2,,154019,27383,HYP
3,,SING,N,H,no,N,3,,154019,27383,HYP
4,,SING,CA,C,no,N,4,,154019,27383,HYP
5,,SING,CA,CB,no,N,5,,154019,27383,HYP
6,,SING,CA,HA,no,N,6,,154019,27383,HYP
7,,DOUB,C,O,no,N,7,,154019,27383,HYP
8,,SING,C,OXT,no,N,8,,154019,27383,HYP
9,,SING,CB,CG,no,N,9,,154019,27383,HYP
10,,SING,CB,HB2,no,N,10,,154019,27383,HYP
11,,SING,CB,HB3,no,N,11,,154019,27383,HYP
12,,SING,CG,CD,no,N,12,,154019,27383,HYP
13,,SING,CG,OD1,no,N,13,,154019,27383,HYP
14,,SING,CG,HG,no,N,14,,154019,27383,HYP
15,,SING,CD,HD22,no,N,15,,154019,27383,HYP
16,,SING,CD,HD23,no,N,16,,154019,27383,HYP
17,,SING,OD1,HD1,no,N,17,,154019,27383,HYP
18,,SING,OXT,HXT,no,N,18,,154019,27383,HYP
1,,SING,N,HN1,no,N,1,,154020,27383,NH2
2,,SING,N,HN2,no,N,2,,154020,27383,NH2
1,,SING,N,CA,no,N,1,,154021,27383,PCA
2,,SING,N,CD,no,N,2,,154021,27383,PCA
3,,SING,N,H,no,N,3,,154021,27383,PCA
4,,SING,CA,CB,no,N,4,,154021,27383,PCA
5,,SING,CA,C,no,N,5,,154021,27383,PCA
6,,SING,CA,HA,no,N,6,,154021,27383,PCA
7,,SING,CB,CG,no,N,7,,154021,27383,PCA
8,,SING,CB,HB2,no,N,8,,154021,27383,PCA
9,,SING,CB,HB3,no,N,9,,154021,27383,PCA
10,,SING,CG,CD,no,N,10,,154021,27383,PCA
11,,SING,CG,HG2,no,N,11,,154021,27383,PCA
12,,SING,CG,HG3,no,N,12,,154021,27383,PCA
13,,DOUB,CD,OE,no,N,13,,154021,27383,PCA
14,,DOUB,C,O,no,N,14,,154021,27383,PCA
15,,SING,C,OXT,no,N,15,,154021,27383,PCA
16,,SING,OXT,HXT,no,N,16,,154021,27383,PCA
1,,SING,N,CA,no,N,1,,154039,27384,HYP
2,,SING,N,CD,no,N,2,,154039,27384,HYP
3,,SING,N,H,no,N,3,,154039,27384,HYP
4,,SING,CA,C,no,N,4,,154039,27384,HYP
5,,SING,CA,CB,no,N,5,,154039,27384,HYP
6,,SING,CA,HA,no,N,6,,154039,27384,HYP
7,,DOUB,C,O,no,N,7,,154039,27384,HYP
8,,SING,C,OXT,no,N,8,,154039,27384,HYP
9,,SING,CB,CG,no,N,9,,154039,27384,HYP
10,,SING,CB,HB2,no,N,10,,154039,27384,HYP
11,,SING,CB,HB3,no,N,11,,154039,27384,HYP
12,,SING,CG,CD,no,N,12,,154039,27384,HYP
13,,SING,CG,OD1,no,N,13,,154039,27384,HYP
14,,SING,CG,HG,no,N,14,,154039,27384,HYP
15,,SING,CD,HD22,no,N,15,,154039,27384,HYP
16,,SING,CD,HD23,no,N,16,,154039,27384,HYP
17,,SING,OD1,HD1,no,N,17,,154039,27384,HYP
18,,SING,OXT,HXT,no,N,18,,154039,27384,HYP
1,,SING,N,HN1,no,N,1,,154040,27384,NH2
2,,SING,N,HN2,no,N,2,,154040,27384,NH2
1,,SING,N,CA,no,N,1,,154041,27384,PCA
2,,SING,N,CD,no,N,2,,154041,27384,PCA
3,,SING,N,H,no,N,3,,154041,27384,PCA
4,,SING,CA,CB,no,N,4,,154041,27384,PCA
5,,SING,CA,C,no,N,5,,154041,27384,PCA
6,,SING,CA,HA,no,N,6,,154041,27384,PCA
7,,SING,CB,CG,no,N,7,,154041,27384,PCA
8,,SING,CB,HB2,no,N,8,,154041,27384,PCA
9,,SING,CB,HB3,no,N,9,,154041,27384,PCA
10,,SING,CG,CD,no,N,10,,154041,27384,PCA
11,,SING,CG,HG2,no,N,11,,154041,27384,PCA
12,,SING,CG,HG3,no,N,12,,154041,27384,PCA
13,,DOUB,CD,OE,no,N,13,,154041,27384,PCA
14,,DOUB,C,O,no,N,14,,154041,27384,PCA
15,,SING,C,OXT,no,N,15,,154041,27384,PCA
16,,SING,OXT,HXT,no,N,16,,154041,27384,PCA
1,,SING,N,CA,no,N,1,,154058,27385,HYP
2,,SING,N,CD,no,N,2,,154058,27385,HYP
3,,SING,N,H,no,N,3,,154058,27385,HYP
4,,SING,CA,C,no,N,4,,154058,27385,HYP
5,,SING,CA,CB,no,N,5,,154058,27385,HYP
6,,SING,CA,HA,no,N,6,,154058,27385,HYP
7,,DOUB,C,O,no,N,7,,154058,27385,HYP
8,,SING,C,OXT,no,N,8,,154058,27385,HYP
9,,SING,CB,CG,no,N,9,,154058,27385,HYP
10,,SING,CB,HB2,no,N,10,,154058,27385,HYP
11,,SING,CB,HB3,no,N,11,,154058,27385,HYP
12,,SING,CG,CD,no,N,12,,154058,27385,HYP
13,,SING,CG,OD1,no,N,13,,154058,27385,HYP
14,,SING,CG,HG,no,N,14,,154058,27385,HYP
15,,SING,CD,HD22,no,N,15,,154058,27385,HYP
16,,SING,CD,HD23,no,N,16,,154058,27385,HYP
17,,SING,OD1,HD1,no,N,17,,154058,27385,HYP
18,,SING,OXT,HXT,no,N,18,,154058,27385,HYP
1,,SING,N,HN1,no,N,1,,154059,27385,NH2
2,,SING,N,HN2,no,N,2,,154059,27385,NH2
1,,SING,N,CA,no,N,1,,154060,27385,PCA
2,,SING,N,CD,no,N,2,,154060,27385,PCA
3,,SING,N,H,no,N,3,,154060,27385,PCA
4,,SING,CA,CB,no,N,4,,154060,27385,PCA
5,,SING,CA,C,no,N,5,,154060,27385,PCA
6,,SING,CA,HA,no,N,6,,154060,27385,PCA
7,,SING,CB,CG,no,N,7,,154060,27385,PCA
8,,SING,CB,HB2,no,N,8,,154060,27385,PCA
9,,SING,CB,HB3,no,N,9,,154060,27385,PCA
10,,SING,CG,CD,no,N,10,,154060,27385,PCA
11,,SING,CG,HG2,no,N,11,,154060,27385,PCA
12,,SING,CG,HG3,no,N,12,,154060,27385,PCA
13,,DOUB,CD,OE,no,N,13,,154060,27385,PCA
14,,DOUB,C,O,no,N,14,,154060,27385,PCA
15,,SING,C,OXT,no,N,15,,154060,27385,PCA
16,,SING,OXT,HXT,no,N,16,,154060,27385,PCA
1,,SING,N,CA,no,N,1,,154077,27386,HYP
2,,SING,N,CD,no,N,2,,154077,27386,HYP
3,,SING,N,H,no,N,3,,154077,27386,HYP
4,,SING,CA,C,no,N,4,,154077,27386,HYP
5,,SING,CA,CB,no,N,5,,154077,27386,HYP
6,,SING,CA,HA,no,N,6,,154077,27386,HYP
7,,DOUB,C,O,no,N,7,,154077,27386,HYP
8,,SING,C,OXT,no,N,8,,154077,27386,HYP
9,,SING,CB,CG,no,N,9,,154077,27386,HYP
10,,SING,CB,HB2,no,N,10,,154077,27386,HYP
11,,SING,CB,HB3,no,N,11,,154077,27386,HYP
12,,SING,CG,CD,no,N,12,,154077,27386,HYP
13,,SING,CG,OD1,no,N,13,,154077,27386,HYP
14,,SING,CG,HG,no,N,14,,154077,27386,HYP
15,,SING,CD,HD22,no,N,15,,154077,27386,HYP
16,,SING,CD,HD23,no,N,16,,154077,27386,HYP
17,,SING,OD1,HD1,no,N,17,,154077,27386,HYP
18,,SING,OXT,HXT,no,N,18,,154077,27386,HYP
1,,SING,N,HN1,no,N,1,,154078,27386,NH2
2,,SING,N,HN2,no,N,2,,154078,27386,NH2
1,,SING,N,CA,no,N,1,,154079,27386,PCA
2,,SING,N,CD,no,N,2,,154079,27386,PCA
3,,SING,N,H,no,N,3,,154079,27386,PCA
4,,SING,CA,CB,no,N,4,,154079,27386,PCA
5,,SING,CA,C,no,N,5,,154079,27386,PCA
6,,SING,CA,HA,no,N,6,,154079,27386,PCA
7,,SING,CB,CG,no,N,7,,154079,27386,PCA
8,,SING,CB,HB2,no,N,8,,154079,27386,PCA
9,,SING,CB,HB3,no,N,9,,154079,27386,PCA
10,,SING,CG,CD,no,N,10,,154079,27386,PCA
11,,SING,CG,HG2,no,N,11,,154079,27386,PCA
12,,SING,CG,HG3,no,N,12,,154079,27386,PCA
13,,DOUB,CD,OE,no,N,13,,154079,27386,PCA
14,,DOUB,C,O,no,N,14,,154079,27386,PCA
15,,SING,C,OXT,no,N,15,,154079,27386,PCA
16,,SING,OXT,HXT,no,N,16,,154079,27386,PCA
1,,DOUB,PB,O1B,no,N,1,,154097,27387,GDP
2,,SING,PB,O2B,no,N,2,,154097,27387,GDP
3,,SING,PB,O3B,no,N,3,,154097,27387,GDP
4,,SING,PB,O3A,no,N,4,,154097,27387,GDP
5,,SING,O2B,HOB2,no,N,5,,154097,27387,GDP
6,,SING,O3B,HOB3,no,N,6,,154097,27387,GDP
7,,SING,O3A,PA,no,N,7,,154097,27387,GDP
8,,DOUB,PA,O1A,no,N,8,,154097,27387,GDP
9,,SING,PA,O2A,no,N,9,,154097,27387,GDP
10,,SING,PA,O5',no,N,10,,154097,27387,GDP
11,,SING,O2A,HOA2,no,N,11,,154097,27387,GDP
12,,SING,O5',C5',no,N,12,,154097,27387,GDP
13,,SING,C5',C4',no,N,13,,154097,27387,GDP
14,,SING,C5',H5',no,N,14,,154097,27387,GDP
15,,SING,C5',H5'',no,N,15,,154097,27387,GDP
16,,SING,C4',O4',no,N,16,,154097,27387,GDP
17,,SING,C4',C3',no,N,17,,154097,27387,GDP
18,,SING,C4',H4',no,N,18,,154097,27387,GDP
19,,SING,O4',C1',no,N,19,,154097,27387,GDP
20,,SING,C3',O3',no,N,20,,154097,27387,GDP
21,,SING,C3',C2',no,N,21,,154097,27387,GDP
22,,SING,C3',H3',no,N,22,,154097,27387,GDP
23,,SING,O3',HO3',no,N,23,,154097,27387,GDP
24,,SING,C2',O2',no,N,24,,154097,27387,GDP
25,,SING,C2',C1',no,N,25,,154097,27387,GDP
26,,SING,C2',H2',no,N,26,,154097,27387,GDP
27,,SING,O2',HO2',no,N,27,,154097,27387,GDP
28,,SING,C1',N9,no,N,28,,154097,27387,GDP
29,,SING,C1',H1',no,N,29,,154097,27387,GDP
30,,SING,N9,C8,yes,N,30,,154097,27387,GDP
31,,SING,N9,C4,yes,N,31,,154097,27387,GDP
32,,DOUB,C8,N7,yes,N,32,,154097,27387,GDP
33,,SING,C8,H8,no,N,33,,154097,27387,GDP
34,,SING,N7,C5,yes,N,34,,154097,27387,GDP
35,,SING,C5,C6,no,N,35,,154097,27387,GDP
36,,DOUB,C5,C4,yes,N,36,,154097,27387,GDP
37,,DOUB,C6,O6,no,N,37,,154097,27387,GDP
38,,SING,C6,N1,no,N,38,,154097,27387,GDP
39,,SING,N1,C2,no,N,39,,154097,27387,GDP
40,,SING,N1,HN1,no,N,40,,154097,27387,GDP
41,,SING,C2,N2,no,N,41,,154097,27387,GDP
42,,DOUB,C2,N3,no,N,42,,154097,27387,GDP
43,,SING,N2,HN21,no,N,43,,154097,27387,GDP
44,,SING,N2,HN22,no,N,44,,154097,27387,GDP
45,,SING,N3,C4,no,N,45,,154097,27387,GDP
1,,SING,N,CA,no,N,1,,154112,27388,HYP
2,,SING,N,CD,no,N,2,,154112,27388,HYP
3,,SING,N,H,no,N,3,,154112,27388,HYP
4,,SING,CA,C,no,N,4,,154112,27388,HYP
5,,SING,CA,CB,no,N,5,,154112,27388,HYP
6,,SING,CA,HA,no,N,6,,154112,27388,HYP
7,,DOUB,C,O,no,N,7,,154112,27388,HYP
8,,SING,C,OXT,no,N,8,,154112,27388,HYP
9,,SING,CB,CG,no,N,9,,154112,27388,HYP
10,,SING,CB,HB2,no,N,10,,154112,27388,HYP
11,,SING,CB,HB3,no,N,11,,154112,27388,HYP
12,,SING,CG,CD,no,N,12,,154112,27388,HYP
13,,SING,CG,OD1,no,N,13,,154112,27388,HYP
14,,SING,CG,HG,no,N,14,,154112,27388,HYP
15,,SING,CD,HD22,no,N,15,,154112,27388,HYP
16,,SING,CD,HD23,no,N,16,,154112,27388,HYP
17,,SING,OD1,HD1,no,N,17,,154112,27388,HYP
18,,SING,OXT,HXT,no,N,18,,154112,27388,HYP
1,,SING,N,HN1,no,N,1,,154113,27388,NH2
2,,SING,N,HN2,no,N,2,,154113,27388,NH2
1,,SING,N,CA,no,N,1,,154114,27388,PCA
2,,SING,N,CD,no,N,2,,154114,27388,PCA
3,,SING,N,H,no,N,3,,154114,27388,PCA
4,,SING,CA,CB,no,N,4,,154114,27388,PCA
5,,SING,CA,C,no,N,5,,154114,27388,PCA
6,,SING,CA,HA,no,N,6,,154114,27388,PCA
7,,SING,CB,CG,no,N,7,,154114,27388,PCA
8,,SING,CB,HB2,no,N,8,,154114,27388,PCA
9,,SING,CB,HB3,no,N,9,,154114,27388,PCA
10,,SING,CG,CD,no,N,10,,154114,27388,PCA
11,,SING,CG,HG2,no,N,11,,154114,27388,PCA
12,,SING,CG,HG3,no,N,12,,154114,27388,PCA
13,,DOUB,CD,OE,no,N,13,,154114,27388,PCA
14,,DOUB,C,O,no,N,14,,154114,27388,PCA
15,,SING,C,OXT,no,N,15,,154114,27388,PCA
16,,SING,OXT,HXT,no,N,16,,154114,27388,PCA
1,,SING,N,CA,no,N,1,,154131,27389,HYP
2,,SING,N,CD,no,N,2,,154131,27389,HYP
3,,SING,N,H,no,N,3,,154131,27389,HYP
4,,SING,CA,C,no,N,4,,154131,27389,HYP
5,,SING,CA,CB,no,N,5,,154131,27389,HYP
6,,SING,CA,HA,no,N,6,,154131,27389,HYP
7,,DOUB,C,O,no,N,7,,154131,27389,HYP
8,,SING,C,OXT,no,N,8,,154131,27389,HYP
9,,SING,CB,CG,no,N,9,,154131,27389,HYP
10,,SING,CB,HB2,no,N,10,,154131,27389,HYP
11,,SING,CB,HB3,no,N,11,,154131,27389,HYP
12,,SING,CG,CD,no,N,12,,154131,27389,HYP
13,,SING,CG,OD1,no,N,13,,154131,27389,HYP
14,,SING,CG,HG,no,N,14,,154131,27389,HYP
15,,SING,CD,HD22,no,N,15,,154131,27389,HYP
16,,SING,CD,HD23,no,N,16,,154131,27389,HYP
17,,SING,OD1,HD1,no,N,17,,154131,27389,HYP
18,,SING,OXT,HXT,no,N,18,,154131,27389,HYP
1,,SING,N,HN1,no,N,1,,154132,27389,NH2
2,,SING,N,HN2,no,N,2,,154132,27389,NH2
1,,SING,N,CA,no,N,1,,154133,27389,PCA
2,,SING,N,CD,no,N,2,,154133,27389,PCA
3,,SING,N,H,no,N,3,,154133,27389,PCA
4,,SING,CA,CB,no,N,4,,154133,27389,PCA
5,,SING,CA,C,no,N,5,,154133,27389,PCA
6,,SING,CA,HA,no,N,6,,154133,27389,PCA
7,,SING,CB,CG,no,N,7,,154133,27389,PCA
8,,SING,CB,HB2,no,N,8,,154133,27389,PCA
9,,SING,CB,HB3,no,N,9,,154133,27389,PCA
10,,SING,CG,CD,no,N,10,,154133,27389,PCA
11,,SING,CG,HG2,no,N,11,,154133,27389,PCA
12,,SING,CG,HG3,no,N,12,,154133,27389,PCA
13,,DOUB,CD,OE,no,N,13,,154133,27389,PCA
14,,DOUB,C,O,no,N,14,,154133,27389,PCA
15,,SING,C,OXT,no,N,15,,154133,27389,PCA
16,,SING,OXT,HXT,no,N,16,,154133,27389,PCA
1,,SING,N,CA,no,N,1,,154150,27390,HYP
2,,SING,N,CD,no,N,2,,154150,27390,HYP
3,,SING,N,H,no,N,3,,154150,27390,HYP
4,,SING,CA,C,no,N,4,,154150,27390,HYP
5,,SING,CA,CB,no,N,5,,154150,27390,HYP
6,,SING,CA,HA,no,N,6,,154150,27390,HYP
7,,DOUB,C,O,no,N,7,,154150,27390,HYP
8,,SING,C,OXT,no,N,8,,154150,27390,HYP
9,,SING,CB,CG,no,N,9,,154150,27390,HYP
10,,SING,CB,HB2,no,N,10,,154150,27390,HYP
11,,SING,CB,HB3,no,N,11,,154150,27390,HYP
12,,SING,CG,CD,no,N,12,,154150,27390,HYP
13,,SING,CG,OD1,no,N,13,,154150,27390,HYP
14,,SING,CG,HG,no,N,14,,154150,27390,HYP
15,,SING,CD,HD22,no,N,15,,154150,27390,HYP
16,,SING,CD,HD23,no,N,16,,154150,27390,HYP
17,,SING,OD1,HD1,no,N,17,,154150,27390,HYP
18,,SING,OXT,HXT,no,N,18,,154150,27390,HYP
1,,SING,N,HN1,no,N,1,,154151,27390,NH2
2,,SING,N,HN2,no,N,2,,154151,27390,NH2
1,,SING,N,CA,no,N,1,,154152,27390,PCA
2,,SING,N,CD,no,N,2,,154152,27390,PCA
3,,SING,N,H,no,N,3,,154152,27390,PCA
4,,SING,CA,CB,no,N,4,,154152,27390,PCA
5,,SING,CA,C,no,N,5,,154152,27390,PCA
6,,SING,CA,HA,no,N,6,,154152,27390,PCA
7,,SING,CB,CG,no,N,7,,154152,27390,PCA
8,,SING,CB,HB2,no,N,8,,154152,27390,PCA
9,,SING,CB,HB3,no,N,9,,154152,27390,PCA
10,,SING,CG,CD,no,N,10,,154152,27390,PCA
11,,SING,CG,HG2,no,N,11,,154152,27390,PCA
12,,SING,CG,HG3,no,N,12,,154152,27390,PCA
13,,DOUB,CD,OE,no,N,13,,154152,27390,PCA
14,,DOUB,C,O,no,N,14,,154152,27390,PCA
15,,SING,C,OXT,no,N,15,,154152,27390,PCA
16,,SING,OXT,HXT,no,N,16,,154152,27390,PCA
1,,SING,N,CA,no,N,1,,154169,27391,HYP
2,,SING,N,CD,no,N,2,,154169,27391,HYP
3,,SING,N,H,no,N,3,,154169,27391,HYP
4,,SING,CA,C,no,N,4,,154169,27391,HYP
5,,SING,CA,CB,no,N,5,,154169,27391,HYP
6,,SING,CA,HA,no,N,6,,154169,27391,HYP
7,,DOUB,C,O,no,N,7,,154169,27391,HYP
8,,SING,C,OXT,no,N,8,,154169,27391,HYP
9,,SING,CB,CG,no,N,9,,154169,27391,HYP
10,,SING,CB,HB2,no,N,10,,154169,27391,HYP
11,,SING,CB,HB3,no,N,11,,154169,27391,HYP
12,,SING,CG,CD,no,N,12,,154169,27391,HYP
13,,SING,CG,OD1,no,N,13,,154169,27391,HYP
14,,SING,CG,HG,no,N,14,,154169,27391,HYP
15,,SING,CD,HD22,no,N,15,,154169,27391,HYP
16,,SING,CD,HD23,no,N,16,,154169,27391,HYP
17,,SING,OD1,HD1,no,N,17,,154169,27391,HYP
18,,SING,OXT,HXT,no,N,18,,154169,27391,HYP
1,,SING,N,HN1,no,N,1,,154170,27391,NH2
2,,SING,N,HN2,no,N,2,,154170,27391,NH2
1,,SING,N,CA,no,N,1,,154171,27391,PCA
2,,SING,N,CD,no,N,2,,154171,27391,PCA
3,,SING,N,H,no,N,3,,154171,27391,PCA
4,,SING,CA,CB,no,N,4,,154171,27391,PCA
5,,SING,CA,C,no,N,5,,154171,27391,PCA
6,,SING,CA,HA,no,N,6,,154171,27391,PCA
7,,SING,CB,CG,no,N,7,,154171,27391,PCA
8,,SING,CB,HB2,no,N,8,,154171,27391,PCA
9,,SING,CB,HB3,no,N,9,,154171,27391,PCA
10,,SING,CG,CD,no,N,10,,154171,27391,PCA
11,,SING,CG,HG2,no,N,11,,154171,27391,PCA
12,,SING,CG,HG3,no,N,12,,154171,27391,PCA
13,,DOUB,CD,OE,no,N,13,,154171,27391,PCA
14,,DOUB,C,O,no,N,14,,154171,27391,PCA
15,,SING,C,OXT,no,N,15,,154171,27391,PCA
16,,SING,OXT,HXT,no,N,16,,154171,27391,PCA
1,,SING,N,CA,no,N,1,,154630,27417,SAM
2,,SING,N,HN1,no,N,2,,154630,27417,SAM
3,,SING,N,HN2,no,N,3,,154630,27417,SAM
4,,SING,CA,C,no,N,4,,154630,27417,SAM
5,,SING,CA,CB,no,N,5,,154630,27417,SAM
6,,SING,CA,HA,no,N,6,,154630,27417,SAM
7,,DOUB,C,O,no,N,7,,154630,27417,SAM
8,,SING,C,OXT,no,N,8,,154630,27417,SAM
9,,SING,CB,CG,no,N,9,,154630,27417,SAM
10,,SING,CB,HB1,no,N,10,,154630,27417,SAM
11,,SING,CB,HB2,no,N,11,,154630,27417,SAM
12,,SING,CG,SD,no,N,12,,154630,27417,SAM
13,,SING,CG,HG1,no,N,13,,154630,27417,SAM
14,,SING,CG,HG2,no,N,14,,154630,27417,SAM
15,,SING,SD,CE,no,N,15,,154630,27417,SAM
16,,SING,SD,C5',no,N,16,,154630,27417,SAM
17,,SING,CE,HE1,no,N,17,,154630,27417,SAM
18,,SING,CE,HE2,no,N,18,,154630,27417,SAM
19,,SING,CE,HE3,no,N,19,,154630,27417,SAM
20,,SING,C5',C4',no,N,20,,154630,27417,SAM
21,,SING,C5',H5'1,no,N,21,,154630,27417,SAM
22,,SING,C5',H5'2,no,N,22,,154630,27417,SAM
23,,SING,C4',O4',no,N,23,,154630,27417,SAM
24,,SING,C4',C3',no,N,24,,154630,27417,SAM
25,,SING,C4',H4',no,N,25,,154630,27417,SAM
26,,SING,O4',C1',no,N,26,,154630,27417,SAM
27,,SING,C3',O3',no,N,27,,154630,27417,SAM
28,,SING,C3',C2',no,N,28,,154630,27417,SAM
29,,SING,C3',H3',no,N,29,,154630,27417,SAM
30,,SING,O3',HO3',no,N,30,,154630,27417,SAM
31,,SING,C2',O2',no,N,31,,154630,27417,SAM
32,,SING,C2',C1',no,N,32,,154630,27417,SAM
33,,SING,C2',H2',no,N,33,,154630,27417,SAM
34,,SING,O2',HO2',no,N,34,,154630,27417,SAM
35,,SING,C1',N9,no,N,35,,154630,27417,SAM
36,,SING,C1',H1',no,N,36,,154630,27417,SAM
37,,SING,N9,C8,yes,N,37,,154630,27417,SAM
38,,SING,N9,C4,yes,N,38,,154630,27417,SAM
39,,DOUB,C8,N7,yes,N,39,,154630,27417,SAM
40,,SING,C8,H8,no,N,40,,154630,27417,SAM
41,,SING,N7,C5,yes,N,41,,154630,27417,SAM
42,,SING,C5,C6,yes,N,42,,154630,27417,SAM
43,,DOUB,C5,C4,yes,N,43,,154630,27417,SAM
44,,SING,C6,N6,no,N,44,,154630,27417,SAM
45,,DOUB,C6,N1,yes,N,45,,154630,27417,SAM
46,,SING,N6,HN61,no,N,46,,154630,27417,SAM
47,,SING,N6,HN62,no,N,47,,154630,27417,SAM
48,,SING,N1,C2,yes,N,48,,154630,27417,SAM
49,,DOUB,C2,N3,yes,N,49,,154630,27417,SAM
50,,SING,C2,H2,no,N,50,,154630,27417,SAM
51,,SING,N3,C4,yes,N,51,,154630,27417,SAM
1,,SING,NA,C1,no,N,1,,154875,27434,HSE
2,,SING,NA,HN1,no,N,2,,154875,27434,HSE
3,,SING,NA,HN2,no,N,3,,154875,27434,HSE
4,,SING,C1,C2,no,N,4,,154875,27434,HSE
5,,SING,C1,C3,no,N,5,,154875,27434,HSE
6,,SING,C1,H1,no,N,6,,154875,27434,HSE
7,,DOUB,C2,O1,no,N,7,,154875,27434,HSE
8,,SING,C2,O2,no,N,8,,154875,27434,HSE
9,,SING,C3,C4,no,N,9,,154875,27434,HSE
10,,SING,C3,H31,no,N,10,,154875,27434,HSE
11,,SING,C3,H32,no,N,11,,154875,27434,HSE
12,,SING,O2,HO2,no,N,12,,154875,27434,HSE
13,,SING,C4,O3,no,N,13,,154875,27434,HSE
14,,SING,C4,H41,no,N,14,,154875,27434,HSE
15,,SING,C4,H42,no,N,15,,154875,27434,HSE
16,,SING,O3,HO3,no,N,16,,154875,27434,HSE
1,,SING,N1,C1,no,N,1,,154876,27434,HSD
2,,SING,C1,C2,no,N,2,,154876,27434,HSD
3,,DOUB,C2,C3,no,N,3,,154876,27434,HSD
4,,SING,C3,C4,no,N,4,,154876,27434,HSD
5,,SING,C4,O1,no,N,5,,154876,27434,HSD
6,,SING,C3,C5,no,N,6,,154876,27434,HSD
7,,SING,C5,O2,no,N,7,,154876,27434,HSD
8,,SING,C5,C6,no,N,8,,154876,27434,HSD
9,,SING,C6,O3,no,N,9,,154876,27434,HSD
10,,SING,C6,C7,no,N,10,,154876,27434,HSD
11,,SING,C1,C7,no,N,11,,154876,27434,HSD
12,,SING,C7,O4,no,N,12,,154876,27434,HSD
13,,SING,N1,H1,no,N,13,,154876,27434,HSD
14,,SING,N1,H2,no,N,14,,154876,27434,HSD
15,,SING,C1,H3,no,N,15,,154876,27434,HSD
16,,SING,C2,H4,no,N,16,,154876,27434,HSD
17,,SING,C4,H5,no,N,17,,154876,27434,HSD
18,,SING,C4,H6,no,N,18,,154876,27434,HSD
19,,SING,O1,H7,no,N,19,,154876,27434,HSD
20,,SING,C5,H8,no,N,20,,154876,27434,HSD
21,,SING,O2,H9,no,N,21,,154876,27434,HSD
22,,SING,C6,H10,no,N,22,,154876,27434,HSD
23,,SING,O3,H11,no,N,23,,154876,27434,HSD
24,,SING,C7,H12,no,N,24,,154876,27434,HSD
25,,SING,O4,H13,no,N,25,,154876,27434,HSD
1,,DOUB,C1,C2,yes,N,1,,154877,27434,PCB
2,,SING,C1,C6,yes,N,2,,154877,27434,PCB
3,,SING,C1,C1',yes,N,3,,154877,27434,PCB
4,,SING,C2,CL2,no,N,4,,154877,27434,PCB
5,,SING,C2,C3,yes,N,5,,154877,27434,PCB
6,,DOUB,C3,C4,yes,N,6,,154877,27434,PCB
7,,SING,C3,H3,no,N,7,,154877,27434,PCB
8,,SING,C4,C5,yes,N,8,,154877,27434,PCB
9,,SING,C4,S,no,N,9,,154877,27434,PCB
10,,SING,C5,CL5,no,N,10,,154877,27434,PCB
11,,DOUB,C5,C6,yes,N,11,,154877,27434,PCB
12,,SING,C6,H6,no,N,12,,154877,27434,PCB
13,,DOUB,S,O1,no,N,13,,154877,27434,PCB
14,,DOUB,S,O2,no,N,14,,154877,27434,PCB
15,,SING,S,CM,no,N,15,,154877,27434,PCB
16,,SING,CM,HM1,no,N,16,,154877,27434,PCB
17,,SING,CM,HM2,no,N,17,,154877,27434,PCB
18,,SING,CM,HM3,no,N,18,,154877,27434,PCB
19,,DOUB,C1',C2',yes,N,19,,154877,27434,PCB
20,,SING,C1',C6',yes,N,20,,154877,27434,PCB
21,,SING,C2',CL2',no,N,21,,154877,27434,PCB
22,,SING,C2',C3',yes,N,22,,154877,27434,PCB
23,,DOUB,C3',C4',yes,N,23,,154877,27434,PCB
24,,SING,C3',H3',no,N,24,,154877,27434,PCB
25,,SING,C4',C5',yes,N,25,,154877,27434,PCB
26,,SING,C4',S',no,N,26,,154877,27434,PCB
27,,SING,C5',CL5',no,N,27,,154877,27434,PCB
28,,DOUB,C5',C6',yes,N,28,,154877,27434,PCB
29,,SING,C6',H6',no,N,29,,154877,27434,PCB
30,,DOUB,S',O1',no,N,30,,154877,27434,PCB
31,,DOUB,S',O2',no,N,31,,154877,27434,PCB
32,,SING,S',CM',no,N,32,,154877,27434,PCB
33,,SING,CM',HM'1,no,N,33,,154877,27434,PCB
34,,SING,CM',HM'2,no,N,34,,154877,27434,PCB
35,,SING,CM',HM'3,no,N,35,,154877,27434,PCB
1,,SING,N,CA,no,N,1,,155184,27452,SAH
2,,SING,N,HN1,no,N,2,,155184,27452,SAH
3,,SING,N,HN2,no,N,3,,155184,27452,SAH
4,,SING,CA,CB,no,N,4,,155184,27452,SAH
5,,SING,CA,C,no,N,5,,155184,27452,SAH
6,,SING,CA,HA,no,N,6,,155184,27452,SAH
7,,SING,CB,CG,no,N,7,,155184,27452,SAH
8,,SING,CB,HB1,no,N,8,,155184,27452,SAH
9,,SING,CB,HB2,no,N,9,,155184,27452,SAH
10,,SING,CG,SD,no,N,10,,155184,27452,SAH
11,,SING,CG,HG1,no,N,11,,155184,27452,SAH
12,,SING,CG,HG2,no,N,12,,155184,27452,SAH
13,,SING,SD,C5',no,N,13,,155184,27452,SAH
14,,DOUB,C,O,no,N,14,,155184,27452,SAH
15,,SING,C,OXT,no,N,15,,155184,27452,SAH
16,,SING,OXT,HXT,no,N,16,,155184,27452,SAH
17,,SING,C5',C4',no,N,17,,155184,27452,SAH
18,,SING,C5',H5'1,no,N,18,,155184,27452,SAH
19,,SING,C5',H5'2,no,N,19,,155184,27452,SAH
20,,SING,C4',O4',no,N,20,,155184,27452,SAH
21,,SING,C4',C3',no,N,21,,155184,27452,SAH
22,,SING,C4',H4',no,N,22,,155184,27452,SAH
23,,SING,O4',C1',no,N,23,,155184,27452,SAH
24,,SING,C3',O3',no,N,24,,155184,27452,SAH
25,,SING,C3',C2',no,N,25,,155184,27452,SAH
26,,SING,C3',H3',no,N,26,,155184,27452,SAH
27,,SING,O3',HO3',no,N,27,,155184,27452,SAH
28,,SING,C2',O2',no,N,28,,155184,27452,SAH
29,,SING,C2',C1',no,N,29,,155184,27452,SAH
30,,SING,C2',H2',no,N,30,,155184,27452,SAH
31,,SING,O2',HO2',no,N,31,,155184,27452,SAH
32,,SING,C1',N9,no,N,32,,155184,27452,SAH
33,,SING,C1',H1',no,N,33,,155184,27452,SAH
34,,SING,N9,C8,yes,N,34,,155184,27452,SAH
35,,SING,N9,C4,yes,N,35,,155184,27452,SAH
36,,DOUB,C8,N7,yes,N,36,,155184,27452,SAH
37,,SING,C8,H8,no,N,37,,155184,27452,SAH
38,,SING,N7,C5,yes,N,38,,155184,27452,SAH
39,,SING,C5,C6,yes,N,39,,155184,27452,SAH
40,,DOUB,C5,C4,yes,N,40,,155184,27452,SAH
41,,SING,C6,N6,no,N,41,,155184,27452,SAH
42,,DOUB,C6,N1,yes,N,42,,155184,27452,SAH
43,,SING,N6,HN61,no,N,43,,155184,27452,SAH
44,,SING,N6,HN62,no,N,44,,155184,27452,SAH
45,,SING,N1,C2,yes,N,45,,155184,27452,SAH
46,,DOUB,C2,N3,yes,N,46,,155184,27452,SAH
47,,SING,C2,H2,no,N,47,,155184,27452,SAH
48,,SING,N3,C4,yes,N,48,,155184,27452,SAH
1,,DOUB,PA,O1A,no,N,1,,155380,27463,NAP
2,,SING,PA,O2A,no,N,2,,155380,27463,NAP
3,,SING,PA,O5B,no,N,3,,155380,27463,NAP
4,,SING,PA,O3,no,N,4,,155380,27463,NAP
5,,SING,O2A,HOA2,no,N,5,,155380,27463,NAP
6,,SING,O5B,C5B,no,N,6,,155380,27463,NAP
7,,SING,C5B,C4B,no,N,7,,155380,27463,NAP
8,,SING,C5B,H51A,no,N,8,,155380,27463,NAP
9,,SING,C5B,H52A,no,N,9,,155380,27463,NAP
10,,SING,C4B,O4B,no,N,10,,155380,27463,NAP
11,,SING,C4B,C3B,no,N,11,,155380,27463,NAP
12,,SING,C4B,H4B,no,N,12,,155380,27463,NAP
13,,SING,O4B,C1B,no,N,13,,155380,27463,NAP
14,,SING,C3B,O3B,no,N,14,,155380,27463,NAP
15,,SING,C3B,C2B,no,N,15,,155380,27463,NAP
16,,SING,C3B,H3B,no,N,16,,155380,27463,NAP
17,,SING,O3B,HO3A,no,N,17,,155380,27463,NAP
18,,SING,C2B,O2B,no,N,18,,155380,27463,NAP
19,,SING,C2B,C1B,no,N,19,,155380,27463,NAP
20,,SING,C2B,H2B,no,N,20,,155380,27463,NAP
21,,SING,O2B,P2B,no,N,21,,155380,27463,NAP
22,,SING,C1B,N9A,no,N,22,,155380,27463,NAP
23,,SING,C1B,H1B,no,N,23,,155380,27463,NAP
24,,SING,N9A,C8A,yes,N,24,,155380,27463,NAP
25,,SING,N9A,C4A,yes,N,25,,155380,27463,NAP
26,,DOUB,C8A,N7A,yes,N,26,,155380,27463,NAP
27,,SING,C8A,H8A,no,N,27,,155380,27463,NAP
28,,SING,N7A,C5A,yes,N,28,,155380,27463,NAP
29,,SING,C5A,C6A,yes,N,29,,155380,27463,NAP
30,,DOUB,C5A,C4A,yes,N,30,,155380,27463,NAP
31,,SING,C6A,N6A,no,N,31,,155380,27463,NAP
32,,DOUB,C6A,N1A,yes,N,32,,155380,27463,NAP
33,,SING,N6A,H61A,no,N,33,,155380,27463,NAP
34,,SING,N6A,H62A,no,N,34,,155380,27463,NAP
35,,SING,N1A,C2A,yes,N,35,,155380,27463,NAP
36,,DOUB,C2A,N3A,yes,N,36,,155380,27463,NAP
37,,SING,C2A,H2A,no,N,37,,155380,27463,NAP
38,,SING,N3A,C4A,yes,N,38,,155380,27463,NAP
39,,SING,O3,PN,no,N,39,,155380,27463,NAP
40,,DOUB,PN,O1N,no,N,40,,155380,27463,NAP
41,,SING,PN,O2N,no,N,41,,155380,27463,NAP
42,,SING,PN,O5D,no,N,42,,155380,27463,NAP
43,,SING,O5D,C5D,no,N,43,,155380,27463,NAP
44,,SING,C5D,C4D,no,N,44,,155380,27463,NAP
45,,SING,C5D,H51N,no,N,45,,155380,27463,NAP
46,,SING,C5D,H52N,no,N,46,,155380,27463,NAP
47,,SING,C4D,O4D,no,N,47,,155380,27463,NAP
48,,SING,C4D,C3D,no,N,48,,155380,27463,NAP
49,,SING,C4D,H4D,no,N,49,,155380,27463,NAP
50,,SING,O4D,C1D,no,N,50,,155380,27463,NAP
51,,SING,C3D,O3D,no,N,51,,155380,27463,NAP
52,,SING,C3D,C2D,no,N,52,,155380,27463,NAP
53,,SING,C3D,H3D,no,N,53,,155380,27463,NAP
54,,SING,O3D,HO3N,no,N,54,,155380,27463,NAP
55,,SING,C2D,O2D,no,N,55,,155380,27463,NAP
56,,SING,C2D,C1D,no,N,56,,155380,27463,NAP
57,,SING,C2D,H2D,no,N,57,,155380,27463,NAP
58,,SING,O2D,HO2N,no,N,58,,155380,27463,NAP
59,,SING,C1D,N1N,no,N,59,,155380,27463,NAP
60,,SING,C1D,H1D,no,N,60,,155380,27463,NAP
61,,SING,N1N,C2N,yes,N,61,,155380,27463,NAP
62,,DOUB,N1N,C6N,yes,N,62,,155380,27463,NAP
63,,DOUB,C2N,C3N,yes,N,63,,155380,27463,NAP
64,,SING,C2N,H2N,no,N,64,,155380,27463,NAP
65,,SING,C3N,C7N,no,N,65,,155380,27463,NAP
66,,SING,C3N,C4N,yes,N,66,,155380,27463,NAP
67,,DOUB,C7N,O7N,no,N,67,,155380,27463,NAP
68,,SING,C7N,N7N,no,N,68,,155380,27463,NAP
69,,SING,N7N,H71N,no,N,69,,155380,27463,NAP
70,,SING,N7N,H72N,no,N,70,,155380,27463,NAP
71,,DOUB,C4N,C5N,yes,N,71,,155380,27463,NAP
72,,SING,C4N,H4N,no,N,72,,155380,27463,NAP
73,,SING,C5N,C6N,yes,N,73,,155380,27463,NAP
74,,SING,C5N,H5N,no,N,74,,155380,27463,NAP
75,,SING,C6N,H6N,no,N,75,,155380,27463,NAP
76,,DOUB,P2B,O1X,no,N,76,,155380,27463,NAP
77,,SING,P2B,O2X,no,N,77,,155380,27463,NAP
78,,SING,P2B,O3X,no,N,78,,155380,27463,NAP
79,,SING,O2X,HOP2,no,N,79,,155380,27463,NAP
80,,SING,O3X,HOP3,no,N,80,,155380,27463,NAP
1,,SING,C1,C2,no,N,1,,155411,27465,RET
2,,SING,C1,C6,no,N,2,,155411,27465,RET
3,,SING,C1,C16,no,N,3,,155411,27465,RET
4,,SING,C1,C17,no,N,4,,155411,27465,RET
5,,SING,C2,C3,no,N,5,,155411,27465,RET
6,,SING,C2,H21,no,N,6,,155411,27465,RET
7,,SING,C2,H22,no,N,7,,155411,27465,RET
8,,SING,C3,C4,no,N,8,,155411,27465,RET
9,,SING,C3,H31,no,N,9,,155411,27465,RET
10,,SING,C3,H32,no,N,10,,155411,27465,RET
11,,SING,C4,C5,no,N,11,,155411,27465,RET
12,,SING,C4,H41,no,N,12,,155411,27465,RET
13,,SING,C4,H42,no,N,13,,155411,27465,RET
14,,DOUB,C5,C6,no,N,14,,155411,27465,RET
15,,SING,C5,C18,no,N,15,,155411,27465,RET
16,,SING,C6,C7,no,N,16,,155411,27465,RET
17,,DOUB,C7,C8,no,E,17,,155411,27465,RET
18,,SING,C7,H7,no,N,18,,155411,27465,RET
19,,SING,C8,C9,no,N,19,,155411,27465,RET
20,,SING,C8,H8,no,N,20,,155411,27465,RET
21,,DOUB,C9,C10,no,E,21,,155411,27465,RET
22,,SING,C9,C19,no,N,22,,155411,27465,RET
23,,SING,C10,C11,no,N,23,,155411,27465,RET
24,,SING,C10,H10,no,N,24,,155411,27465,RET
25,,DOUB,C11,C12,no,E,25,,155411,27465,RET
26,,SING,C11,H11,no,N,26,,155411,27465,RET
27,,SING,C12,C13,no,N,27,,155411,27465,RET
28,,SING,C12,H12,no,N,28,,155411,27465,RET
29,,DOUB,C13,C14,no,E,29,,155411,27465,RET
30,,SING,C13,C20,no,N,30,,155411,27465,RET
31,,SING,C14,C15,no,N,31,,155411,27465,RET
32,,SING,C14,H14,no,N,32,,155411,27465,RET
33,,DOUB,C15,O1,no,N,33,,155411,27465,RET
34,,SING,C15,H15,no,N,34,,155411,27465,RET
35,,SING,C16,H161,no,N,35,,155411,27465,RET
36,,SING,C16,H162,no,N,36,,155411,27465,RET
37,,SING,C16,H163,no,N,37,,155411,27465,RET
38,,SING,C17,H171,no,N,38,,155411,27465,RET
39,,SING,C17,H172,no,N,39,,155411,27465,RET
40,,SING,C17,H173,no,N,40,,155411,27465,RET
41,,SING,C18,H181,no,N,41,,155411,27465,RET
42,,SING,C18,H182,no,N,42,,155411,27465,RET
43,,SING,C18,H183,no,N,43,,155411,27465,RET
44,,SING,C19,H191,no,N,44,,155411,27465,RET
45,,SING,C19,H192,no,N,45,,155411,27465,RET
46,,SING,C19,H193,no,N,46,,155411,27465,RET
47,,SING,C20,H201,no,N,47,,155411,27465,RET
48,,SING,C20,H202,no,N,48,,155411,27465,RET
49,,SING,C20,H203,no,N,49,,155411,27465,RET
1,,SING,N1,C2,no,N,1,,155477,27469,FMN
2,,DOUB,N1,C10,no,N,2,,155477,27469,FMN
3,,DOUB,C2,O2,no,N,3,,155477,27469,FMN
4,,SING,C2,N3,no,N,4,,155477,27469,FMN
5,,SING,N3,C4,no,N,5,,155477,27469,FMN
6,,SING,N3,HN3,no,N,6,,155477,27469,FMN
7,,DOUB,C4,O4,no,N,7,,155477,27469,FMN
8,,SING,C4,C4A,no,N,8,,155477,27469,FMN
9,,DOUB,C4A,N5,no,N,9,,155477,27469,FMN
10,,SING,C4A,C10,no,N,10,,155477,27469,FMN
11,,SING,N5,C5A,no,N,11,,155477,27469,FMN
12,,DOUB,C5A,C6,yes,N,12,,155477,27469,FMN
13,,SING,C5A,C9A,yes,N,13,,155477,27469,FMN
14,,SING,C6,C7,yes,N,14,,155477,27469,FMN
15,,SING,C6,H6,no,N,15,,155477,27469,FMN
16,,SING,C7,C7M,no,N,16,,155477,27469,FMN
17,,DOUB,C7,C8,yes,N,17,,155477,27469,FMN
18,,SING,C7M,HM71,no,N,18,,155477,27469,FMN
19,,SING,C7M,HM72,no,N,19,,155477,27469,FMN
20,,SING,C7M,HM73,no,N,20,,155477,27469,FMN
21,,SING,C8,C8M,no,N,21,,155477,27469,FMN
22,,SING,C8,C9,yes,N,22,,155477,27469,FMN
23,,SING,C8M,HM81,no,N,23,,155477,27469,FMN
24,,SING,C8M,HM82,no,N,24,,155477,27469,FMN
25,,SING,C8M,HM83,no,N,25,,155477,27469,FMN
26,,DOUB,C9,C9A,yes,N,26,,155477,27469,FMN
27,,SING,C9,H9,no,N,27,,155477,27469,FMN
28,,SING,C9A,N10,no,N,28,,155477,27469,FMN
29,,SING,N10,C10,no,N,29,,155477,27469,FMN
30,,SING,N10,C1',no,N,30,,155477,27469,FMN
31,,SING,C1',C2',no,N,31,,155477,27469,FMN
32,,SING,C1',H1'1,no,N,32,,155477,27469,FMN
33,,SING,C1',H1'2,no,N,33,,155477,27469,FMN
34,,SING,C2',O2',no,N,34,,155477,27469,FMN
35,,SING,C2',C3',no,N,35,,155477,27469,FMN
36,,SING,C2',H2',no,N,36,,155477,27469,FMN
37,,SING,O2',HO2',no,N,37,,155477,27469,FMN
38,,SING,C3',O3',no,N,38,,155477,27469,FMN
39,,SING,C3',C4',no,N,39,,155477,27469,FMN
40,,SING,C3',H3',no,N,40,,155477,27469,FMN
41,,SING,O3',HO3',no,N,41,,155477,27469,FMN
42,,SING,C4',O4',no,N,42,,155477,27469,FMN
43,,SING,C4',C5',no,N,43,,155477,27469,FMN
44,,SING,C4',H4',no,N,44,,155477,27469,FMN
45,,SING,O4',HO4',no,N,45,,155477,27469,FMN
46,,SING,C5',O5',no,N,46,,155477,27469,FMN
47,,SING,C5',H5'1,no,N,47,,155477,27469,FMN
48,,SING,C5',H5'2,no,N,48,,155477,27469,FMN
49,,SING,O5',P,no,N,49,,155477,27469,FMN
50,,DOUB,P,O1P,no,N,50,,155477,27469,FMN
51,,SING,P,O2P,no,N,51,,155477,27469,FMN
52,,SING,P,O3P,no,N,52,,155477,27469,FMN
53,,SING,O2P,HOP2,no,N,53,,155477,27469,FMN
54,,SING,O3P,HOP3,no,N,54,,155477,27469,FMN
1,,SING,N1,C2,no,N,1,,155494,27470,FMN
2,,DOUB,N1,C10,no,N,2,,155494,27470,FMN
3,,DOUB,C2,O2,no,N,3,,155494,27470,FMN
4,,SING,C2,N3,no,N,4,,155494,27470,FMN
5,,SING,N3,C4,no,N,5,,155494,27470,FMN
6,,SING,N3,HN3,no,N,6,,155494,27470,FMN
7,,DOUB,C4,O4,no,N,7,,155494,27470,FMN
8,,SING,C4,C4A,no,N,8,,155494,27470,FMN
9,,DOUB,C4A,N5,no,N,9,,155494,27470,FMN
10,,SING,C4A,C10,no,N,10,,155494,27470,FMN
11,,SING,N5,C5A,no,N,11,,155494,27470,FMN
12,,DOUB,C5A,C6,yes,N,12,,155494,27470,FMN
13,,SING,C5A,C9A,yes,N,13,,155494,27470,FMN
14,,SING,C6,C7,yes,N,14,,155494,27470,FMN
15,,SING,C6,H6,no,N,15,,155494,27470,FMN
16,,SING,C7,C7M,no,N,16,,155494,27470,FMN
17,,DOUB,C7,C8,yes,N,17,,155494,27470,FMN
18,,SING,C7M,HM71,no,N,18,,155494,27470,FMN
19,,SING,C7M,HM72,no,N,19,,155494,27470,FMN
20,,SING,C7M,HM73,no,N,20,,155494,27470,FMN
21,,SING,C8,C8M,no,N,21,,155494,27470,FMN
22,,SING,C8,C9,yes,N,22,,155494,27470,FMN
23,,SING,C8M,HM81,no,N,23,,155494,27470,FMN
24,,SING,C8M,HM82,no,N,24,,155494,27470,FMN
25,,SING,C8M,HM83,no,N,25,,155494,27470,FMN
26,,DOUB,C9,C9A,yes,N,26,,155494,27470,FMN
27,,SING,C9,H9,no,N,27,,155494,27470,FMN
28,,SING,C9A,N10,no,N,28,,155494,27470,FMN
29,,SING,N10,C10,no,N,29,,155494,27470,FMN
30,,SING,N10,C1',no,N,30,,155494,27470,FMN
31,,SING,C1',C2',no,N,31,,155494,27470,FMN
32,,SING,C1',H1'1,no,N,32,,155494,27470,FMN
33,,SING,C1',H1'2,no,N,33,,155494,27470,FMN
34,,SING,C2',O2',no,N,34,,155494,27470,FMN
35,,SING,C2',C3',no,N,35,,155494,27470,FMN
36,,SING,C2',H2',no,N,36,,155494,27470,FMN
37,,SING,O2',HO2',no,N,37,,155494,27470,FMN
38,,SING,C3',O3',no,N,38,,155494,27470,FMN
39,,SING,C3',C4',no,N,39,,155494,27470,FMN
40,,SING,C3',H3',no,N,40,,155494,27470,FMN
41,,SING,O3',HO3',no,N,41,,155494,27470,FMN
42,,SING,C4',O4',no,N,42,,155494,27470,FMN
43,,SING,C4',C5',no,N,43,,155494,27470,FMN
44,,SING,C4',H4',no,N,44,,155494,27470,FMN
45,,SING,O4',HO4',no,N,45,,155494,27470,FMN
46,,SING,C5',O5',no,N,46,,155494,27470,FMN
47,,SING,C5',H5'1,no,N,47,,155494,27470,FMN
48,,SING,C5',H5'2,no,N,48,,155494,27470,FMN
49,,SING,O5',P,no,N,49,,155494,27470,FMN
50,,DOUB,P,O1P,no,N,50,,155494,27470,FMN
51,,SING,P,O2P,no,N,51,,155494,27470,FMN
52,,SING,P,O3P,no,N,52,,155494,27470,FMN
53,,SING,O2P,HOP2,no,N,53,,155494,27470,FMN
54,,SING,O3P,HOP3,no,N,54,,155494,27470,FMN
1,,SING,N,CA,no,N,1,,155614,27478,ZAE
2,,SING,N,C10,no,N,2,,155614,27478,ZAE
3,,SING,N,H,no,N,3,,155614,27478,ZAE
4,,SING,CA,C,no,N,4,,155614,27478,ZAE
5,,SING,CA,CB,no,N,5,,155614,27478,ZAE
6,,SING,CA,HA,no,N,6,,155614,27478,ZAE
7,,DOUB,C,O,no,N,7,,155614,27478,ZAE
8,,SING,C,OXT,no,N,8,,155614,27478,ZAE
9,,SING,OXT,HXT,no,N,9,,155614,27478,ZAE
10,,SING,CB,CG,no,N,10,,155614,27478,ZAE
11,,SING,CB,HB2,no,N,11,,155614,27478,ZAE
12,,SING,CB,HB3,no,N,12,,155614,27478,ZAE
13,,DOUB,CG,CD1,yes,N,13,,155614,27478,ZAE
14,,SING,CG,CD2,yes,N,14,,155614,27478,ZAE
15,,SING,CD1,CE1,yes,N,15,,155614,27478,ZAE
16,,SING,CD1,HD1,no,N,16,,155614,27478,ZAE
17,,DOUB,CD2,CE2,yes,N,17,,155614,27478,ZAE
18,,SING,CD2,HD2,no,N,18,,155614,27478,ZAE
19,,DOUB,CE1,CZ,yes,N,19,,155614,27478,ZAE
20,,SING,CE1,HE1,no,N,20,,155614,27478,ZAE
21,,SING,CE2,CZ,yes,N,21,,155614,27478,ZAE
22,,SING,CE2,HE2,no,N,22,,155614,27478,ZAE
23,,SING,CZ,HZ,no,N,23,,155614,27478,ZAE
24,,SING,C10,H11,no,N,24,,155614,27478,ZAE
25,,SING,C10,H12,no,N,25,,155614,27478,ZAE
26,,SING,C10,H13,no,N,26,,155614,27478,ZAE
1,,SING,N,CA,no,N,1,,155615,27478,DGN
2,,SING,N,H,no,N,2,,155615,27478,DGN
3,,SING,N,H2,no,N,3,,155615,27478,DGN
4,,SING,CA,C,no,N,4,,155615,27478,DGN
5,,SING,CA,CB,no,N,5,,155615,27478,DGN
6,,SING,CA,HA,no,N,6,,155615,27478,DGN
7,,DOUB,C,O,no,N,7,,155615,27478,DGN
8,,SING,C,OXT,no,N,8,,155615,27478,DGN
9,,SING,OXT,HXT,no,N,9,,155615,27478,DGN
10,,SING,CB,CG,no,N,10,,155615,27478,DGN
11,,SING,CB,HB2,no,N,11,,155615,27478,DGN
12,,SING,CB,HB3,no,N,12,,155615,27478,DGN
13,,SING,CG,CD,no,N,13,,155615,27478,DGN
14,,SING,CG,HG2,no,N,14,,155615,27478,DGN
15,,SING,CG,HG3,no,N,15,,155615,27478,DGN
16,,DOUB,CD,OE1,no,N,16,,155615,27478,DGN
17,,SING,CD,NE2,no,N,17,,155615,27478,DGN
18,,SING,NE2,HE21,no,N,18,,155615,27478,DGN
19,,SING,NE2,HE22,no,N,19,,155615,27478,DGN
1,,SING,CG2,CB,no,N,1,,155616,27478,28J
2,,SING,CB,CG1,no,N,2,,155616,27478,28J
3,,SING,CB,CA,no,N,3,,155616,27478,28J
4,,SING,CG1,CD1,no,N,4,,155616,27478,28J
5,,SING,CA,N,no,N,5,,155616,27478,28J
6,,SING,CA,C,no,N,6,,155616,27478,28J
7,,DOUB,C,O,no,N,7,,155616,27478,28J
8,,SING,N,H20,no,N,8,,155616,27478,28J
9,,SING,CA,H21,no,N,9,,155616,27478,28J
10,,SING,CB,H22,no,N,10,,155616,27478,28J
11,,SING,CG2,H23,no,N,11,,155616,27478,28J
12,,SING,CG2,H24,no,N,12,,155616,27478,28J
13,,SING,CG2,H25,no,N,13,,155616,27478,28J
14,,SING,CG1,H26,no,N,14,,155616,27478,28J
15,,SING,CG1,H27,no,N,15,,155616,27478,28J
16,,SING,CD1,H28,no,N,16,,155616,27478,28J
17,,SING,CD1,H29,no,N,17,,155616,27478,28J
18,,SING,CD1,H30,no,N,18,,155616,27478,28J
19,,SING,N,H2,no,N,19,,155616,27478,28J
20,,SING,C,OXT,no,N,20,,155616,27478,28J
21,,SING,OXT,HXT,no,N,21,,155616,27478,28J
1,,SING,N,CA,no,N,1,,155617,27478,DTH
2,,SING,N,H,no,N,2,,155617,27478,DTH
3,,SING,N,HN2,no,N,3,,155617,27478,DTH
4,,SING,CA,CB,no,N,4,,155617,27478,DTH
5,,SING,CA,C,no,N,5,,155617,27478,DTH
6,,SING,CA,HA,no,N,6,,155617,27478,DTH
7,,SING,CB,CG2,no,N,7,,155617,27478,DTH
8,,SING,CB,OG1,no,N,8,,155617,27478,DTH
9,,SING,CB,HB,no,N,9,,155617,27478,DTH
10,,SING,CG2,HG21,no,N,10,,155617,27478,DTH
11,,SING,CG2,HG22,no,N,11,,155617,27478,DTH
12,,SING,CG2,HG23,no,N,12,,155617,27478,DTH
13,,SING,OG1,HG1,no,N,13,,155617,27478,DTH
14,,DOUB,C,O,no,N,14,,155617,27478,DTH
15,,SING,C,OXT,no,N,15,,155617,27478,DTH
16,,SING,OXT,HXT,no,N,16,,155617,27478,DTH
1,,SING,N,CA,no,N,1,,155632,27479,ZAE
2,,SING,N,C10,no,N,2,,155632,27479,ZAE
3,,SING,N,H,no,N,3,,155632,27479,ZAE
4,,SING,CA,C,no,N,4,,155632,27479,ZAE
5,,SING,CA,CB,no,N,5,,155632,27479,ZAE
6,,SING,CA,HA,no,N,6,,155632,27479,ZAE
7,,DOUB,C,O,no,N,7,,155632,27479,ZAE
8,,SING,C,OXT,no,N,8,,155632,27479,ZAE
9,,SING,OXT,HXT,no,N,9,,155632,27479,ZAE
10,,SING,CB,CG,no,N,10,,155632,27479,ZAE
11,,SING,CB,HB2,no,N,11,,155632,27479,ZAE
12,,SING,CB,HB3,no,N,12,,155632,27479,ZAE
13,,DOUB,CG,CD1,yes,N,13,,155632,27479,ZAE
14,,SING,CG,CD2,yes,N,14,,155632,27479,ZAE
15,,SING,CD1,CE1,yes,N,15,,155632,27479,ZAE
16,,SING,CD1,HD1,no,N,16,,155632,27479,ZAE
17,,DOUB,CD2,CE2,yes,N,17,,155632,27479,ZAE
18,,SING,CD2,HD2,no,N,18,,155632,27479,ZAE
19,,DOUB,CE1,CZ,yes,N,19,,155632,27479,ZAE
20,,SING,CE1,HE1,no,N,20,,155632,27479,ZAE
21,,SING,CE2,CZ,yes,N,21,,155632,27479,ZAE
22,,SING,CE2,HE2,no,N,22,,155632,27479,ZAE
23,,SING,CZ,HZ,no,N,23,,155632,27479,ZAE
24,,SING,C10,H11,no,N,24,,155632,27479,ZAE
25,,SING,C10,H12,no,N,25,,155632,27479,ZAE
26,,SING,C10,H13,no,N,26,,155632,27479,ZAE
1,,SING,N,CA,no,N,1,,155633,27479,DGN
2,,SING,N,H,no,N,2,,155633,27479,DGN
3,,SING,N,H2,no,N,3,,155633,27479,DGN
4,,SING,CA,C,no,N,4,,155633,27479,DGN
5,,SING,CA,CB,no,N,5,,155633,27479,DGN
6,,SING,CA,HA,no,N,6,,155633,27479,DGN
7,,DOUB,C,O,no,N,7,,155633,27479,DGN
8,,SING,C,OXT,no,N,8,,155633,27479,DGN
9,,SING,OXT,HXT,no,N,9,,155633,27479,DGN
10,,SING,CB,CG,no,N,10,,155633,27479,DGN
11,,SING,CB,HB2,no,N,11,,155633,27479,DGN
12,,SING,CB,HB3,no,N,12,,155633,27479,DGN
13,,SING,CG,CD,no,N,13,,155633,27479,DGN
14,,SING,CG,HG2,no,N,14,,155633,27479,DGN
15,,SING,CG,HG3,no,N,15,,155633,27479,DGN
16,,DOUB,CD,OE1,no,N,16,,155633,27479,DGN
17,,SING,CD,NE2,no,N,17,,155633,27479,DGN
18,,SING,NE2,HE21,no,N,18,,155633,27479,DGN
19,,SING,NE2,HE22,no,N,19,,155633,27479,DGN
1,,SING,CG2,CB,no,N,1,,155634,27479,28J
2,,SING,CB,CG1,no,N,2,,155634,27479,28J
3,,SING,CB,CA,no,N,3,,155634,27479,28J
4,,SING,CG1,CD1,no,N,4,,155634,27479,28J
5,,SING,CA,N,no,N,5,,155634,27479,28J
6,,SING,CA,C,no,N,6,,155634,27479,28J
7,,DOUB,C,O,no,N,7,,155634,27479,28J
8,,SING,N,H20,no,N,8,,155634,27479,28J
9,,SING,CA,H21,no,N,9,,155634,27479,28J
10,,SING,CB,H22,no,N,10,,155634,27479,28J
11,,SING,CG2,H23,no,N,11,,155634,27479,28J
12,,SING,CG2,H24,no,N,12,,155634,27479,28J
13,,SING,CG2,H25,no,N,13,,155634,27479,28J
14,,SING,CG1,H26,no,N,14,,155634,27479,28J
15,,SING,CG1,H27,no,N,15,,155634,27479,28J
16,,SING,CD1,H28,no,N,16,,155634,27479,28J
17,,SING,CD1,H29,no,N,17,,155634,27479,28J
18,,SING,CD1,H30,no,N,18,,155634,27479,28J
19,,SING,N,H2,no,N,19,,155634,27479,28J
20,,SING,C,OXT,no,N,20,,155634,27479,28J
21,,SING,OXT,HXT,no,N,21,,155634,27479,28J
1,,SING,N,CA,no,N,1,,155635,27479,DTH
2,,SING,N,H,no,N,2,,155635,27479,DTH
3,,SING,N,HN2,no,N,3,,155635,27479,DTH
4,,SING,CA,CB,no,N,4,,155635,27479,DTH
5,,SING,CA,C,no,N,5,,155635,27479,DTH
6,,SING,CA,HA,no,N,6,,155635,27479,DTH
7,,SING,CB,CG2,no,N,7,,155635,27479,DTH
8,,SING,CB,OG1,no,N,8,,155635,27479,DTH
9,,SING,CB,HB,no,N,9,,155635,27479,DTH
10,,SING,CG2,HG21,no,N,10,,155635,27479,DTH
11,,SING,CG2,HG22,no,N,11,,155635,27479,DTH
12,,SING,CG2,HG23,no,N,12,,155635,27479,DTH
13,,SING,OG1,HG1,no,N,13,,155635,27479,DTH
14,,DOUB,C,O,no,N,14,,155635,27479,DTH
15,,SING,C,OXT,no,N,15,,155635,27479,DTH
16,,SING,OXT,HXT,no,N,16,,155635,27479,DTH
1,,SING,N,CA,no,N,1,,155650,27480,ZAE
2,,SING,N,C10,no,N,2,,155650,27480,ZAE
3,,SING,N,H,no,N,3,,155650,27480,ZAE
4,,SING,CA,C,no,N,4,,155650,27480,ZAE
5,,SING,CA,CB,no,N,5,,155650,27480,ZAE
6,,SING,CA,HA,no,N,6,,155650,27480,ZAE
7,,DOUB,C,O,no,N,7,,155650,27480,ZAE
8,,SING,C,OXT,no,N,8,,155650,27480,ZAE
9,,SING,OXT,HXT,no,N,9,,155650,27480,ZAE
10,,SING,CB,CG,no,N,10,,155650,27480,ZAE
11,,SING,CB,HB2,no,N,11,,155650,27480,ZAE
12,,SING,CB,HB3,no,N,12,,155650,27480,ZAE
13,,DOUB,CG,CD1,yes,N,13,,155650,27480,ZAE
14,,SING,CG,CD2,yes,N,14,,155650,27480,ZAE
15,,SING,CD1,CE1,yes,N,15,,155650,27480,ZAE
16,,SING,CD1,HD1,no,N,16,,155650,27480,ZAE
17,,DOUB,CD2,CE2,yes,N,17,,155650,27480,ZAE
18,,SING,CD2,HD2,no,N,18,,155650,27480,ZAE
19,,DOUB,CE1,CZ,yes,N,19,,155650,27480,ZAE
20,,SING,CE1,HE1,no,N,20,,155650,27480,ZAE
21,,SING,CE2,CZ,yes,N,21,,155650,27480,ZAE
22,,SING,CE2,HE2,no,N,22,,155650,27480,ZAE
23,,SING,CZ,HZ,no,N,23,,155650,27480,ZAE
24,,SING,C10,H11,no,N,24,,155650,27480,ZAE
25,,SING,C10,H12,no,N,25,,155650,27480,ZAE
26,,SING,C10,H13,no,N,26,,155650,27480,ZAE
1,,SING,N,CA,no,N,1,,155651,27480,DGN
2,,SING,N,H,no,N,2,,155651,27480,DGN
3,,SING,N,H2,no,N,3,,155651,27480,DGN
4,,SING,CA,C,no,N,4,,155651,27480,DGN
5,,SING,CA,CB,no,N,5,,155651,27480,DGN
6,,SING,CA,HA,no,N,6,,155651,27480,DGN
7,,DOUB,C,O,no,N,7,,155651,27480,DGN
8,,SING,C,OXT,no,N,8,,155651,27480,DGN
9,,SING,OXT,HXT,no,N,9,,155651,27480,DGN
10,,SING,CB,CG,no,N,10,,155651,27480,DGN
11,,SING,CB,HB2,no,N,11,,155651,27480,DGN
12,,SING,CB,HB3,no,N,12,,155651,27480,DGN
13,,SING,CG,CD,no,N,13,,155651,27480,DGN
14,,SING,CG,HG2,no,N,14,,155651,27480,DGN
15,,SING,CG,HG3,no,N,15,,155651,27480,DGN
16,,DOUB,CD,OE1,no,N,16,,155651,27480,DGN
17,,SING,CD,NE2,no,N,17,,155651,27480,DGN
18,,SING,NE2,HE21,no,N,18,,155651,27480,DGN
19,,SING,NE2,HE22,no,N,19,,155651,27480,DGN
1,,SING,CG2,CB,no,N,1,,155652,27480,28J
2,,SING,CB,CG1,no,N,2,,155652,27480,28J
3,,SING,CB,CA,no,N,3,,155652,27480,28J
4,,SING,CG1,CD1,no,N,4,,155652,27480,28J
5,,SING,CA,N,no,N,5,,155652,27480,28J
6,,SING,CA,C,no,N,6,,155652,27480,28J
7,,DOUB,C,O,no,N,7,,155652,27480,28J
8,,SING,N,H20,no,N,8,,155652,27480,28J
9,,SING,CA,H21,no,N,9,,155652,27480,28J
10,,SING,CB,H22,no,N,10,,155652,27480,28J
11,,SING,CG2,H23,no,N,11,,155652,27480,28J
12,,SING,CG2,H24,no,N,12,,155652,27480,28J
13,,SING,CG2,H25,no,N,13,,155652,27480,28J
14,,SING,CG1,H26,no,N,14,,155652,27480,28J
15,,SING,CG1,H27,no,N,15,,155652,27480,28J
16,,SING,CD1,H28,no,N,16,,155652,27480,28J
17,,SING,CD1,H29,no,N,17,,155652,27480,28J
18,,SING,CD1,H30,no,N,18,,155652,27480,28J
19,,SING,N,H2,no,N,19,,155652,27480,28J
20,,SING,C,OXT,no,N,20,,155652,27480,28J
21,,SING,OXT,HXT,no,N,21,,155652,27480,28J
1,,SING,N,CA,no,N,1,,155653,27480,DTH
2,,SING,N,H,no,N,2,,155653,27480,DTH
3,,SING,N,HN2,no,N,3,,155653,27480,DTH
4,,SING,CA,CB,no,N,4,,155653,27480,DTH
5,,SING,CA,C,no,N,5,,155653,27480,DTH
6,,SING,CA,HA,no,N,6,,155653,27480,DTH
7,,SING,CB,CG2,no,N,7,,155653,27480,DTH
8,,SING,CB,OG1,no,N,8,,155653,27480,DTH
9,,SING,CB,HB,no,N,9,,155653,27480,DTH
10,,SING,CG2,HG21,no,N,10,,155653,27480,DTH
11,,SING,CG2,HG22,no,N,11,,155653,27480,DTH
12,,SING,CG2,HG23,no,N,12,,155653,27480,DTH
13,,SING,OG1,HG1,no,N,13,,155653,27480,DTH
14,,DOUB,C,O,no,N,14,,155653,27480,DTH
15,,SING,C,OXT,no,N,15,,155653,27480,DTH
16,,SING,OXT,HXT,no,N,16,,155653,27480,DTH
1,,SING,N,HN1,no,N,1,,155730,27485,NH2
2,,SING,N,HN2,no,N,2,,155730,27485,NH2
1,,SING,N,CA,no,N,1,,155864,27495,SEP
2,,SING,N,H,no,N,2,,155864,27495,SEP
3,,SING,N,H2,no,N,3,,155864,27495,SEP
4,,SING,CA,CB,no,N,4,,155864,27495,SEP
5,,SING,CA,C,no,N,5,,155864,27495,SEP
6,,SING,CA,HA,no,N,6,,155864,27495,SEP
7,,SING,CB,OG,no,N,7,,155864,27495,SEP
8,,SING,CB,HB2,no,N,8,,155864,27495,SEP
9,,SING,CB,HB3,no,N,9,,155864,27495,SEP
10,,SING,OG,P,no,N,10,,155864,27495,SEP
11,,DOUB,C,O,no,N,11,,155864,27495,SEP
12,,SING,C,OXT,no,N,12,,155864,27495,SEP
13,,SING,OXT,HXT,no,N,13,,155864,27495,SEP
14,,DOUB,P,O1P,no,N,14,,155864,27495,SEP
15,,SING,P,O2P,no,N,15,,155864,27495,SEP
16,,SING,P,O3P,no,N,16,,155864,27495,SEP
17,,SING,O2P,HOP2,no,N,17,,155864,27495,SEP
18,,SING,O3P,HOP3,no,N,18,,155864,27495,SEP
1,,SING,N,CA,no,N,1,,156539,27538,TPO
2,,SING,N,H,no,N,2,,156539,27538,TPO
3,,SING,N,H2,no,N,3,,156539,27538,TPO
4,,SING,CA,CB,no,N,4,,156539,27538,TPO
5,,SING,CA,C,no,N,5,,156539,27538,TPO
6,,SING,CA,HA,no,N,6,,156539,27538,TPO
7,,SING,CB,CG2,no,N,7,,156539,27538,TPO
8,,SING,CB,OG1,no,N,8,,156539,27538,TPO
9,,SING,CB,HB,no,N,9,,156539,27538,TPO
10,,SING,CG2,HG21,no,N,10,,156539,27538,TPO
11,,SING,CG2,HG22,no,N,11,,156539,27538,TPO
12,,SING,CG2,HG23,no,N,12,,156539,27538,TPO
13,,SING,OG1,P,no,N,13,,156539,27538,TPO
14,,DOUB,P,O1P,no,N,14,,156539,27538,TPO
15,,SING,P,O2P,no,N,15,,156539,27538,TPO
16,,SING,P,O3P,no,N,16,,156539,27538,TPO
17,,SING,O2P,HOP2,no,N,17,,156539,27538,TPO
18,,SING,O3P,HOP3,no,N,18,,156539,27538,TPO
19,,DOUB,C,O,no,N,19,,156539,27538,TPO
20,,SING,C,OXT,no,N,20,,156539,27538,TPO
21,,SING,OXT,HXT,no,N,21,,156539,27538,TPO
1,,SING,CHA,C1A,no,N,1,,156818,27556,HEM
2,,DOUB,CHA,C4D,no,N,2,,156818,27556,HEM
3,,SING,CHA,HHA,no,N,3,,156818,27556,HEM
4,,SING,CHB,C4A,no,N,4,,156818,27556,HEM
5,,DOUB,CHB,C1B,no,N,5,,156818,27556,HEM
6,,SING,CHB,HHB,no,N,6,,156818,27556,HEM
7,,SING,CHC,C4B,no,N,7,,156818,27556,HEM
8,,DOUB,CHC,C1C,no,N,8,,156818,27556,HEM
9,,SING,CHC,HHC,no,N,9,,156818,27556,HEM
10,,DOUB,CHD,C4C,no,N,10,,156818,27556,HEM
11,,SING,CHD,C1D,no,N,11,,156818,27556,HEM
12,,SING,CHD,HHD,no,N,12,,156818,27556,HEM
13,,DOUB,C1A,C2A,yes,N,13,,156818,27556,HEM
14,,SING,C1A,NA,yes,N,14,,156818,27556,HEM
15,,SING,C2A,C3A,yes,N,15,,156818,27556,HEM
16,,SING,C2A,CAA,no,N,16,,156818,27556,HEM
17,,DOUB,C3A,C4A,yes,N,17,,156818,27556,HEM
18,,SING,C3A,CMA,no,N,18,,156818,27556,HEM
19,,SING,C4A,NA,yes,N,19,,156818,27556,HEM
20,,SING,CMA,HMA,no,N,20,,156818,27556,HEM
21,,SING,CMA,HMAA,no,N,21,,156818,27556,HEM
22,,SING,CMA,HMAB,no,N,22,,156818,27556,HEM
23,,SING,CAA,CBA,no,N,23,,156818,27556,HEM
24,,SING,CAA,HAA,no,N,24,,156818,27556,HEM
25,,SING,CAA,HAAA,no,N,25,,156818,27556,HEM
26,,SING,CBA,CGA,no,N,26,,156818,27556,HEM
27,,SING,CBA,HBA,no,N,27,,156818,27556,HEM
28,,SING,CBA,HBAA,no,N,28,,156818,27556,HEM
29,,DOUB,CGA,O1A,no,N,29,,156818,27556,HEM
30,,SING,CGA,O2A,no,N,30,,156818,27556,HEM
31,,SING,C1B,C2B,no,N,31,,156818,27556,HEM
32,,SING,C1B,NB,no,N,32,,156818,27556,HEM
33,,DOUB,C2B,C3B,no,N,33,,156818,27556,HEM
34,,SING,C2B,CMB,no,N,34,,156818,27556,HEM
35,,SING,C3B,C4B,no,N,35,,156818,27556,HEM
36,,SING,C3B,CAB,no,N,36,,156818,27556,HEM
37,,DOUB,C4B,NB,no,N,37,,156818,27556,HEM
38,,SING,CMB,HMB,no,N,38,,156818,27556,HEM
39,,SING,CMB,HMBA,no,N,39,,156818,27556,HEM
40,,SING,CMB,HMBB,no,N,40,,156818,27556,HEM
41,,DOUB,CAB,CBB,no,N,41,,156818,27556,HEM
42,,SING,CAB,HAB,no,N,42,,156818,27556,HEM
43,,SING,CBB,HBB,no,N,43,,156818,27556,HEM
44,,SING,CBB,HBBA,no,N,44,,156818,27556,HEM
45,,SING,C1C,C2C,yes,N,45,,156818,27556,HEM
46,,SING,C1C,NC,yes,N,46,,156818,27556,HEM
47,,DOUB,C2C,C3C,yes,N,47,,156818,27556,HEM
48,,SING,C2C,CMC,no,N,48,,156818,27556,HEM
49,,SING,C3C,C4C,yes,N,49,,156818,27556,HEM
50,,SING,C3C,CAC,no,N,50,,156818,27556,HEM
51,,SING,C4C,NC,yes,N,51,,156818,27556,HEM
52,,SING,CMC,HMC,no,N,52,,156818,27556,HEM
53,,SING,CMC,HMCA,no,N,53,,156818,27556,HEM
54,,SING,CMC,HMCB,no,N,54,,156818,27556,HEM
55,,DOUB,CAC,CBC,no,N,55,,156818,27556,HEM
56,,SING,CAC,HAC,no,N,56,,156818,27556,HEM
57,,SING,CBC,HBC,no,N,57,,156818,27556,HEM
58,,SING,CBC,HBCA,no,N,58,,156818,27556,HEM
59,,SING,C1D,C2D,no,N,59,,156818,27556,HEM
60,,DOUB,C1D,ND,no,N,60,,156818,27556,HEM
61,,DOUB,C2D,C3D,no,N,61,,156818,27556,HEM
62,,SING,C2D,CMD,no,N,62,,156818,27556,HEM
63,,SING,C3D,C4D,no,N,63,,156818,27556,HEM
64,,SING,C3D,CAD,no,N,64,,156818,27556,HEM
65,,SING,C4D,ND,no,N,65,,156818,27556,HEM
66,,SING,CMD,HMD,no,N,66,,156818,27556,HEM
67,,SING,CMD,HMDA,no,N,67,,156818,27556,HEM
68,,SING,CMD,HMDB,no,N,68,,156818,27556,HEM
69,,SING,CAD,CBD,no,N,69,,156818,27556,HEM
70,,SING,CAD,HAD,no,N,70,,156818,27556,HEM
71,,SING,CAD,HADA,no,N,71,,156818,27556,HEM
72,,SING,CBD,CGD,no,N,72,,156818,27556,HEM
73,,SING,CBD,HBD,no,N,73,,156818,27556,HEM
74,,SING,CBD,HBDA,no,N,74,,156818,27556,HEM
75,,DOUB,CGD,O1D,no,N,75,,156818,27556,HEM
76,,SING,CGD,O2D,no,N,76,,156818,27556,HEM
77,,SING,O2A,H2A,no,N,77,,156818,27556,HEM
78,,SING,O2D,H2D,no,N,78,,156818,27556,HEM
79,,SING,FE,NA,no,N,79,,156818,27556,HEM
80,,SING,FE,NB,no,N,80,,156818,27556,HEM
81,,SING,FE,NC,no,N,81,,156818,27556,HEM
82,,SING,FE,ND,no,N,82,,156818,27556,HEM
1,,DOUB,O2,C2,no,N,1,,156900,27561,XC5
2,,SING,C2,N3,no,N,2,,156900,27561,XC5
3,,SING,C2,N1,no,N,3,,156900,27561,XC5
4,,DOUB,N3,C4,no,N,4,,156900,27561,XC5
5,,SING,C2',C1',no,N,5,,156900,27561,XC5
6,,SING,C2',C3',no,N,6,,156900,27561,XC5
7,,SING,C1',N1,no,N,7,,156900,27561,XC5
8,,SING,C1',O4',no,N,8,,156900,27561,XC5
9,,SING,N1,C6,no,N,9,,156900,27561,XC5
10,,SING,O3',C3',no,N,10,,156900,27561,XC5
11,,SING,C4,N4,no,N,11,,156900,27561,XC5
12,,SING,C4,C5,no,N,12,,156900,27561,XC5
13,,SING,C3',C4',no,N,13,,156900,27561,XC5
14,,SING,O4',C4',no,N,14,,156900,27561,XC5
15,,SING,C4',C5',no,N,15,,156900,27561,XC5
16,,DOUB,C6,C5,no,N,16,,156900,27561,XC5
17,,DOUB,O1B,PB,no,N,17,,156900,27561,XC5
18,,SING,C5',O5',no,N,18,,156900,27561,XC5
19,,SING,O5',PA,no,N,19,,156900,27561,XC5
20,,SING,PB,O2B,no,N,20,,156900,27561,XC5
21,,SING,PB,C3A,no,N,21,,156900,27561,XC5
22,,SING,PB,O3B,no,N,22,,156900,27561,XC5
23,,SING,C3A,PA,no,N,23,,156900,27561,XC5
24,,SING,O3B,PG,no,N,24,,156900,27561,XC5
25,,DOUB,PA,O2A,no,N,25,,156900,27561,XC5
26,,SING,PA,O1A,no,N,26,,156900,27561,XC5
27,,DOUB,PG,O2G,no,N,27,,156900,27561,XC5
28,,SING,PG,O1G,no,N,28,,156900,27561,XC5
29,,SING,PG,O3G,no,N,29,,156900,27561,XC5
30,,SING,O1A,H1,no,N,30,,156900,27561,XC5
31,,SING,C3A,H2,no,N,31,,156900,27561,XC5
32,,SING,C3A,H3,no,N,32,,156900,27561,XC5
33,,SING,O2B,H4,no,N,33,,156900,27561,XC5
34,,SING,O1G,H5,no,N,34,,156900,27561,XC5
35,,SING,O3G,H6,no,N,35,,156900,27561,XC5
36,,SING,C5,H7,no,N,36,,156900,27561,XC5
37,,SING,C6,H8,no,N,37,,156900,27561,XC5
38,,SING,N4,H9,no,N,38,,156900,27561,XC5
39,,SING,N4,H10,no,N,39,,156900,27561,XC5
40,,SING,C1',H11,no,N,40,,156900,27561,XC5
41,,SING,C2',H12,no,N,41,,156900,27561,XC5
42,,SING,C2',H13,no,N,42,,156900,27561,XC5
43,,SING,C3',H14,no,N,43,,156900,27561,XC5
44,,SING,C4',H15,no,N,44,,156900,27561,XC5
45,,SING,C5',H16,no,N,45,,156900,27561,XC5
46,,SING,C5',H17,no,N,46,,156900,27561,XC5
47,,SING,O3',H18,no,N,47,,156900,27561,XC5
1,,DOUB,O17,C16,no,N,1,,156979,27566,NIL
2,,SING,C16,N14,no,N,2,,156979,27566,NIL
3,,SING,C16,C18,no,N,3,,156979,27566,NIL
4,,SING,N14,C11,no,N,4,,156979,27566,NIL
5,,DOUB,C11,C9,yes,N,5,,156979,27566,NIL
6,,SING,C11,C12,yes,N,6,,156979,27566,NIL
7,,SING,C9,C8,yes,N,7,,156979,27566,NIL
8,,SING,C8,N51,yes,N,8,,156979,27566,NIL
9,,DOUB,C8,C6,yes,N,9,,156979,27566,NIL
10,,SING,N51,C56,yes,N,10,,156979,27566,NIL
11,,SING,N51,C52,yes,N,11,,156979,27566,NIL
12,,DOUB,C56,C55,yes,N,12,,156979,27566,NIL
13,,SING,C55,C58,no,N,13,,156979,27566,NIL
14,,SING,C55,N54,yes,N,14,,156979,27566,NIL
15,,DOUB,N54,C52,yes,N,15,,156979,27566,NIL
16,,SING,C6,C5,yes,N,16,,156979,27566,NIL
17,,DOUB,C12,C5,yes,N,17,,156979,27566,NIL
18,,SING,C5,C2,no,N,18,,156979,27566,NIL
19,,SING,C2,F4,no,N,19,,156979,27566,NIL
20,,SING,C2,F3,no,N,20,,156979,27566,NIL
21,,SING,C2,F1,no,N,21,,156979,27566,NIL
22,,DOUB,C18,C25,yes,N,22,,156979,27566,NIL
23,,SING,C18,C19,yes,N,23,,156979,27566,NIL
24,,SING,C25,C23,yes,N,24,,156979,27566,NIL
25,,DOUB,C23,C22,yes,N,25,,156979,27566,NIL
26,,SING,C22,C27,no,N,26,,156979,27566,NIL
27,,SING,C22,C21,yes,N,27,,156979,27566,NIL
28,,DOUB,C21,C19,yes,N,28,,156979,27566,NIL
29,,SING,C21,N31,no,N,29,,156979,27566,NIL
30,,SING,N31,C33,no,N,30,,156979,27566,NIL
31,,DOUB,C33,N40,yes,N,31,,156979,27566,NIL
32,,SING,C33,N34,yes,N,32,,156979,27566,NIL
33,,SING,N40,C38,yes,N,33,,156979,27566,NIL
34,,DOUB,C38,C36,yes,N,34,,156979,27566,NIL
35,,SING,C36,C35,yes,N,35,,156979,27566,NIL
36,,DOUB,C35,N34,yes,N,36,,156979,27566,NIL
37,,SING,C35,C41,yes,N,37,,156979,27566,NIL
38,,DOUB,C41,C49,yes,N,38,,156979,27566,NIL
39,,SING,C41,C42,yes,N,39,,156979,27566,NIL
40,,SING,C49,C47,yes,N,40,,156979,27566,NIL
41,,DOUB,C47,C45,yes,N,41,,156979,27566,NIL
42,,SING,C45,N44,yes,N,42,,156979,27566,NIL
43,,DOUB,N44,C42,yes,N,43,,156979,27566,NIL
44,,SING,N14,HN14,no,N,44,,156979,27566,NIL
45,,SING,C9,H9,no,N,45,,156979,27566,NIL
46,,SING,C56,H56,no,N,46,,156979,27566,NIL
47,,SING,C58,H58,no,N,47,,156979,27566,NIL
48,,SING,C58,H58A,no,N,48,,156979,27566,NIL
49,,SING,C58,H58B,no,N,49,,156979,27566,NIL
50,,SING,C52,H52,no,N,50,,156979,27566,NIL
51,,SING,C6,H6,no,N,51,,156979,27566,NIL
52,,SING,C12,H12,no,N,52,,156979,27566,NIL
53,,SING,C25,H25,no,N,53,,156979,27566,NIL
54,,SING,C23,H23,no,N,54,,156979,27566,NIL
55,,SING,C27,H27,no,N,55,,156979,27566,NIL
56,,SING,C27,H27A,no,N,56,,156979,27566,NIL
57,,SING,C27,H27B,no,N,57,,156979,27566,NIL
58,,SING,C19,H19,no,N,58,,156979,27566,NIL
59,,SING,N31,HN31,no,N,59,,156979,27566,NIL
60,,SING,C38,H38,no,N,60,,156979,27566,NIL
61,,SING,C36,H36,no,N,61,,156979,27566,NIL
62,,SING,C49,H49,no,N,62,,156979,27566,NIL
63,,SING,C47,H47,no,N,63,,156979,27566,NIL
64,,SING,C45,H45,no,N,64,,156979,27566,NIL
65,,SING,C42,H42,no,N,65,,156979,27566,NIL
1,,SING,N,CA,no,N,1,,157075,27572,DBU
2,,SING,N,H,no,N,2,,157075,27572,DBU
3,,SING,N,H2,no,N,3,,157075,27572,DBU
4,,DOUB,CA,CB,no,Z,4,,157075,27572,DBU
5,,SING,CA,C,no,N,5,,157075,27572,DBU
6,,SING,CB,CG,no,N,6,,157075,27572,DBU
7,,SING,CB,HB,no,N,7,,157075,27572,DBU
8,,SING,CG,HG1,no,N,8,,157075,27572,DBU
9,,SING,CG,HG2,no,N,9,,157075,27572,DBU
10,,SING,CG,HG3,no,N,10,,157075,27572,DBU
11,,DOUB,C,O,no,N,11,,157075,27572,DBU
12,,SING,C,OXT,no,N,12,,157075,27572,DBU
13,,SING,OXT,HXT,no,N,13,,157075,27572,DBU
1,,SING,N,CA,no,N,1,,157076,27572,DAL
2,,SING,N,H,no,N,2,,157076,27572,DAL
3,,SING,N,H2,no,N,3,,157076,27572,DAL
4,,SING,CA,CB,no,N,4,,157076,27572,DAL
5,,SING,CA,C,no,N,5,,157076,27572,DAL
6,,SING,CA,HA,no,N,6,,157076,27572,DAL
7,,SING,CB,HB1,no,N,7,,157076,27572,DAL
8,,SING,CB,HB2,no,N,8,,157076,27572,DAL
9,,SING,CB,HB3,no,N,9,,157076,27572,DAL
10,,DOUB,C,O,no,N,10,,157076,27572,DAL
11,,SING,C,OXT,no,N,11,,157076,27572,DAL
12,,SING,OXT,HXT,no,N,12,,157076,27572,DAL
1,,SING,N,CA,no,N,1,,157077,27572,DHA
2,,SING,N,H,no,N,2,,157077,27572,DHA
3,,SING,N,H2,no,N,3,,157077,27572,DHA
4,,DOUB,CA,CB,no,N,4,,157077,27572,DHA
5,,SING,CA,C,no,N,5,,157077,27572,DHA
6,,SING,CB,HB1,no,N,6,,157077,27572,DHA
7,,SING,CB,HB2,no,N,7,,157077,27572,DHA
8,,DOUB,C,O,no,N,8,,157077,27572,DHA
9,,SING,C,OXT,no,N,9,,157077,27572,DHA
10,,SING,OXT,HXT,no,N,10,,157077,27572,DHA
1,,SING,N,CA,no,N,1,,157078,27572,ABU
2,,SING,N,H,no,N,2,,157078,27572,ABU
3,,SING,N,HN2,no,N,3,,157078,27572,ABU
4,,SING,CA,CB,no,N,4,,157078,27572,ABU
5,,SING,CA,HA1,no,N,5,,157078,27572,ABU
6,,SING,CA,HA2,no,N,6,,157078,27572,ABU
7,,SING,CB,CG,no,N,7,,157078,27572,ABU
8,,SING,CB,HB1,no,N,8,,157078,27572,ABU
9,,SING,CB,HB2,no,N,9,,157078,27572,ABU
10,,SING,CG,CD,no,N,10,,157078,27572,ABU
11,,SING,CG,HG1,no,N,11,,157078,27572,ABU
12,,SING,CG,HG2,no,N,12,,157078,27572,ABU
13,,DOUB,CD,OE1,no,N,13,,157078,27572,ABU
14,,SING,CD,OE2,no,N,14,,157078,27572,ABU
15,,SING,OE2,HE2,no,N,15,,157078,27572,ABU
1,,SING,N,CA,no,N,1,,157079,27572,DBB
2,,SING,CA,C,no,N,2,,157079,27572,DBB
3,,SING,CA,CB,no,N,3,,157079,27572,DBB
4,,DOUB,C,O,no,N,4,,157079,27572,DBB
5,,SING,CB,CG,no,N,5,,157079,27572,DBB
6,,SING,C,OXT,no,N,6,,157079,27572,DBB
7,,SING,N,H,no,N,7,,157079,27572,DBB
8,,SING,N,H1,no,N,8,,157079,27572,DBB
9,,SING,CA,HA,no,N,9,,157079,27572,DBB
10,,SING,CB,HB2,no,N,10,,157079,27572,DBB
11,,SING,CB,HB3,no,N,11,,157079,27572,DBB
12,,SING,CG,HG1,no,N,12,,157079,27572,DBB
13,,SING,CG,HG2,no,N,13,,157079,27572,DBB
14,,SING,CG,HG3,no,N,14,,157079,27572,DBB
15,,SING,OXT,HXT,no,N,15,,157079,27572,DBB
1,,SING,C1,C2,no,N,1,,157080,27572,NAG
2,,SING,C1,O1,no,N,2,,157080,27572,NAG
3,,SING,C1,O5,no,N,3,,157080,27572,NAG
4,,SING,C1,H1,no,N,4,,157080,27572,NAG
5,,SING,C2,C3,no,N,5,,157080,27572,NAG
6,,SING,C2,N2,no,N,6,,157080,27572,NAG
7,,SING,C2,H2,no,N,7,,157080,27572,NAG
8,,SING,C3,C4,no,N,8,,157080,27572,NAG
9,,SING,C3,O3,no,N,9,,157080,27572,NAG
10,,SING,C3,H3,no,N,10,,157080,27572,NAG
11,,SING,C4,C5,no,N,11,,157080,27572,NAG
12,,SING,C4,O4,no,N,12,,157080,27572,NAG
13,,SING,C4,H4,no,N,13,,157080,27572,NAG
14,,SING,C5,C6,no,N,14,,157080,27572,NAG
15,,SING,C5,O5,no,N,15,,157080,27572,NAG
16,,SING,C5,H5,no,N,16,,157080,27572,NAG
17,,SING,C6,O6,no,N,17,,157080,27572,NAG
18,,SING,C6,H61,no,N,18,,157080,27572,NAG
19,,SING,C6,H62,no,N,19,,157080,27572,NAG
20,,SING,C7,C8,no,N,20,,157080,27572,NAG
21,,SING,C7,N2,no,N,21,,157080,27572,NAG
22,,DOUB,C7,O7,no,N,22,,157080,27572,NAG
23,,SING,C8,H81,no,N,23,,157080,27572,NAG
24,,SING,C8,H82,no,N,24,,157080,27572,NAG
25,,SING,C8,H83,no,N,25,,157080,27572,NAG
26,,SING,N2,HN2,no,N,26,,157080,27572,NAG
27,,SING,O1,HO1,no,N,27,,157080,27572,NAG
28,,SING,O3,HO3,no,N,28,,157080,27572,NAG
29,,SING,O4,HO4,no,N,29,,157080,27572,NAG
30,,SING,O6,HO6,no,N,30,,157080,27572,NAG
1,,SING,C1,C2,no,N,1,,157081,27572,MUB
2,,SING,C2,C3,no,N,2,,157081,27572,MUB
3,,SING,C3,C4,no,N,3,,157081,27572,MUB
4,,SING,C4,C5,no,N,4,,157081,27572,MUB
5,,SING,C5,C6,no,N,5,,157081,27572,MUB
6,,SING,C7,C8,no,N,6,,157081,27572,MUB
7,,SING,C9,C10,no,N,7,,157081,27572,MUB
8,,SING,C9,C11,no,N,8,,157081,27572,MUB
9,,SING,C1,O1,no,N,9,,157081,27572,MUB
10,,SING,C3,O3,no,N,10,,157081,27572,MUB
11,,SING,C9,O3,no,N,11,,157081,27572,MUB
12,,SING,C4,O4,no,N,12,,157081,27572,MUB
13,,SING,C1,O5,no,N,13,,157081,27572,MUB
14,,SING,C5,O5,no,N,14,,157081,27572,MUB
15,,SING,C6,O6,no,N,15,,157081,27572,MUB
16,,DOUB,C7,O7,no,N,16,,157081,27572,MUB
17,,SING,C10,O11,no,N,17,,157081,27572,MUB
18,,DOUB,C10,O10,no,N,18,,157081,27572,MUB
19,,SING,C2,N2,no,N,19,,157081,27572,MUB
20,,SING,C7,N2,no,N,20,,157081,27572,MUB
21,,SING,C1,H1,no,N,21,,157081,27572,MUB
22,,SING,C2,H2,no,N,22,,157081,27572,MUB
23,,SING,N2,HN2,no,N,23,,157081,27572,MUB
24,,SING,C8,H81,no,N,24,,157081,27572,MUB
25,,SING,C8,H82,no,N,25,,157081,27572,MUB
26,,SING,C8,H83,no,N,26,,157081,27572,MUB
27,,SING,C3,H3,no,N,27,,157081,27572,MUB
28,,SING,C9,H9,no,N,28,,157081,27572,MUB
29,,SING,C11,H111,no,N,29,,157081,27572,MUB
30,,SING,C11,H112,no,N,30,,157081,27572,MUB
31,,SING,C11,H113,no,N,31,,157081,27572,MUB
32,,SING,C4,H4A,no,N,32,,157081,27572,MUB
33,,SING,C5,H5,no,N,33,,157081,27572,MUB
34,,SING,C6,H61,no,N,34,,157081,27572,MUB
35,,SING,C6,H62,no,N,35,,157081,27572,MUB
36,,SING,O6,HO6,no,N,36,,157081,27572,MUB
37,,SING,O4,H4,no,N,37,,157081,27572,MUB
38,,SING,O11,H1',no,N,38,,157081,27572,MUB
39,,SING,O1,HO1,no,N,39,,157081,27572,MUB
1,,SING,N,CA,no,N,1,,157082,27572,FGA
2,,SING,N,H,no,N,2,,157082,27572,FGA
3,,SING,N,H2,no,N,3,,157082,27572,FGA
4,,SING,CA,C,no,N,4,,157082,27572,FGA
5,,SING,CA,CB,no,N,5,,157082,27572,FGA
6,,SING,CA,HA,no,N,6,,157082,27572,FGA
7,,DOUB,C,O,no,N,7,,157082,27572,FGA
8,,SING,C,OXT,no,N,8,,157082,27572,FGA
9,,SING,CB,CG,no,N,9,,157082,27572,FGA
10,,SING,CB,HB2,no,N,10,,157082,27572,FGA
11,,SING,CB,HB3,no,N,11,,157082,27572,FGA
12,,SING,CG,CD,no,N,12,,157082,27572,FGA
13,,SING,CG,HG2,no,N,13,,157082,27572,FGA
14,,SING,CG,HG3,no,N,14,,157082,27572,FGA
15,,DOUB,CD,OE1,no,N,15,,157082,27572,FGA
16,,SING,CD,OE2,no,N,16,,157082,27572,FGA
17,,SING,OE2,HE2,no,N,17,,157082,27572,FGA
18,,SING,OXT,HXT,no,N,18,,157082,27572,FGA
1,,DOUB,PB,O1B,no,N,1,,157162,27577,GDP
2,,SING,PB,O2B,no,N,2,,157162,27577,GDP
3,,SING,PB,O3B,no,N,3,,157162,27577,GDP
4,,SING,PB,O3A,no,N,4,,157162,27577,GDP
5,,SING,O2B,HOB2,no,N,5,,157162,27577,GDP
6,,SING,O3B,HOB3,no,N,6,,157162,27577,GDP
7,,SING,O3A,PA,no,N,7,,157162,27577,GDP
8,,DOUB,PA,O1A,no,N,8,,157162,27577,GDP
9,,SING,PA,O2A,no,N,9,,157162,27577,GDP
10,,SING,PA,O5',no,N,10,,157162,27577,GDP
11,,SING,O2A,HOA2,no,N,11,,157162,27577,GDP
12,,SING,O5',C5',no,N,12,,157162,27577,GDP
13,,SING,C5',C4',no,N,13,,157162,27577,GDP
14,,SING,C5',H5',no,N,14,,157162,27577,GDP
15,,SING,C5',H5'',no,N,15,,157162,27577,GDP
16,,SING,C4',O4',no,N,16,,157162,27577,GDP
17,,SING,C4',C3',no,N,17,,157162,27577,GDP
18,,SING,C4',H4',no,N,18,,157162,27577,GDP
19,,SING,O4',C1',no,N,19,,157162,27577,GDP
20,,SING,C3',O3',no,N,20,,157162,27577,GDP
21,,SING,C3',C2',no,N,21,,157162,27577,GDP
22,,SING,C3',H3',no,N,22,,157162,27577,GDP
23,,SING,O3',HO3',no,N,23,,157162,27577,GDP
24,,SING,C2',O2',no,N,24,,157162,27577,GDP
25,,SING,C2',C1',no,N,25,,157162,27577,GDP
26,,SING,C2',H2',no,N,26,,157162,27577,GDP
27,,SING,O2',HO2',no,N,27,,157162,27577,GDP
28,,SING,C1',N9,no,N,28,,157162,27577,GDP
29,,SING,C1',H1',no,N,29,,157162,27577,GDP
30,,SING,N9,C8,yes,N,30,,157162,27577,GDP
31,,SING,N9,C4,yes,N,31,,157162,27577,GDP
32,,DOUB,C8,N7,yes,N,32,,157162,27577,GDP
33,,SING,C8,H8,no,N,33,,157162,27577,GDP
34,,SING,N7,C5,yes,N,34,,157162,27577,GDP
35,,SING,C5,C6,no,N,35,,157162,27577,GDP
36,,DOUB,C5,C4,yes,N,36,,157162,27577,GDP
37,,DOUB,C6,O6,no,N,37,,157162,27577,GDP
38,,SING,C6,N1,no,N,38,,157162,27577,GDP
39,,SING,N1,C2,no,N,39,,157162,27577,GDP
40,,SING,N1,HN1,no,N,40,,157162,27577,GDP
41,,SING,C2,N2,no,N,41,,157162,27577,GDP
42,,DOUB,C2,N3,no,N,42,,157162,27577,GDP
43,,SING,N2,HN21,no,N,43,,157162,27577,GDP
44,,SING,N2,HN22,no,N,44,,157162,27577,GDP
45,,SING,N3,C4,no,N,45,,157162,27577,GDP
1,,SING,N1,C2,yes,N,1,,157713,27612,APR
2,,DOUB,N1,C6,yes,N,2,,157713,27612,APR
3,,DOUB,C2,N3,yes,N,3,,157713,27612,APR
4,,SING,C2,H2,no,N,4,,157713,27612,APR
5,,SING,N3,C4,yes,N,5,,157713,27612,APR
6,,DOUB,C4,C5,yes,N,6,,157713,27612,APR
7,,SING,C4,N9,yes,N,7,,157713,27612,APR
8,,SING,C5,C6,yes,N,8,,157713,27612,APR
9,,SING,C5,N7,yes,N,9,,157713,27612,APR
10,,SING,C6,N6,no,N,10,,157713,27612,APR
11,,SING,N6,H61,no,N,11,,157713,27612,APR
12,,SING,N6,H62,no,N,12,,157713,27612,APR
13,,DOUB,N7,C8,yes,N,13,,157713,27612,APR
14,,SING,C8,N9,yes,N,14,,157713,27612,APR
15,,SING,C8,H8,no,N,15,,157713,27612,APR
16,,SING,N9,C1',no,N,16,,157713,27612,APR
17,,SING,C1',C2',no,N,17,,157713,27612,APR
18,,SING,C1',O4',no,N,18,,157713,27612,APR
19,,SING,C1',H'1,no,N,19,,157713,27612,APR
20,,SING,C2',O2',no,N,20,,157713,27612,APR
21,,SING,C2',C3',no,N,21,,157713,27612,APR
22,,SING,C2',H'2,no,N,22,,157713,27612,APR
23,,SING,O2',HO'2,no,N,23,,157713,27612,APR
24,,SING,C3',O3',no,N,24,,157713,27612,APR
25,,SING,C3',C4',no,N,25,,157713,27612,APR
26,,SING,C3',H'3,no,N,26,,157713,27612,APR
27,,SING,O3',HO'3,no,N,27,,157713,27612,APR
28,,SING,O4',C4',no,N,28,,157713,27612,APR
29,,SING,C4',C5',no,N,29,,157713,27612,APR
30,,SING,C4',H'4,no,N,30,,157713,27612,APR
31,,SING,C5',O5',no,N,31,,157713,27612,APR
32,,SING,C5',H5'1,no,N,32,,157713,27612,APR
33,,SING,C5',H5'2,no,N,33,,157713,27612,APR
34,,SING,O5',PA,no,N,34,,157713,27612,APR
35,,DOUB,PA,O1A,no,N,35,,157713,27612,APR
36,,SING,PA,O2A,no,N,36,,157713,27612,APR
37,,SING,PA,O3A,no,N,37,,157713,27612,APR
38,,SING,O2A,HOA2,no,N,38,,157713,27612,APR
39,,SING,O3A,PB,no,N,39,,157713,27612,APR
40,,DOUB,PB,O1B,no,N,40,,157713,27612,APR
41,,SING,PB,O2B,no,N,41,,157713,27612,APR
42,,SING,PB,O5D,no,N,42,,157713,27612,APR
43,,SING,O2B,HOB2,no,N,43,,157713,27612,APR
44,,SING,O5D,C5D,no,N,44,,157713,27612,APR
45,,SING,C5D,C4D,no,N,45,,157713,27612,APR
46,,SING,C5D,H5R1,no,N,46,,157713,27612,APR
47,,SING,C5D,H5R2,no,N,47,,157713,27612,APR
48,,SING,O4D,C1D,no,N,48,,157713,27612,APR
49,,SING,O4D,C4D,no,N,49,,157713,27612,APR
50,,SING,O1D,C1D,no,N,50,,157713,27612,APR
51,,SING,O1D,HOR1,no,N,51,,157713,27612,APR
52,,SING,C1D,C2D,no,N,52,,157713,27612,APR
53,,SING,C1D,HR'1,no,N,53,,157713,27612,APR
54,,SING,O2D,C2D,no,N,54,,157713,27612,APR
55,,SING,O2D,HOR2,no,N,55,,157713,27612,APR
56,,SING,C2D,C3D,no,N,56,,157713,27612,APR
57,,SING,C2D,HR'2,no,N,57,,157713,27612,APR
58,,SING,O3D,C3D,no,N,58,,157713,27612,APR
59,,SING,O3D,HOR3,no,N,59,,157713,27612,APR
60,,SING,C3D,C4D,no,N,60,,157713,27612,APR
61,,SING,C3D,HR'3,no,N,61,,157713,27612,APR
62,,SING,C4D,HR'4,no,N,62,,157713,27612,APR
1,,DOUB,C1,O1,no,N,1,,158141,27638,OLA
2,,SING,C1,O2,no,N,2,,158141,27638,OLA
3,,SING,C1,C2,no,N,3,,158141,27638,OLA
4,,SING,O2,HO2,no,N,4,,158141,27638,OLA
5,,SING,C2,C3,no,N,5,,158141,27638,OLA
6,,SING,C2,H21,no,N,6,,158141,27638,OLA
7,,SING,C2,H22,no,N,7,,158141,27638,OLA
8,,SING,C3,C4,no,N,8,,158141,27638,OLA
9,,SING,C3,H31,no,N,9,,158141,27638,OLA
10,,SING,C3,H32,no,N,10,,158141,27638,OLA
11,,SING,C4,C5,no,N,11,,158141,27638,OLA
12,,SING,C4,H41,no,N,12,,158141,27638,OLA
13,,SING,C4,H42,no,N,13,,158141,27638,OLA
14,,SING,C5,C6,no,N,14,,158141,27638,OLA
15,,SING,C5,H51,no,N,15,,158141,27638,OLA
16,,SING,C5,H52,no,N,16,,158141,27638,OLA
17,,SING,C6,C7,no,N,17,,158141,27638,OLA
18,,SING,C6,H61,no,N,18,,158141,27638,OLA
19,,SING,C6,H62,no,N,19,,158141,27638,OLA
20,,SING,C7,C8,no,N,20,,158141,27638,OLA
21,,SING,C7,H71,no,N,21,,158141,27638,OLA
22,,SING,C7,H72,no,N,22,,158141,27638,OLA
23,,SING,C8,C9,no,N,23,,158141,27638,OLA
24,,SING,C8,H81,no,N,24,,158141,27638,OLA
25,,SING,C8,H82,no,N,25,,158141,27638,OLA
26,,DOUB,C9,C10,no,Z,26,,158141,27638,OLA
27,,SING,C9,H9,no,N,27,,158141,27638,OLA
28,,SING,C10,C11,no,N,28,,158141,27638,OLA
29,,SING,C10,H10,no,N,29,,158141,27638,OLA
30,,SING,C11,C12,no,N,30,,158141,27638,OLA
31,,SING,C11,H111,no,N,31,,158141,27638,OLA
32,,SING,C11,H112,no,N,32,,158141,27638,OLA
33,,SING,C12,C13,no,N,33,,158141,27638,OLA
34,,SING,C12,H121,no,N,34,,158141,27638,OLA
35,,SING,C12,H122,no,N,35,,158141,27638,OLA
36,,SING,C13,C14,no,N,36,,158141,27638,OLA
37,,SING,C13,H131,no,N,37,,158141,27638,OLA
38,,SING,C13,H132,no,N,38,,158141,27638,OLA
39,,SING,C14,C15,no,N,39,,158141,27638,OLA
40,,SING,C14,H141,no,N,40,,158141,27638,OLA
41,,SING,C14,H142,no,N,41,,158141,27638,OLA
42,,SING,C15,C16,no,N,42,,158141,27638,OLA
43,,SING,C15,H151,no,N,43,,158141,27638,OLA
44,,SING,C15,H152,no,N,44,,158141,27638,OLA
45,,SING,C16,C17,no,N,45,,158141,27638,OLA
46,,SING,C16,H161,no,N,46,,158141,27638,OLA
47,,SING,C16,H162,no,N,47,,158141,27638,OLA
48,,SING,C17,C18,no,N,48,,158141,27638,OLA
49,,SING,C17,H171,no,N,49,,158141,27638,OLA
50,,SING,C17,H172,no,N,50,,158141,27638,OLA
51,,SING,C18,H181,no,N,51,,158141,27638,OLA
52,,SING,C18,H182,no,N,52,,158141,27638,OLA
53,,SING,C18,H183,no,N,53,,158141,27638,OLA
1,,DOUB,PB,O1B,no,N,1,,158264,27646,GDP
2,,SING,PB,O2B,no,N,2,,158264,27646,GDP
3,,SING,PB,O3B,no,N,3,,158264,27646,GDP
4,,SING,PB,O3A,no,N,4,,158264,27646,GDP
5,,SING,O2B,HOB2,no,N,5,,158264,27646,GDP
6,,SING,O3B,HOB3,no,N,6,,158264,27646,GDP
7,,SING,O3A,PA,no,N,7,,158264,27646,GDP
8,,DOUB,PA,O1A,no,N,8,,158264,27646,GDP
9,,SING,PA,O2A,no,N,9,,158264,27646,GDP
10,,SING,PA,O5',no,N,10,,158264,27646,GDP
11,,SING,O2A,HOA2,no,N,11,,158264,27646,GDP
12,,SING,O5',C5',no,N,12,,158264,27646,GDP
13,,SING,C5',C4',no,N,13,,158264,27646,GDP
14,,SING,C5',H5',no,N,14,,158264,27646,GDP
15,,SING,C5',H5'',no,N,15,,158264,27646,GDP
16,,SING,C4',O4',no,N,16,,158264,27646,GDP
17,,SING,C4',C3',no,N,17,,158264,27646,GDP
18,,SING,C4',H4',no,N,18,,158264,27646,GDP
19,,SING,O4',C1',no,N,19,,158264,27646,GDP
20,,SING,C3',O3',no,N,20,,158264,27646,GDP
21,,SING,C3',C2',no,N,21,,158264,27646,GDP
22,,SING,C3',H3',no,N,22,,158264,27646,GDP
23,,SING,O3',HO3',no,N,23,,158264,27646,GDP
24,,SING,C2',O2',no,N,24,,158264,27646,GDP
25,,SING,C2',C1',no,N,25,,158264,27646,GDP
26,,SING,C2',H2',no,N,26,,158264,27646,GDP
27,,SING,O2',HO2',no,N,27,,158264,27646,GDP
28,,SING,C1',N9,no,N,28,,158264,27646,GDP
29,,SING,C1',H1',no,N,29,,158264,27646,GDP
30,,SING,N9,C8,yes,N,30,,158264,27646,GDP
31,,SING,N9,C4,yes,N,31,,158264,27646,GDP
32,,DOUB,C8,N7,yes,N,32,,158264,27646,GDP
33,,SING,C8,H8,no,N,33,,158264,27646,GDP
34,,SING,N7,C5,yes,N,34,,158264,27646,GDP
35,,SING,C5,C6,no,N,35,,158264,27646,GDP
36,,DOUB,C5,C4,yes,N,36,,158264,27646,GDP
37,,DOUB,C6,O6,no,N,37,,158264,27646,GDP
38,,SING,C6,N1,no,N,38,,158264,27646,GDP
39,,SING,N1,C2,no,N,39,,158264,27646,GDP
40,,SING,N1,HN1,no,N,40,,158264,27646,GDP
41,,SING,C2,N2,no,N,41,,158264,27646,GDP
42,,DOUB,C2,N3,no,N,42,,158264,27646,GDP
43,,SING,N2,HN21,no,N,43,,158264,27646,GDP
44,,SING,N2,HN22,no,N,44,,158264,27646,GDP
45,,SING,N3,C4,no,N,45,,158264,27646,GDP
1,,SING,N,CA,no,N,1,,158285,27647,SEP
2,,SING,N,H,no,N,2,,158285,27647,SEP
3,,SING,N,H2,no,N,3,,158285,27647,SEP
4,,SING,CA,CB,no,N,4,,158285,27647,SEP
5,,SING,CA,C,no,N,5,,158285,27647,SEP
6,,SING,CA,HA,no,N,6,,158285,27647,SEP
7,,SING,CB,OG,no,N,7,,158285,27647,SEP
8,,SING,CB,HB2,no,N,8,,158285,27647,SEP
9,,SING,CB,HB3,no,N,9,,158285,27647,SEP
10,,SING,OG,P,no,N,10,,158285,27647,SEP
11,,DOUB,C,O,no,N,11,,158285,27647,SEP
12,,SING,C,OXT,no,N,12,,158285,27647,SEP
13,,SING,OXT,HXT,no,N,13,,158285,27647,SEP
14,,DOUB,P,O1P,no,N,14,,158285,27647,SEP
15,,SING,P,O2P,no,N,15,,158285,27647,SEP
16,,SING,P,O3P,no,N,16,,158285,27647,SEP
17,,SING,O2P,HOP2,no,N,17,,158285,27647,SEP
18,,SING,O3P,HOP3,no,N,18,,158285,27647,SEP
1,,SING,N,CA,no,N,1,,158286,27647,TPO
2,,SING,N,H,no,N,2,,158286,27647,TPO
3,,SING,N,H2,no,N,3,,158286,27647,TPO
4,,SING,CA,CB,no,N,4,,158286,27647,TPO
5,,SING,CA,C,no,N,5,,158286,27647,TPO
6,,SING,CA,HA,no,N,6,,158286,27647,TPO
7,,SING,CB,CG2,no,N,7,,158286,27647,TPO
8,,SING,CB,OG1,no,N,8,,158286,27647,TPO
9,,SING,CB,HB,no,N,9,,158286,27647,TPO
10,,SING,CG2,HG21,no,N,10,,158286,27647,TPO
11,,SING,CG2,HG22,no,N,11,,158286,27647,TPO
12,,SING,CG2,HG23,no,N,12,,158286,27647,TPO
13,,SING,OG1,P,no,N,13,,158286,27647,TPO
14,,DOUB,P,O1P,no,N,14,,158286,27647,TPO
15,,SING,P,O2P,no,N,15,,158286,27647,TPO
16,,SING,P,O3P,no,N,16,,158286,27647,TPO
17,,SING,O2P,HOP2,no,N,17,,158286,27647,TPO
18,,SING,O3P,HOP3,no,N,18,,158286,27647,TPO
19,,DOUB,C,O,no,N,19,,158286,27647,TPO
20,,SING,C,OXT,no,N,20,,158286,27647,TPO
21,,SING,OXT,HXT,no,N,21,,158286,27647,TPO
1,,SING,FE1,S1,no,N,1,,158634,27673,FES
2,,SING,FE1,S2,no,N,2,,158634,27673,FES
3,,SING,FE2,S1,no,N,3,,158634,27673,FES
4,,SING,FE2,S2,no,N,4,,158634,27673,FES
1,,DOUB,PB,O1B,no,N,1,,159302,27718,GDP
2,,SING,PB,O2B,no,N,2,,159302,27718,GDP
3,,SING,PB,O3B,no,N,3,,159302,27718,GDP
4,,SING,PB,O3A,no,N,4,,159302,27718,GDP
5,,SING,O2B,HOB2,no,N,5,,159302,27718,GDP
6,,SING,O3B,HOB3,no,N,6,,159302,27718,GDP
7,,SING,O3A,PA,no,N,7,,159302,27718,GDP
8,,DOUB,PA,O1A,no,N,8,,159302,27718,GDP
9,,SING,PA,O2A,no,N,9,,159302,27718,GDP
10,,SING,PA,O5',no,N,10,,159302,27718,GDP
11,,SING,O2A,HOA2,no,N,11,,159302,27718,GDP
12,,SING,O5',C5',no,N,12,,159302,27718,GDP
13,,SING,C5',C4',no,N,13,,159302,27718,GDP
14,,SING,C5',H5',no,N,14,,159302,27718,GDP
15,,SING,C5',H5'',no,N,15,,159302,27718,GDP
16,,SING,C4',O4',no,N,16,,159302,27718,GDP
17,,SING,C4',C3',no,N,17,,159302,27718,GDP
18,,SING,C4',H4',no,N,18,,159302,27718,GDP
19,,SING,O4',C1',no,N,19,,159302,27718,GDP
20,,SING,C3',O3',no,N,20,,159302,27718,GDP
21,,SING,C3',C2',no,N,21,,159302,27718,GDP
22,,SING,C3',H3',no,N,22,,159302,27718,GDP
23,,SING,O3',HO3',no,N,23,,159302,27718,GDP
24,,SING,C2',O2',no,N,24,,159302,27718,GDP
25,,SING,C2',C1',no,N,25,,159302,27718,GDP
26,,SING,C2',H2',no,N,26,,159302,27718,GDP
27,,SING,O2',HO2',no,N,27,,159302,27718,GDP
28,,SING,C1',N9,no,N,28,,159302,27718,GDP
29,,SING,C1',H1',no,N,29,,159302,27718,GDP
30,,SING,N9,C8,yes,N,30,,159302,27718,GDP
31,,SING,N9,C4,yes,N,31,,159302,27718,GDP
32,,DOUB,C8,N7,yes,N,32,,159302,27718,GDP
33,,SING,C8,H8,no,N,33,,159302,27718,GDP
34,,SING,N7,C5,yes,N,34,,159302,27718,GDP
35,,SING,C5,C6,no,N,35,,159302,27718,GDP
36,,DOUB,C5,C4,yes,N,36,,159302,27718,GDP
37,,DOUB,C6,O6,no,N,37,,159302,27718,GDP
38,,SING,C6,N1,no,N,38,,159302,27718,GDP
39,,SING,N1,C2,no,N,39,,159302,27718,GDP
40,,SING,N1,HN1,no,N,40,,159302,27718,GDP
41,,SING,C2,N2,no,N,41,,159302,27718,GDP
42,,DOUB,C2,N3,no,N,42,,159302,27718,GDP
43,,SING,N2,HN21,no,N,43,,159302,27718,GDP
44,,SING,N2,HN22,no,N,44,,159302,27718,GDP
45,,SING,N3,C4,no,N,45,,159302,27718,GDP
1,,DOUB,PB,O1B,no,N,1,,159321,27719,GDP
2,,SING,PB,O2B,no,N,2,,159321,27719,GDP
3,,SING,PB,O3B,no,N,3,,159321,27719,GDP
4,,SING,PB,O3A,no,N,4,,159321,27719,GDP
5,,SING,O2B,HOB2,no,N,5,,159321,27719,GDP
6,,SING,O3B,HOB3,no,N,6,,159321,27719,GDP
7,,SING,O3A,PA,no,N,7,,159321,27719,GDP
8,,DOUB,PA,O1A,no,N,8,,159321,27719,GDP
9,,SING,PA,O2A,no,N,9,,159321,27719,GDP
10,,SING,PA,O5',no,N,10,,159321,27719,GDP
11,,SING,O2A,HOA2,no,N,11,,159321,27719,GDP
12,,SING,O5',C5',no,N,12,,159321,27719,GDP
13,,SING,C5',C4',no,N,13,,159321,27719,GDP
14,,SING,C5',H5',no,N,14,,159321,27719,GDP
15,,SING,C5',H5'',no,N,15,,159321,27719,GDP
16,,SING,C4',O4',no,N,16,,159321,27719,GDP
17,,SING,C4',C3',no,N,17,,159321,27719,GDP
18,,SING,C4',H4',no,N,18,,159321,27719,GDP
19,,SING,O4',C1',no,N,19,,159321,27719,GDP
20,,SING,C3',O3',no,N,20,,159321,27719,GDP
21,,SING,C3',C2',no,N,21,,159321,27719,GDP
22,,SING,C3',H3',no,N,22,,159321,27719,GDP
23,,SING,O3',HO3',no,N,23,,159321,27719,GDP
24,,SING,C2',O2',no,N,24,,159321,27719,GDP
25,,SING,C2',C1',no,N,25,,159321,27719,GDP
26,,SING,C2',H2',no,N,26,,159321,27719,GDP
27,,SING,O2',HO2',no,N,27,,159321,27719,GDP
28,,SING,C1',N9,no,N,28,,159321,27719,GDP
29,,SING,C1',H1',no,N,29,,159321,27719,GDP
30,,SING,N9,C8,yes,N,30,,159321,27719,GDP
31,,SING,N9,C4,yes,N,31,,159321,27719,GDP
32,,DOUB,C8,N7,yes,N,32,,159321,27719,GDP
33,,SING,C8,H8,no,N,33,,159321,27719,GDP
34,,SING,N7,C5,yes,N,34,,159321,27719,GDP
35,,SING,C5,C6,no,N,35,,159321,27719,GDP
36,,DOUB,C5,C4,yes,N,36,,159321,27719,GDP
37,,DOUB,C6,O6,no,N,37,,159321,27719,GDP
38,,SING,C6,N1,no,N,38,,159321,27719,GDP
39,,SING,N1,C2,no,N,39,,159321,27719,GDP
40,,SING,N1,HN1,no,N,40,,159321,27719,GDP
41,,SING,C2,N2,no,N,41,,159321,27719,GDP
42,,DOUB,C2,N3,no,N,42,,159321,27719,GDP
43,,SING,N2,HN21,no,N,43,,159321,27719,GDP
44,,SING,N2,HN22,no,N,44,,159321,27719,GDP
45,,SING,N3,C4,no,N,45,,159321,27719,GDP
1,,DOUB,PB,O1B,no,N,1,,159340,27720,GDP
2,,SING,PB,O2B,no,N,2,,159340,27720,GDP
3,,SING,PB,O3B,no,N,3,,159340,27720,GDP
4,,SING,PB,O3A,no,N,4,,159340,27720,GDP
5,,SING,O2B,HOB2,no,N,5,,159340,27720,GDP
6,,SING,O3B,HOB3,no,N,6,,159340,27720,GDP
7,,SING,O3A,PA,no,N,7,,159340,27720,GDP
8,,DOUB,PA,O1A,no,N,8,,159340,27720,GDP
9,,SING,PA,O2A,no,N,9,,159340,27720,GDP
10,,SING,PA,O5',no,N,10,,159340,27720,GDP
11,,SING,O2A,HOA2,no,N,11,,159340,27720,GDP
12,,SING,O5',C5',no,N,12,,159340,27720,GDP
13,,SING,C5',C4',no,N,13,,159340,27720,GDP
14,,SING,C5',H5',no,N,14,,159340,27720,GDP
15,,SING,C5',H5'',no,N,15,,159340,27720,GDP
16,,SING,C4',O4',no,N,16,,159340,27720,GDP
17,,SING,C4',C3',no,N,17,,159340,27720,GDP
18,,SING,C4',H4',no,N,18,,159340,27720,GDP
19,,SING,O4',C1',no,N,19,,159340,27720,GDP
20,,SING,C3',O3',no,N,20,,159340,27720,GDP
21,,SING,C3',C2',no,N,21,,159340,27720,GDP
22,,SING,C3',H3',no,N,22,,159340,27720,GDP
23,,SING,O3',HO3',no,N,23,,159340,27720,GDP
24,,SING,C2',O2',no,N,24,,159340,27720,GDP
25,,SING,C2',C1',no,N,25,,159340,27720,GDP
26,,SING,C2',H2',no,N,26,,159340,27720,GDP
27,,SING,O2',HO2',no,N,27,,159340,27720,GDP
28,,SING,C1',N9,no,N,28,,159340,27720,GDP
29,,SING,C1',H1',no,N,29,,159340,27720,GDP
30,,SING,N9,C8,yes,N,30,,159340,27720,GDP
31,,SING,N9,C4,yes,N,31,,159340,27720,GDP
32,,DOUB,C8,N7,yes,N,32,,159340,27720,GDP
33,,SING,C8,H8,no,N,33,,159340,27720,GDP
34,,SING,N7,C5,yes,N,34,,159340,27720,GDP
35,,SING,C5,C6,no,N,35,,159340,27720,GDP
36,,DOUB,C5,C4,yes,N,36,,159340,27720,GDP
37,,DOUB,C6,O6,no,N,37,,159340,27720,GDP
38,,SING,C6,N1,no,N,38,,159340,27720,GDP
39,,SING,N1,C2,no,N,39,,159340,27720,GDP
40,,SING,N1,HN1,no,N,40,,159340,27720,GDP
41,,SING,C2,N2,no,N,41,,159340,27720,GDP
42,,DOUB,C2,N3,no,N,42,,159340,27720,GDP
43,,SING,N2,HN21,no,N,43,,159340,27720,GDP
44,,SING,N2,HN22,no,N,44,,159340,27720,GDP
45,,SING,N3,C4,no,N,45,,159340,27720,GDP
1,,SING,PG,O3B,no,N,1,,159482,27726,GSP
2,,DOUB,PG,S1G,no,N,2,,159482,27726,GSP
3,,SING,PG,O2G,no,N,3,,159482,27726,GSP
4,,SING,PG,O3G,no,N,4,,159482,27726,GSP
5,,SING,O3B,PB,no,N,5,,159482,27726,GSP
6,,SING,O2G,HOG2,no,N,6,,159482,27726,GSP
7,,SING,O3G,HOG3,no,N,7,,159482,27726,GSP
8,,DOUB,PB,O1B,no,N,8,,159482,27726,GSP
9,,SING,PB,O2B,no,N,9,,159482,27726,GSP
10,,SING,PB,O3A,no,N,10,,159482,27726,GSP
11,,SING,O2B,HOB2,no,N,11,,159482,27726,GSP
12,,DOUB,PA,O1A,no,N,12,,159482,27726,GSP
13,,SING,PA,O2A,no,N,13,,159482,27726,GSP
14,,SING,PA,O3A,no,N,14,,159482,27726,GSP
15,,SING,PA,O5',no,N,15,,159482,27726,GSP
16,,SING,O2A,HOA2,no,N,16,,159482,27726,GSP
17,,SING,O5',C5',no,N,17,,159482,27726,GSP
18,,SING,C5',C4',no,N,18,,159482,27726,GSP
19,,SING,C5',H5'1,no,N,19,,159482,27726,GSP
20,,SING,C5',H5'2,no,N,20,,159482,27726,GSP
21,,SING,C4',O4',no,N,21,,159482,27726,GSP
22,,SING,C4',C3',no,N,22,,159482,27726,GSP
23,,SING,C4',H4',no,N,23,,159482,27726,GSP
24,,SING,O4',C1',no,N,24,,159482,27726,GSP
25,,SING,C3',O3',no,N,25,,159482,27726,GSP
26,,SING,C3',C2',no,N,26,,159482,27726,GSP
27,,SING,C3',H3',no,N,27,,159482,27726,GSP
28,,SING,O3',HO3',no,N,28,,159482,27726,GSP
29,,SING,C2',O2',no,N,29,,159482,27726,GSP
30,,SING,C2',C1',no,N,30,,159482,27726,GSP
31,,SING,C2',H2',no,N,31,,159482,27726,GSP
32,,SING,O2',HO2',no,N,32,,159482,27726,GSP
33,,SING,C1',N9,no,N,33,,159482,27726,GSP
34,,SING,C1',H1',no,N,34,,159482,27726,GSP
35,,SING,N9,C8,yes,N,35,,159482,27726,GSP
36,,SING,N9,C4,yes,N,36,,159482,27726,GSP
37,,DOUB,C8,N7,yes,N,37,,159482,27726,GSP
38,,SING,C8,H8,no,N,38,,159482,27726,GSP
39,,SING,N7,C5,yes,N,39,,159482,27726,GSP
40,,SING,C5,C6,no,N,40,,159482,27726,GSP
41,,DOUB,C5,C4,yes,N,41,,159482,27726,GSP
42,,DOUB,C6,O6,no,N,42,,159482,27726,GSP
43,,SING,C6,N1,no,N,43,,159482,27726,GSP
44,,SING,N1,C2,no,N,44,,159482,27726,GSP
45,,SING,N1,HN1,no,N,45,,159482,27726,GSP
46,,SING,C2,N2,no,N,46,,159482,27726,GSP
47,,DOUB,C2,N3,no,N,47,,159482,27726,GSP
48,,SING,N2,HN21,no,N,48,,159482,27726,GSP
49,,SING,N2,HN22,no,N,49,,159482,27726,GSP
50,,SING,N3,C4,no,N,50,,159482,27726,GSP
1,,SING,N,CA,no,N,1,,159499,27728,ABA
2,,SING,N,H,no,N,2,,159499,27728,ABA
3,,SING,N,HN2,no,N,3,,159499,27728,ABA
4,,SING,CA,C,no,N,4,,159499,27728,ABA
5,,SING,CA,CB,no,N,5,,159499,27728,ABA
6,,SING,CA,HA,no,N,6,,159499,27728,ABA
7,,DOUB,C,O,no,N,7,,159499,27728,ABA
8,,SING,C,OXT,no,N,8,,159499,27728,ABA
9,,SING,CB,CG,no,N,9,,159499,27728,ABA
10,,SING,CB,HB3,no,N,10,,159499,27728,ABA
11,,SING,CB,HB2,no,N,11,,159499,27728,ABA
12,,SING,CG,HG1,no,N,12,,159499,27728,ABA
13,,SING,CG,HG3,no,N,13,,159499,27728,ABA
14,,SING,CG,HG2,no,N,14,,159499,27728,ABA
15,,SING,OXT,HXT,no,N,15,,159499,27728,ABA
1,,SING,N,CA,no,N,1,,159500,27728,NLE
2,,SING,N,H,no,N,2,,159500,27728,NLE
3,,SING,N,HN2,no,N,3,,159500,27728,NLE
4,,SING,CA,C,no,N,4,,159500,27728,NLE
5,,SING,CA,CB,no,N,5,,159500,27728,NLE
6,,SING,CA,HA,no,N,6,,159500,27728,NLE
7,,DOUB,C,O,no,N,7,,159500,27728,NLE
8,,SING,C,OXT,no,N,8,,159500,27728,NLE
9,,SING,OXT,HXT,no,N,9,,159500,27728,NLE
10,,SING,CB,CG,no,N,10,,159500,27728,NLE
11,,SING,CB,HB2,no,N,11,,159500,27728,NLE
12,,SING,CB,HB3,no,N,12,,159500,27728,NLE
13,,SING,CG,CD,no,N,13,,159500,27728,NLE
14,,SING,CG,HG2,no,N,14,,159500,27728,NLE
15,,SING,CG,HG3,no,N,15,,159500,27728,NLE
16,,SING,CD,CE,no,N,16,,159500,27728,NLE
17,,SING,CD,HD2,no,N,17,,159500,27728,NLE
18,,SING,CD,HD3,no,N,18,,159500,27728,NLE
19,,SING,CE,HE1,no,N,19,,159500,27728,NLE
20,,SING,CE,HE2,no,N,20,,159500,27728,NLE
21,,SING,CE,HE3,no,N,21,,159500,27728,NLE
1,,SING,N,CA,no,N,1,,159534,27730,ABA
2,,SING,N,H,no,N,2,,159534,27730,ABA
3,,SING,N,HN2,no,N,3,,159534,27730,ABA
4,,SING,CA,C,no,N,4,,159534,27730,ABA
5,,SING,CA,CB,no,N,5,,159534,27730,ABA
6,,SING,CA,HA,no,N,6,,159534,27730,ABA
7,,DOUB,C,O,no,N,7,,159534,27730,ABA
8,,SING,C,OXT,no,N,8,,159534,27730,ABA
9,,SING,CB,CG,no,N,9,,159534,27730,ABA
10,,SING,CB,HB3,no,N,10,,159534,27730,ABA
11,,SING,CB,HB2,no,N,11,,159534,27730,ABA
12,,SING,CG,HG1,no,N,12,,159534,27730,ABA
13,,SING,CG,HG3,no,N,13,,159534,27730,ABA
14,,SING,CG,HG2,no,N,14,,159534,27730,ABA
15,,SING,OXT,HXT,no,N,15,,159534,27730,ABA
1,,SING,N,CA,no,N,1,,159535,27730,NLE
2,,SING,N,H,no,N,2,,159535,27730,NLE
3,,SING,N,HN2,no,N,3,,159535,27730,NLE
4,,SING,CA,C,no,N,4,,159535,27730,NLE
5,,SING,CA,CB,no,N,5,,159535,27730,NLE
6,,SING,CA,HA,no,N,6,,159535,27730,NLE
7,,DOUB,C,O,no,N,7,,159535,27730,NLE
8,,SING,C,OXT,no,N,8,,159535,27730,NLE
9,,SING,OXT,HXT,no,N,9,,159535,27730,NLE
10,,SING,CB,CG,no,N,10,,159535,27730,NLE
11,,SING,CB,HB2,no,N,11,,159535,27730,NLE
12,,SING,CB,HB3,no,N,12,,159535,27730,NLE
13,,SING,CG,CD,no,N,13,,159535,27730,NLE
14,,SING,CG,HG2,no,N,14,,159535,27730,NLE
15,,SING,CG,HG3,no,N,15,,159535,27730,NLE
16,,SING,CD,CE,no,N,16,,159535,27730,NLE
17,,SING,CD,HD2,no,N,17,,159535,27730,NLE
18,,SING,CD,HD3,no,N,18,,159535,27730,NLE
19,,SING,CE,HE1,no,N,19,,159535,27730,NLE
20,,SING,CE,HE2,no,N,20,,159535,27730,NLE
21,,SING,CE,HE3,no,N,21,,159535,27730,NLE
1,,SING,C1,C2,no,N,1,,159575,27733,FK5
2,,SING,C1,O1,no,N,2,,159575,27733,FK5
3,,DOUB,C1,O2,no,N,3,,159575,27733,FK5
4,,SING,C2,C3,no,N,4,,159575,27733,FK5
5,,SING,C2,N7,no,N,5,,159575,27733,FK5
6,,SING,C2,H2,no,N,6,,159575,27733,FK5
7,,SING,C3,C4,no,N,7,,159575,27733,FK5
8,,SING,C3,H31A,no,N,8,,159575,27733,FK5
9,,SING,C3,H32A,no,N,9,,159575,27733,FK5
10,,SING,C4,C5,no,N,10,,159575,27733,FK5
11,,SING,C4,H41,no,N,11,,159575,27733,FK5
12,,SING,C4,H42,no,N,12,,159575,27733,FK5
13,,SING,C5,C6,no,N,13,,159575,27733,FK5
14,,SING,C5,H51,no,N,14,,159575,27733,FK5
15,,SING,C5,H52,no,N,15,,159575,27733,FK5
16,,SING,C6,N7,no,N,16,,159575,27733,FK5
17,,SING,C6,H61,no,N,17,,159575,27733,FK5
18,,SING,C6,H62,no,N,18,,159575,27733,FK5
19,,SING,C8,C9,no,N,19,,159575,27733,FK5
20,,SING,C8,N7,no,N,20,,159575,27733,FK5
21,,DOUB,C8,O3,no,N,21,,159575,27733,FK5
22,,SING,C9,C10,no,N,22,,159575,27733,FK5
23,,DOUB,C9,O4,no,N,23,,159575,27733,FK5
24,,SING,C10,C11,no,N,24,,159575,27733,FK5
25,,SING,C10,O5,no,N,25,,159575,27733,FK5
26,,SING,C10,O6,no,N,26,,159575,27733,FK5
27,,SING,C11,C12,no,N,27,,159575,27733,FK5
28,,SING,C11,C35,no,N,28,,159575,27733,FK5
29,,SING,C11,H11,no,N,29,,159575,27733,FK5
30,,SING,C12,C13,no,N,30,,159575,27733,FK5
31,,SING,C12,H121,no,N,31,,159575,27733,FK5
32,,SING,C12,H122,no,N,32,,159575,27733,FK5
33,,SING,C13,C14,no,N,33,,159575,27733,FK5
34,,SING,C13,O7,no,N,34,,159575,27733,FK5
35,,SING,C13,H13,no,N,35,,159575,27733,FK5
36,,SING,C14,C15,no,N,36,,159575,27733,FK5
37,,SING,C14,O5,no,N,37,,159575,27733,FK5
38,,SING,C14,H14,no,N,38,,159575,27733,FK5
39,,SING,C15,C16,no,N,39,,159575,27733,FK5
40,,SING,C15,O8,no,N,40,,159575,27733,FK5
41,,SING,C15,H15,no,N,41,,159575,27733,FK5
42,,SING,C16,C17,no,N,42,,159575,27733,FK5
43,,SING,C16,H161,no,N,43,,159575,27733,FK5
44,,SING,C16,H162,no,N,44,,159575,27733,FK5
45,,SING,C17,C18,no,N,45,,159575,27733,FK5
46,,SING,C17,C36,no,N,46,,159575,27733,FK5
47,,SING,C17,H17,no,N,47,,159575,27733,FK5
48,,SING,C18,C19,no,N,48,,159575,27733,FK5
49,,SING,C18,H181,no,N,49,,159575,27733,FK5
50,,SING,C18,H182,no,N,50,,159575,27733,FK5
51,,DOUB,C19,C20,no,E,51,,159575,27733,FK5
52,,SING,C19,C37,no,N,52,,159575,27733,FK5
53,,SING,C20,C21,no,N,53,,159575,27733,FK5
54,,SING,C20,H20,no,N,54,,159575,27733,FK5
55,,SING,C21,C22,no,N,55,,159575,27733,FK5
56,,SING,C21,C38,no,N,56,,159575,27733,FK5
57,,SING,C21,H21,no,N,57,,159575,27733,FK5
58,,SING,C22,C23,no,N,58,,159575,27733,FK5
59,,DOUB,C22,O9,no,N,59,,159575,27733,FK5
60,,SING,C23,C24,no,N,60,,159575,27733,FK5
61,,SING,C23,H231,no,N,61,,159575,27733,FK5
62,,SING,C23,H232,no,N,62,,159575,27733,FK5
63,,SING,C24,C25,no,N,63,,159575,27733,FK5
64,,SING,C24,O10,no,N,64,,159575,27733,FK5
65,,SING,C24,H24,no,N,65,,159575,27733,FK5
66,,SING,C25,C26,no,N,66,,159575,27733,FK5
67,,SING,C25,C41,no,N,67,,159575,27733,FK5
68,,SING,C25,H25,no,N,68,,159575,27733,FK5
69,,SING,C26,C27,no,N,69,,159575,27733,FK5
70,,SING,C26,O1,no,N,70,,159575,27733,FK5
71,,SING,C26,H26,no,N,71,,159575,27733,FK5
72,,DOUB,C27,C28,no,E,72,,159575,27733,FK5
73,,SING,C27,C42,no,N,73,,159575,27733,FK5
74,,SING,C28,C29,no,N,74,,159575,27733,FK5
75,,SING,C28,H28,no,N,75,,159575,27733,FK5
76,,SING,C29,C30,no,N,76,,159575,27733,FK5
77,,SING,C29,C34,no,N,77,,159575,27733,FK5
78,,SING,C29,H29,no,N,78,,159575,27733,FK5
79,,SING,C30,C31,no,N,79,,159575,27733,FK5
80,,SING,C30,H301,no,N,80,,159575,27733,FK5
81,,SING,C30,H302,no,N,81,,159575,27733,FK5
82,,SING,C31,C32,no,N,82,,159575,27733,FK5
83,,SING,C31,O11,no,N,83,,159575,27733,FK5
84,,SING,C31,H31,no,N,84,,159575,27733,FK5
85,,SING,C32,C33,no,N,85,,159575,27733,FK5
86,,SING,C32,O12,no,N,86,,159575,27733,FK5
87,,SING,C32,H32,no,N,87,,159575,27733,FK5
88,,SING,C33,C34,no,N,88,,159575,27733,FK5
89,,SING,C33,H331,no,N,89,,159575,27733,FK5
90,,SING,C33,H332,no,N,90,,159575,27733,FK5
91,,SING,C34,H341,no,N,91,,159575,27733,FK5
92,,SING,C34,H342,no,N,92,,159575,27733,FK5
93,,SING,C35,H351,no,N,93,,159575,27733,FK5
94,,SING,C35,H352,no,N,94,,159575,27733,FK5
95,,SING,C35,H353,no,N,95,,159575,27733,FK5
96,,SING,C36,H361,no,N,96,,159575,27733,FK5
97,,SING,C36,H362,no,N,97,,159575,27733,FK5
98,,SING,C36,H363,no,N,98,,159575,27733,FK5
99,,SING,C37,H371,no,N,99,,159575,27733,FK5
100,,SING,C37,H372,no,N,100,,159575,27733,FK5
101,,SING,C37,H373,no,N,101,,159575,27733,FK5
102,,SING,C38,C39,no,N,102,,159575,27733,FK5
103,,SING,C38,H381,no,N,103,,159575,27733,FK5
104,,SING,C38,H382,no,N,104,,159575,27733,FK5
105,,DOUB,C39,C40,no,N,105,,159575,27733,FK5
106,,SING,C39,H39,no,N,106,,159575,27733,FK5
107,,SING,C40,H401,no,N,107,,159575,27733,FK5
108,,SING,C40,H402,no,N,108,,159575,27733,FK5
109,,SING,C41,H411,no,N,109,,159575,27733,FK5
110,,SING,C41,H412,no,N,110,,159575,27733,FK5
111,,SING,C41,H413,no,N,111,,159575,27733,FK5
112,,SING,C42,H421,no,N,112,,159575,27733,FK5
113,,SING,C42,H422,no,N,113,,159575,27733,FK5
114,,SING,C42,H423,no,N,114,,159575,27733,FK5
115,,SING,C43,O7,no,N,115,,159575,27733,FK5
116,,SING,C43,H431,no,N,116,,159575,27733,FK5
117,,SING,C43,H432,no,N,117,,159575,27733,FK5
118,,SING,C43,H433,no,N,118,,159575,27733,FK5
119,,SING,C44,O8,no,N,119,,159575,27733,FK5
120,,SING,C44,H441,no,N,120,,159575,27733,FK5
121,,SING,C44,H442,no,N,121,,159575,27733,FK5
122,,SING,C44,H443,no,N,122,,159575,27733,FK5
123,,SING,C45,O11,no,N,123,,159575,27733,FK5
124,,SING,C45,H451,no,N,124,,159575,27733,FK5
125,,SING,C45,H452,no,N,125,,159575,27733,FK5
126,,SING,C45,H453,no,N,126,,159575,27733,FK5
127,,SING,O6,HO6,no,N,127,,159575,27733,FK5
128,,SING,O10,HO10,no,N,128,,159575,27733,FK5
129,,SING,O12,HO12,no,N,129,,159575,27733,FK5
1,,SING,C1,C2,no,N,1,,159619,27737,FK5
2,,SING,C1,O1,no,N,2,,159619,27737,FK5
3,,DOUB,C1,O2,no,N,3,,159619,27737,FK5
4,,SING,C2,C3,no,N,4,,159619,27737,FK5
5,,SING,C2,N7,no,N,5,,159619,27737,FK5
6,,SING,C2,H2,no,N,6,,159619,27737,FK5
7,,SING,C3,C4,no,N,7,,159619,27737,FK5
8,,SING,C3,H31A,no,N,8,,159619,27737,FK5
9,,SING,C3,H32A,no,N,9,,159619,27737,FK5
10,,SING,C4,C5,no,N,10,,159619,27737,FK5
11,,SING,C4,H41,no,N,11,,159619,27737,FK5
12,,SING,C4,H42,no,N,12,,159619,27737,FK5
13,,SING,C5,C6,no,N,13,,159619,27737,FK5
14,,SING,C5,H51,no,N,14,,159619,27737,FK5
15,,SING,C5,H52,no,N,15,,159619,27737,FK5
16,,SING,C6,N7,no,N,16,,159619,27737,FK5
17,,SING,C6,H61,no,N,17,,159619,27737,FK5
18,,SING,C6,H62,no,N,18,,159619,27737,FK5
19,,SING,C8,C9,no,N,19,,159619,27737,FK5
20,,SING,C8,N7,no,N,20,,159619,27737,FK5
21,,DOUB,C8,O3,no,N,21,,159619,27737,FK5
22,,SING,C9,C10,no,N,22,,159619,27737,FK5
23,,DOUB,C9,O4,no,N,23,,159619,27737,FK5
24,,SING,C10,C11,no,N,24,,159619,27737,FK5
25,,SING,C10,O5,no,N,25,,159619,27737,FK5
26,,SING,C10,O6,no,N,26,,159619,27737,FK5
27,,SING,C11,C12,no,N,27,,159619,27737,FK5
28,,SING,C11,C35,no,N,28,,159619,27737,FK5
29,,SING,C11,H11,no,N,29,,159619,27737,FK5
30,,SING,C12,C13,no,N,30,,159619,27737,FK5
31,,SING,C12,H121,no,N,31,,159619,27737,FK5
32,,SING,C12,H122,no,N,32,,159619,27737,FK5
33,,SING,C13,C14,no,N,33,,159619,27737,FK5
34,,SING,C13,O7,no,N,34,,159619,27737,FK5
35,,SING,C13,H13,no,N,35,,159619,27737,FK5
36,,SING,C14,C15,no,N,36,,159619,27737,FK5
37,,SING,C14,O5,no,N,37,,159619,27737,FK5
38,,SING,C14,H14,no,N,38,,159619,27737,FK5
39,,SING,C15,C16,no,N,39,,159619,27737,FK5
40,,SING,C15,O8,no,N,40,,159619,27737,FK5
41,,SING,C15,H15,no,N,41,,159619,27737,FK5
42,,SING,C16,C17,no,N,42,,159619,27737,FK5
43,,SING,C16,H161,no,N,43,,159619,27737,FK5
44,,SING,C16,H162,no,N,44,,159619,27737,FK5
45,,SING,C17,C18,no,N,45,,159619,27737,FK5
46,,SING,C17,C36,no,N,46,,159619,27737,FK5
47,,SING,C17,H17,no,N,47,,159619,27737,FK5
48,,SING,C18,C19,no,N,48,,159619,27737,FK5
49,,SING,C18,H181,no,N,49,,159619,27737,FK5
50,,SING,C18,H182,no,N,50,,159619,27737,FK5
51,,DOUB,C19,C20,no,E,51,,159619,27737,FK5
52,,SING,C19,C37,no,N,52,,159619,27737,FK5
53,,SING,C20,C21,no,N,53,,159619,27737,FK5
54,,SING,C20,H20,no,N,54,,159619,27737,FK5
55,,SING,C21,C22,no,N,55,,159619,27737,FK5
56,,SING,C21,C38,no,N,56,,159619,27737,FK5
57,,SING,C21,H21,no,N,57,,159619,27737,FK5
58,,SING,C22,C23,no,N,58,,159619,27737,FK5
59,,DOUB,C22,O9,no,N,59,,159619,27737,FK5
60,,SING,C23,C24,no,N,60,,159619,27737,FK5
61,,SING,C23,H231,no,N,61,,159619,27737,FK5
62,,SING,C23,H232,no,N,62,,159619,27737,FK5
63,,SING,C24,C25,no,N,63,,159619,27737,FK5
64,,SING,C24,O10,no,N,64,,159619,27737,FK5
65,,SING,C24,H24,no,N,65,,159619,27737,FK5
66,,SING,C25,C26,no,N,66,,159619,27737,FK5
67,,SING,C25,C41,no,N,67,,159619,27737,FK5
68,,SING,C25,H25,no,N,68,,159619,27737,FK5
69,,SING,C26,C27,no,N,69,,159619,27737,FK5
70,,SING,C26,O1,no,N,70,,159619,27737,FK5
71,,SING,C26,H26,no,N,71,,159619,27737,FK5
72,,DOUB,C27,C28,no,E,72,,159619,27737,FK5
73,,SING,C27,C42,no,N,73,,159619,27737,FK5
74,,SING,C28,C29,no,N,74,,159619,27737,FK5
75,,SING,C28,H28,no,N,75,,159619,27737,FK5
76,,SING,C29,C30,no,N,76,,159619,27737,FK5
77,,SING,C29,C34,no,N,77,,159619,27737,FK5
78,,SING,C29,H29,no,N,78,,159619,27737,FK5
79,,SING,C30,C31,no,N,79,,159619,27737,FK5
80,,SING,C30,H301,no,N,80,,159619,27737,FK5
81,,SING,C30,H302,no,N,81,,159619,27737,FK5
82,,SING,C31,C32,no,N,82,,159619,27737,FK5
83,,SING,C31,O11,no,N,83,,159619,27737,FK5
84,,SING,C31,H31,no,N,84,,159619,27737,FK5
85,,SING,C32,C33,no,N,85,,159619,27737,FK5
86,,SING,C32,O12,no,N,86,,159619,27737,FK5
87,,SING,C32,H32,no,N,87,,159619,27737,FK5
88,,SING,C33,C34,no,N,88,,159619,27737,FK5
89,,SING,C33,H331,no,N,89,,159619,27737,FK5
90,,SING,C33,H332,no,N,90,,159619,27737,FK5
91,,SING,C34,H341,no,N,91,,159619,27737,FK5
92,,SING,C34,H342,no,N,92,,159619,27737,FK5
93,,SING,C35,H351,no,N,93,,159619,27737,FK5
94,,SING,C35,H352,no,N,94,,159619,27737,FK5
95,,SING,C35,H353,no,N,95,,159619,27737,FK5
96,,SING,C36,H361,no,N,96,,159619,27737,FK5
97,,SING,C36,H362,no,N,97,,159619,27737,FK5
98,,SING,C36,H363,no,N,98,,159619,27737,FK5
99,,SING,C37,H371,no,N,99,,159619,27737,FK5
100,,SING,C37,H372,no,N,100,,159619,27737,FK5
101,,SING,C37,H373,no,N,101,,159619,27737,FK5
102,,SING,C38,C39,no,N,102,,159619,27737,FK5
103,,SING,C38,H381,no,N,103,,159619,27737,FK5
104,,SING,C38,H382,no,N,104,,159619,27737,FK5
105,,DOUB,C39,C40,no,N,105,,159619,27737,FK5
106,,SING,C39,H39,no,N,106,,159619,27737,FK5
107,,SING,C40,H401,no,N,107,,159619,27737,FK5
108,,SING,C40,H402,no,N,108,,159619,27737,FK5
109,,SING,C41,H411,no,N,109,,159619,27737,FK5
110,,SING,C41,H412,no,N,110,,159619,27737,FK5
111,,SING,C41,H413,no,N,111,,159619,27737,FK5
112,,SING,C42,H421,no,N,112,,159619,27737,FK5
113,,SING,C42,H422,no,N,113,,159619,27737,FK5
114,,SING,C42,H423,no,N,114,,159619,27737,FK5
115,,SING,C43,O7,no,N,115,,159619,27737,FK5
116,,SING,C43,H431,no,N,116,,159619,27737,FK5
117,,SING,C43,H432,no,N,117,,159619,27737,FK5
118,,SING,C43,H433,no,N,118,,159619,27737,FK5
119,,SING,C44,O8,no,N,119,,159619,27737,FK5
120,,SING,C44,H441,no,N,120,,159619,27737,FK5
121,,SING,C44,H442,no,N,121,,159619,27737,FK5
122,,SING,C44,H443,no,N,122,,159619,27737,FK5
123,,SING,C45,O11,no,N,123,,159619,27737,FK5
124,,SING,C45,H451,no,N,124,,159619,27737,FK5
125,,SING,C45,H452,no,N,125,,159619,27737,FK5
126,,SING,C45,H453,no,N,126,,159619,27737,FK5
127,,SING,O6,HO6,no,N,127,,159619,27737,FK5
128,,SING,O10,HO10,no,N,128,,159619,27737,FK5
129,,SING,O12,HO12,no,N,129,,159619,27737,FK5
1,,SING,C1,C2,no,N,1,,159663,27739,FK5
2,,SING,C1,O1,no,N,2,,159663,27739,FK5
3,,DOUB,C1,O2,no,N,3,,159663,27739,FK5
4,,SING,C2,C3,no,N,4,,159663,27739,FK5
5,,SING,C2,N7,no,N,5,,159663,27739,FK5
6,,SING,C2,H2,no,N,6,,159663,27739,FK5
7,,SING,C3,C4,no,N,7,,159663,27739,FK5
8,,SING,C3,H31A,no,N,8,,159663,27739,FK5
9,,SING,C3,H32A,no,N,9,,159663,27739,FK5
10,,SING,C4,C5,no,N,10,,159663,27739,FK5
11,,SING,C4,H41,no,N,11,,159663,27739,FK5
12,,SING,C4,H42,no,N,12,,159663,27739,FK5
13,,SING,C5,C6,no,N,13,,159663,27739,FK5
14,,SING,C5,H51,no,N,14,,159663,27739,FK5
15,,SING,C5,H52,no,N,15,,159663,27739,FK5
16,,SING,C6,N7,no,N,16,,159663,27739,FK5
17,,SING,C6,H61,no,N,17,,159663,27739,FK5
18,,SING,C6,H62,no,N,18,,159663,27739,FK5
19,,SING,C8,C9,no,N,19,,159663,27739,FK5
20,,SING,C8,N7,no,N,20,,159663,27739,FK5
21,,DOUB,C8,O3,no,N,21,,159663,27739,FK5
22,,SING,C9,C10,no,N,22,,159663,27739,FK5
23,,DOUB,C9,O4,no,N,23,,159663,27739,FK5
24,,SING,C10,C11,no,N,24,,159663,27739,FK5
25,,SING,C10,O5,no,N,25,,159663,27739,FK5
26,,SING,C10,O6,no,N,26,,159663,27739,FK5
27,,SING,C11,C12,no,N,27,,159663,27739,FK5
28,,SING,C11,C35,no,N,28,,159663,27739,FK5
29,,SING,C11,H11,no,N,29,,159663,27739,FK5
30,,SING,C12,C13,no,N,30,,159663,27739,FK5
31,,SING,C12,H121,no,N,31,,159663,27739,FK5
32,,SING,C12,H122,no,N,32,,159663,27739,FK5
33,,SING,C13,C14,no,N,33,,159663,27739,FK5
34,,SING,C13,O7,no,N,34,,159663,27739,FK5
35,,SING,C13,H13,no,N,35,,159663,27739,FK5
36,,SING,C14,C15,no,N,36,,159663,27739,FK5
37,,SING,C14,O5,no,N,37,,159663,27739,FK5
38,,SING,C14,H14,no,N,38,,159663,27739,FK5
39,,SING,C15,C16,no,N,39,,159663,27739,FK5
40,,SING,C15,O8,no,N,40,,159663,27739,FK5
41,,SING,C15,H15,no,N,41,,159663,27739,FK5
42,,SING,C16,C17,no,N,42,,159663,27739,FK5
43,,SING,C16,H161,no,N,43,,159663,27739,FK5
44,,SING,C16,H162,no,N,44,,159663,27739,FK5
45,,SING,C17,C18,no,N,45,,159663,27739,FK5
46,,SING,C17,C36,no,N,46,,159663,27739,FK5
47,,SING,C17,H17,no,N,47,,159663,27739,FK5
48,,SING,C18,C19,no,N,48,,159663,27739,FK5
49,,SING,C18,H181,no,N,49,,159663,27739,FK5
50,,SING,C18,H182,no,N,50,,159663,27739,FK5
51,,DOUB,C19,C20,no,E,51,,159663,27739,FK5
52,,SING,C19,C37,no,N,52,,159663,27739,FK5
53,,SING,C20,C21,no,N,53,,159663,27739,FK5
54,,SING,C20,H20,no,N,54,,159663,27739,FK5
55,,SING,C21,C22,no,N,55,,159663,27739,FK5
56,,SING,C21,C38,no,N,56,,159663,27739,FK5
57,,SING,C21,H21,no,N,57,,159663,27739,FK5
58,,SING,C22,C23,no,N,58,,159663,27739,FK5
59,,DOUB,C22,O9,no,N,59,,159663,27739,FK5
60,,SING,C23,C24,no,N,60,,159663,27739,FK5
61,,SING,C23,H231,no,N,61,,159663,27739,FK5
62,,SING,C23,H232,no,N,62,,159663,27739,FK5
63,,SING,C24,C25,no,N,63,,159663,27739,FK5
64,,SING,C24,O10,no,N,64,,159663,27739,FK5
65,,SING,C24,H24,no,N,65,,159663,27739,FK5
66,,SING,C25,C26,no,N,66,,159663,27739,FK5
67,,SING,C25,C41,no,N,67,,159663,27739,FK5
68,,SING,C25,H25,no,N,68,,159663,27739,FK5
69,,SING,C26,C27,no,N,69,,159663,27739,FK5
70,,SING,C26,O1,no,N,70,,159663,27739,FK5
71,,SING,C26,H26,no,N,71,,159663,27739,FK5
72,,DOUB,C27,C28,no,E,72,,159663,27739,FK5
73,,SING,C27,C42,no,N,73,,159663,27739,FK5
74,,SING,C28,C29,no,N,74,,159663,27739,FK5
75,,SING,C28,H28,no,N,75,,159663,27739,FK5
76,,SING,C29,C30,no,N,76,,159663,27739,FK5
77,,SING,C29,C34,no,N,77,,159663,27739,FK5
78,,SING,C29,H29,no,N,78,,159663,27739,FK5
79,,SING,C30,C31,no,N,79,,159663,27739,FK5
80,,SING,C30,H301,no,N,80,,159663,27739,FK5
81,,SING,C30,H302,no,N,81,,159663,27739,FK5
82,,SING,C31,C32,no,N,82,,159663,27739,FK5
83,,SING,C31,O11,no,N,83,,159663,27739,FK5
84,,SING,C31,H31,no,N,84,,159663,27739,FK5
85,,SING,C32,C33,no,N,85,,159663,27739,FK5
86,,SING,C32,O12,no,N,86,,159663,27739,FK5
87,,SING,C32,H32,no,N,87,,159663,27739,FK5
88,,SING,C33,C34,no,N,88,,159663,27739,FK5
89,,SING,C33,H331,no,N,89,,159663,27739,FK5
90,,SING,C33,H332,no,N,90,,159663,27739,FK5
91,,SING,C34,H341,no,N,91,,159663,27739,FK5
92,,SING,C34,H342,no,N,92,,159663,27739,FK5
93,,SING,C35,H351,no,N,93,,159663,27739,FK5
94,,SING,C35,H352,no,N,94,,159663,27739,FK5
95,,SING,C35,H353,no,N,95,,159663,27739,FK5
96,,SING,C36,H361,no,N,96,,159663,27739,FK5
97,,SING,C36,H362,no,N,97,,159663,27739,FK5
98,,SING,C36,H363,no,N,98,,159663,27739,FK5
99,,SING,C37,H371,no,N,99,,159663,27739,FK5
100,,SING,C37,H372,no,N,100,,159663,27739,FK5
101,,SING,C37,H373,no,N,101,,159663,27739,FK5
102,,SING,C38,C39,no,N,102,,159663,27739,FK5
103,,SING,C38,H381,no,N,103,,159663,27739,FK5
104,,SING,C38,H382,no,N,104,,159663,27739,FK5
105,,DOUB,C39,C40,no,N,105,,159663,27739,FK5
106,,SING,C39,H39,no,N,106,,159663,27739,FK5
107,,SING,C40,H401,no,N,107,,159663,27739,FK5
108,,SING,C40,H402,no,N,108,,159663,27739,FK5
109,,SING,C41,H411,no,N,109,,159663,27739,FK5
110,,SING,C41,H412,no,N,110,,159663,27739,FK5
111,,SING,C41,H413,no,N,111,,159663,27739,FK5
112,,SING,C42,H421,no,N,112,,159663,27739,FK5
113,,SING,C42,H422,no,N,113,,159663,27739,FK5
114,,SING,C42,H423,no,N,114,,159663,27739,FK5
115,,SING,C43,O7,no,N,115,,159663,27739,FK5
116,,SING,C43,H431,no,N,116,,159663,27739,FK5
117,,SING,C43,H432,no,N,117,,159663,27739,FK5
118,,SING,C43,H433,no,N,118,,159663,27739,FK5
119,,SING,C44,O8,no,N,119,,159663,27739,FK5
120,,SING,C44,H441,no,N,120,,159663,27739,FK5
121,,SING,C44,H442,no,N,121,,159663,27739,FK5
122,,SING,C44,H443,no,N,122,,159663,27739,FK5
123,,SING,C45,O11,no,N,123,,159663,27739,FK5
124,,SING,C45,H451,no,N,124,,159663,27739,FK5
125,,SING,C45,H452,no,N,125,,159663,27739,FK5
126,,SING,C45,H453,no,N,126,,159663,27739,FK5
127,,SING,O6,HO6,no,N,127,,159663,27739,FK5
128,,SING,O10,HO10,no,N,128,,159663,27739,FK5
129,,SING,O12,HO12,no,N,129,,159663,27739,FK5
1,,SING,N,CN,no,N,1,,159822,27752,BMT
2,,SING,N,CA,no,N,2,,159822,27752,BMT
3,,SING,N,H,no,N,3,,159822,27752,BMT
4,,SING,CN,HN1,no,N,4,,159822,27752,BMT
5,,SING,CN,HN2,no,N,5,,159822,27752,BMT
6,,SING,CN,HN3,no,N,6,,159822,27752,BMT
7,,SING,CA,C,no,N,7,,159822,27752,BMT
8,,SING,CA,CB,no,N,8,,159822,27752,BMT
9,,SING,CA,HA,no,N,9,,159822,27752,BMT
10,,DOUB,C,O,no,N,10,,159822,27752,BMT
11,,SING,C,OXT,no,N,11,,159822,27752,BMT
12,,SING,OXT,HXT,no,N,12,,159822,27752,BMT
13,,SING,CB,OG1,no,N,13,,159822,27752,BMT
14,,SING,CB,CG2,no,N,14,,159822,27752,BMT
15,,SING,CB,HB,no,N,15,,159822,27752,BMT
16,,SING,OG1,HG1,no,N,16,,159822,27752,BMT
17,,SING,CG2,CD1,no,N,17,,159822,27752,BMT
18,,SING,CG2,CD2,no,N,18,,159822,27752,BMT
19,,SING,CG2,HG2,no,N,19,,159822,27752,BMT
20,,SING,CD1,HD11,no,N,20,,159822,27752,BMT
21,,SING,CD1,HD12,no,N,21,,159822,27752,BMT
22,,SING,CD1,HD13,no,N,22,,159822,27752,BMT
23,,SING,CD2,CE,no,N,23,,159822,27752,BMT
24,,SING,CD2,HD22,no,N,24,,159822,27752,BMT
25,,SING,CD2,HD23,no,N,25,,159822,27752,BMT
26,,DOUB,CE,CZ,no,E,26,,159822,27752,BMT
27,,SING,CE,HE,no,N,27,,159822,27752,BMT
28,,SING,CZ,CH,no,N,28,,159822,27752,BMT
29,,SING,CZ,HZ,no,N,29,,159822,27752,BMT
30,,SING,CH,HH1,no,N,30,,159822,27752,BMT
31,,SING,CH,HH2,no,N,31,,159822,27752,BMT
32,,SING,CH,HH3,no,N,32,,159822,27752,BMT
1,,SING,N,CA,no,N,1,,159823,27752,DAL
2,,SING,N,H,no,N,2,,159823,27752,DAL
3,,SING,N,H2,no,N,3,,159823,27752,DAL
4,,SING,CA,CB,no,N,4,,159823,27752,DAL
5,,SING,CA,C,no,N,5,,159823,27752,DAL
6,,SING,CA,HA,no,N,6,,159823,27752,DAL
7,,SING,CB,HB1,no,N,7,,159823,27752,DAL
8,,SING,CB,HB2,no,N,8,,159823,27752,DAL
9,,SING,CB,HB3,no,N,9,,159823,27752,DAL
10,,DOUB,C,O,no,N,10,,159823,27752,DAL
11,,SING,C,OXT,no,N,11,,159823,27752,DAL
12,,SING,OXT,HXT,no,N,12,,159823,27752,DAL
1,,SING,N,CA,no,N,1,,159824,27752,SAR
2,,SING,N,CN,no,N,2,,159824,27752,SAR
3,,SING,N,H,no,N,3,,159824,27752,SAR
4,,SING,CA,C,no,N,4,,159824,27752,SAR
5,,SING,CA,HA2,no,N,5,,159824,27752,SAR
6,,SING,CA,HA3,no,N,6,,159824,27752,SAR
7,,DOUB,C,O,no,N,7,,159824,27752,SAR
8,,SING,C,OXT,no,N,8,,159824,27752,SAR
9,,SING,CN,HN1,no,N,9,,159824,27752,SAR
10,,SING,CN,HN2,no,N,10,,159824,27752,SAR
11,,SING,CN,HN3,no,N,11,,159824,27752,SAR
12,,SING,OXT,HXT,no,N,12,,159824,27752,SAR
1,,SING,N,CN,no,N,1,,159825,27752,MLE
2,,SING,N,CA,no,N,2,,159825,27752,MLE
3,,SING,N,H,no,N,3,,159825,27752,MLE
4,,SING,CN,HN1,no,N,4,,159825,27752,MLE
5,,SING,CN,HN2,no,N,5,,159825,27752,MLE
6,,SING,CN,HN3,no,N,6,,159825,27752,MLE
7,,SING,CA,CB,no,N,7,,159825,27752,MLE
8,,SING,CA,C,no,N,8,,159825,27752,MLE
9,,SING,CA,HA,no,N,9,,159825,27752,MLE
10,,SING,CB,CG,no,N,10,,159825,27752,MLE
11,,SING,CB,HB2,no,N,11,,159825,27752,MLE
12,,SING,CB,HB3,no,N,12,,159825,27752,MLE
13,,SING,CG,CD1,no,N,13,,159825,27752,MLE
14,,SING,CG,CD2,no,N,14,,159825,27752,MLE
15,,SING,CG,HG,no,N,15,,159825,27752,MLE
16,,SING,CD1,HD11,no,N,16,,159825,27752,MLE
17,,SING,CD1,HD12,no,N,17,,159825,27752,MLE
18,,SING,CD1,HD13,no,N,18,,159825,27752,MLE
19,,SING,CD2,HD21,no,N,19,,159825,27752,MLE
20,,SING,CD2,HD22,no,N,20,,159825,27752,MLE
21,,SING,CD2,HD23,no,N,21,,159825,27752,MLE
22,,DOUB,C,O,no,N,22,,159825,27752,MLE
23,,SING,C,OXT,no,N,23,,159825,27752,MLE
24,,SING,OXT,HXT,no,N,24,,159825,27752,MLE
1,,SING,N,CN,no,N,1,,159826,27752,MVA
2,,SING,N,CA,no,N,2,,159826,27752,MVA
3,,SING,N,H,no,N,3,,159826,27752,MVA
4,,SING,CN,HN1,no,N,4,,159826,27752,MVA
5,,SING,CN,HN2,no,N,5,,159826,27752,MVA
6,,SING,CN,HN3,no,N,6,,159826,27752,MVA
7,,SING,CA,CB,no,N,7,,159826,27752,MVA
8,,SING,CA,C,no,N,8,,159826,27752,MVA
9,,SING,CA,HA,no,N,9,,159826,27752,MVA
10,,SING,CB,CG1,no,N,10,,159826,27752,MVA
11,,SING,CB,CG2,no,N,11,,159826,27752,MVA
12,,SING,CB,HB,no,N,12,,159826,27752,MVA
13,,SING,CG1,HG11,no,N,13,,159826,27752,MVA
14,,SING,CG1,HG12,no,N,14,,159826,27752,MVA
15,,SING,CG1,HG13,no,N,15,,159826,27752,MVA
16,,SING,CG2,HG21,no,N,16,,159826,27752,MVA
17,,SING,CG2,HG22,no,N,17,,159826,27752,MVA
18,,SING,CG2,HG23,no,N,18,,159826,27752,MVA
19,,DOUB,C,O,no,N,19,,159826,27752,MVA
20,,SING,C,OXT,no,N,20,,159826,27752,MVA
21,,SING,OXT,HXT,no,N,21,,159826,27752,MVA
1,,SING,N,HN1,no,N,1,,159889,27756,NH2
2,,SING,N,HN2,no,N,2,,159889,27756,NH2
1,,SING,N,CA,no,N,1,,159990,27764,SEP
2,,SING,N,H,no,N,2,,159990,27764,SEP
3,,SING,N,H2,no,N,3,,159990,27764,SEP
4,,SING,CA,CB,no,N,4,,159990,27764,SEP
5,,SING,CA,C,no,N,5,,159990,27764,SEP
6,,SING,CA,HA,no,N,6,,159990,27764,SEP
7,,SING,CB,OG,no,N,7,,159990,27764,SEP
8,,SING,CB,HB2,no,N,8,,159990,27764,SEP
9,,SING,CB,HB3,no,N,9,,159990,27764,SEP
10,,SING,OG,P,no,N,10,,159990,27764,SEP
11,,DOUB,C,O,no,N,11,,159990,27764,SEP
12,,SING,C,OXT,no,N,12,,159990,27764,SEP
13,,SING,OXT,HXT,no,N,13,,159990,27764,SEP
14,,DOUB,P,O1P,no,N,14,,159990,27764,SEP
15,,SING,P,O2P,no,N,15,,159990,27764,SEP
16,,SING,P,O3P,no,N,16,,159990,27764,SEP
17,,SING,O2P,HOP2,no,N,17,,159990,27764,SEP
18,,SING,O3P,HOP3,no,N,18,,159990,27764,SEP
1,,SING,N,CN,no,N,1,,160196,27779,BMT
2,,SING,N,CA,no,N,2,,160196,27779,BMT
3,,SING,N,H,no,N,3,,160196,27779,BMT
4,,SING,CN,HN1,no,N,4,,160196,27779,BMT
5,,SING,CN,HN2,no,N,5,,160196,27779,BMT
6,,SING,CN,HN3,no,N,6,,160196,27779,BMT
7,,SING,CA,C,no,N,7,,160196,27779,BMT
8,,SING,CA,CB,no,N,8,,160196,27779,BMT
9,,SING,CA,HA,no,N,9,,160196,27779,BMT
10,,DOUB,C,O,no,N,10,,160196,27779,BMT
11,,SING,C,OXT,no,N,11,,160196,27779,BMT
12,,SING,OXT,HXT,no,N,12,,160196,27779,BMT
13,,SING,CB,OG1,no,N,13,,160196,27779,BMT
14,,SING,CB,CG2,no,N,14,,160196,27779,BMT
15,,SING,CB,HB,no,N,15,,160196,27779,BMT
16,,SING,OG1,HG1,no,N,16,,160196,27779,BMT
17,,SING,CG2,CD1,no,N,17,,160196,27779,BMT
18,,SING,CG2,CD2,no,N,18,,160196,27779,BMT
19,,SING,CG2,HG2,no,N,19,,160196,27779,BMT
20,,SING,CD1,HD11,no,N,20,,160196,27779,BMT
21,,SING,CD1,HD12,no,N,21,,160196,27779,BMT
22,,SING,CD1,HD13,no,N,22,,160196,27779,BMT
23,,SING,CD2,CE,no,N,23,,160196,27779,BMT
24,,SING,CD2,HD22,no,N,24,,160196,27779,BMT
25,,SING,CD2,HD23,no,N,25,,160196,27779,BMT
26,,DOUB,CE,CZ,no,E,26,,160196,27779,BMT
27,,SING,CE,HE,no,N,27,,160196,27779,BMT
28,,SING,CZ,CH,no,N,28,,160196,27779,BMT
29,,SING,CZ,HZ,no,N,29,,160196,27779,BMT
30,,SING,CH,HH1,no,N,30,,160196,27779,BMT
31,,SING,CH,HH2,no,N,31,,160196,27779,BMT
32,,SING,CH,HH3,no,N,32,,160196,27779,BMT
1,,SING,N,CA,no,N,1,,160197,27779,DAL
2,,SING,N,H,no,N,2,,160197,27779,DAL
3,,SING,N,H2,no,N,3,,160197,27779,DAL
4,,SING,CA,CB,no,N,4,,160197,27779,DAL
5,,SING,CA,C,no,N,5,,160197,27779,DAL
6,,SING,CA,HA,no,N,6,,160197,27779,DAL
7,,SING,CB,HB1,no,N,7,,160197,27779,DAL
8,,SING,CB,HB2,no,N,8,,160197,27779,DAL
9,,SING,CB,HB3,no,N,9,,160197,27779,DAL
10,,DOUB,C,O,no,N,10,,160197,27779,DAL
11,,SING,C,OXT,no,N,11,,160197,27779,DAL
12,,SING,OXT,HXT,no,N,12,,160197,27779,DAL
1,,SING,N,CA,no,N,1,,160198,27779,SAR
2,,SING,N,CN,no,N,2,,160198,27779,SAR
3,,SING,N,H,no,N,3,,160198,27779,SAR
4,,SING,CA,C,no,N,4,,160198,27779,SAR
5,,SING,CA,HA2,no,N,5,,160198,27779,SAR
6,,SING,CA,HA3,no,N,6,,160198,27779,SAR
7,,DOUB,C,O,no,N,7,,160198,27779,SAR
8,,SING,C,OXT,no,N,8,,160198,27779,SAR
9,,SING,CN,HN1,no,N,9,,160198,27779,SAR
10,,SING,CN,HN2,no,N,10,,160198,27779,SAR
11,,SING,CN,HN3,no,N,11,,160198,27779,SAR
12,,SING,OXT,HXT,no,N,12,,160198,27779,SAR
1,,SING,N,CN,no,N,1,,160199,27779,MLE
2,,SING,N,CA,no,N,2,,160199,27779,MLE
3,,SING,N,H,no,N,3,,160199,27779,MLE
4,,SING,CN,HN1,no,N,4,,160199,27779,MLE
5,,SING,CN,HN2,no,N,5,,160199,27779,MLE
6,,SING,CN,HN3,no,N,6,,160199,27779,MLE
7,,SING,CA,CB,no,N,7,,160199,27779,MLE
8,,SING,CA,C,no,N,8,,160199,27779,MLE
9,,SING,CA,HA,no,N,9,,160199,27779,MLE
10,,SING,CB,CG,no,N,10,,160199,27779,MLE
11,,SING,CB,HB2,no,N,11,,160199,27779,MLE
12,,SING,CB,HB3,no,N,12,,160199,27779,MLE
13,,SING,CG,CD1,no,N,13,,160199,27779,MLE
14,,SING,CG,CD2,no,N,14,,160199,27779,MLE
15,,SING,CG,HG,no,N,15,,160199,27779,MLE
16,,SING,CD1,HD11,no,N,16,,160199,27779,MLE
17,,SING,CD1,HD12,no,N,17,,160199,27779,MLE
18,,SING,CD1,HD13,no,N,18,,160199,27779,MLE
19,,SING,CD2,HD21,no,N,19,,160199,27779,MLE
20,,SING,CD2,HD22,no,N,20,,160199,27779,MLE
21,,SING,CD2,HD23,no,N,21,,160199,27779,MLE
22,,DOUB,C,O,no,N,22,,160199,27779,MLE
23,,SING,C,OXT,no,N,23,,160199,27779,MLE
24,,SING,OXT,HXT,no,N,24,,160199,27779,MLE
1,,SING,N,CN,no,N,1,,160200,27779,MVA
2,,SING,N,CA,no,N,2,,160200,27779,MVA
3,,SING,N,H,no,N,3,,160200,27779,MVA
4,,SING,CN,HN1,no,N,4,,160200,27779,MVA
5,,SING,CN,HN2,no,N,5,,160200,27779,MVA
6,,SING,CN,HN3,no,N,6,,160200,27779,MVA
7,,SING,CA,CB,no,N,7,,160200,27779,MVA
8,,SING,CA,C,no,N,8,,160200,27779,MVA
9,,SING,CA,HA,no,N,9,,160200,27779,MVA
10,,SING,CB,CG1,no,N,10,,160200,27779,MVA
11,,SING,CB,CG2,no,N,11,,160200,27779,MVA
12,,SING,CB,HB,no,N,12,,160200,27779,MVA
13,,SING,CG1,HG11,no,N,13,,160200,27779,MVA
14,,SING,CG1,HG12,no,N,14,,160200,27779,MVA
15,,SING,CG1,HG13,no,N,15,,160200,27779,MVA
16,,SING,CG2,HG21,no,N,16,,160200,27779,MVA
17,,SING,CG2,HG22,no,N,17,,160200,27779,MVA
18,,SING,CG2,HG23,no,N,18,,160200,27779,MVA
19,,DOUB,C,O,no,N,19,,160200,27779,MVA
20,,SING,C,OXT,no,N,20,,160200,27779,MVA
21,,SING,OXT,HXT,no,N,21,,160200,27779,MVA
1,,DOUB,PG,O1G,no,N,1,,160472,27794,GTP
2,,SING,PG,O2G,no,N,2,,160472,27794,GTP
3,,SING,PG,O3G,no,N,3,,160472,27794,GTP
4,,SING,PG,O3B,no,N,4,,160472,27794,GTP
5,,SING,O2G,HOG2,no,N,5,,160472,27794,GTP
6,,SING,O3G,HOG3,no,N,6,,160472,27794,GTP
7,,SING,O3B,PB,no,N,7,,160472,27794,GTP
8,,DOUB,PB,O1B,no,N,8,,160472,27794,GTP
9,,SING,PB,O2B,no,N,9,,160472,27794,GTP
10,,SING,PB,O3A,no,N,10,,160472,27794,GTP
11,,SING,O2B,HOB2,no,N,11,,160472,27794,GTP
12,,SING,O3A,PA,no,N,12,,160472,27794,GTP
13,,DOUB,PA,O1A,no,N,13,,160472,27794,GTP
14,,SING,PA,O2A,no,N,14,,160472,27794,GTP
15,,SING,PA,O5',no,N,15,,160472,27794,GTP
16,,SING,O2A,HOA2,no,N,16,,160472,27794,GTP
17,,SING,O5',C5',no,N,17,,160472,27794,GTP
18,,SING,C5',C4',no,N,18,,160472,27794,GTP
19,,SING,C5',H5',no,N,19,,160472,27794,GTP
20,,SING,C5',H5'',no,N,20,,160472,27794,GTP
21,,SING,C4',O4',no,N,21,,160472,27794,GTP
22,,SING,C4',C3',no,N,22,,160472,27794,GTP
23,,SING,C4',H4',no,N,23,,160472,27794,GTP
24,,SING,O4',C1',no,N,24,,160472,27794,GTP
25,,SING,C3',O3',no,N,25,,160472,27794,GTP
26,,SING,C3',C2',no,N,26,,160472,27794,GTP
27,,SING,C3',H3',no,N,27,,160472,27794,GTP
28,,SING,O3',HO3',no,N,28,,160472,27794,GTP
29,,SING,C2',O2',no,N,29,,160472,27794,GTP
30,,SING,C2',C1',no,N,30,,160472,27794,GTP
31,,SING,C2',H2',no,N,31,,160472,27794,GTP
32,,SING,O2',HO2',no,N,32,,160472,27794,GTP
33,,SING,C1',N9,no,N,33,,160472,27794,GTP
34,,SING,C1',H1',no,N,34,,160472,27794,GTP
35,,SING,N9,C8,yes,N,35,,160472,27794,GTP
36,,SING,N9,C4,yes,N,36,,160472,27794,GTP
37,,DOUB,C8,N7,yes,N,37,,160472,27794,GTP
38,,SING,C8,H8,no,N,38,,160472,27794,GTP
39,,SING,N7,C5,yes,N,39,,160472,27794,GTP
40,,SING,C5,C6,no,N,40,,160472,27794,GTP
41,,DOUB,C5,C4,yes,N,41,,160472,27794,GTP
42,,DOUB,C6,O6,no,N,42,,160472,27794,GTP
43,,SING,C6,N1,no,N,43,,160472,27794,GTP
44,,SING,N1,C2,no,N,44,,160472,27794,GTP
45,,SING,N1,HN1,no,N,45,,160472,27794,GTP
46,,SING,C2,N2,no,N,46,,160472,27794,GTP
47,,DOUB,C2,N3,no,N,47,,160472,27794,GTP
48,,SING,N2,HN21,no,N,48,,160472,27794,GTP
49,,SING,N2,HN22,no,N,49,,160472,27794,GTP
50,,SING,N3,C4,no,N,50,,160472,27794,GTP
1,,SING,N,CA,no,N,1,,160532,27797,RF9
2,,SING,CA,CB,no,N,2,,160532,27797,RF9
3,,SING,CA,C,no,N,3,,160532,27797,RF9
4,,DOUB,O1,C,no,N,4,,160532,27797,RF9
5,,SING,CB,CG,no,N,5,,160532,27797,RF9
6,,SING,CG,CD,no,N,6,,160532,27797,RF9
7,,SING,CD,CE,no,N,7,,160532,27797,RF9
8,,SING,CE,NZ,no,N,8,,160532,27797,RF9
9,,SING,NZ,CX1,no,N,9,,160532,27797,RF9
10,,DOUB,O3,CX2,no,N,10,,160532,27797,RF9
11,,SING,CX1,CX2,no,N,11,,160532,27797,RF9
12,,SING,CX1,C1,no,N,12,,160532,27797,RF9
13,,SING,CX2,O2,no,N,13,,160532,27797,RF9
14,,SING,C,OXT,no,N,14,,160532,27797,RF9
15,,SING,N,H1,no,N,15,,160532,27797,RF9
16,,SING,N,H2,no,N,16,,160532,27797,RF9
17,,SING,CA,H4,no,N,17,,160532,27797,RF9
18,,SING,CB,H5,no,N,18,,160532,27797,RF9
19,,SING,CB,H6,no,N,19,,160532,27797,RF9
20,,SING,CG,H7,no,N,20,,160532,27797,RF9
21,,SING,CG,H8,no,N,21,,160532,27797,RF9
22,,SING,CD,H9,no,N,22,,160532,27797,RF9
23,,SING,CD,H10,no,N,23,,160532,27797,RF9
24,,SING,CE,H11,no,N,24,,160532,27797,RF9
25,,SING,CE,H12,no,N,25,,160532,27797,RF9
26,,SING,NZ,H13,no,N,26,,160532,27797,RF9
27,,SING,C1,H15,no,N,27,,160532,27797,RF9
28,,SING,C1,H16,no,N,28,,160532,27797,RF9
29,,SING,C1,H17,no,N,29,,160532,27797,RF9
30,,SING,CX1,H18,no,N,30,,160532,27797,RF9
31,,SING,O2,H19,no,N,31,,160532,27797,RF9
32,,SING,OXT,HXT,no,N,32,,160532,27797,RF9
1,,SING,N,CN,no,N,1,,160578,27800,BMT
2,,SING,N,CA,no,N,2,,160578,27800,BMT
3,,SING,N,H,no,N,3,,160578,27800,BMT
4,,SING,CN,HN1,no,N,4,,160578,27800,BMT
5,,SING,CN,HN2,no,N,5,,160578,27800,BMT
6,,SING,CN,HN3,no,N,6,,160578,27800,BMT
7,,SING,CA,C,no,N,7,,160578,27800,BMT
8,,SING,CA,CB,no,N,8,,160578,27800,BMT
9,,SING,CA,HA,no,N,9,,160578,27800,BMT
10,,DOUB,C,O,no,N,10,,160578,27800,BMT
11,,SING,C,OXT,no,N,11,,160578,27800,BMT
12,,SING,OXT,HXT,no,N,12,,160578,27800,BMT
13,,SING,CB,OG1,no,N,13,,160578,27800,BMT
14,,SING,CB,CG2,no,N,14,,160578,27800,BMT
15,,SING,CB,HB,no,N,15,,160578,27800,BMT
16,,SING,OG1,HG1,no,N,16,,160578,27800,BMT
17,,SING,CG2,CD1,no,N,17,,160578,27800,BMT
18,,SING,CG2,CD2,no,N,18,,160578,27800,BMT
19,,SING,CG2,HG2,no,N,19,,160578,27800,BMT
20,,SING,CD1,HD11,no,N,20,,160578,27800,BMT
21,,SING,CD1,HD12,no,N,21,,160578,27800,BMT
22,,SING,CD1,HD13,no,N,22,,160578,27800,BMT
23,,SING,CD2,CE,no,N,23,,160578,27800,BMT
24,,SING,CD2,HD22,no,N,24,,160578,27800,BMT
25,,SING,CD2,HD23,no,N,25,,160578,27800,BMT
26,,DOUB,CE,CZ,no,E,26,,160578,27800,BMT
27,,SING,CE,HE,no,N,27,,160578,27800,BMT
28,,SING,CZ,CH,no,N,28,,160578,27800,BMT
29,,SING,CZ,HZ,no,N,29,,160578,27800,BMT
30,,SING,CH,HH1,no,N,30,,160578,27800,BMT
31,,SING,CH,HH2,no,N,31,,160578,27800,BMT
32,,SING,CH,HH3,no,N,32,,160578,27800,BMT
1,,SING,N,CA,no,N,1,,160579,27800,DAL
2,,SING,N,H,no,N,2,,160579,27800,DAL
3,,SING,N,H2,no,N,3,,160579,27800,DAL
4,,SING,CA,CB,no,N,4,,160579,27800,DAL
5,,SING,CA,C,no,N,5,,160579,27800,DAL
6,,SING,CA,HA,no,N,6,,160579,27800,DAL
7,,SING,CB,HB1,no,N,7,,160579,27800,DAL
8,,SING,CB,HB2,no,N,8,,160579,27800,DAL
9,,SING,CB,HB3,no,N,9,,160579,27800,DAL
10,,DOUB,C,O,no,N,10,,160579,27800,DAL
11,,SING,C,OXT,no,N,11,,160579,27800,DAL
12,,SING,OXT,HXT,no,N,12,,160579,27800,DAL
1,,SING,N,CA,no,N,1,,160580,27800,SAR
2,,SING,N,CN,no,N,2,,160580,27800,SAR
3,,SING,N,H,no,N,3,,160580,27800,SAR
4,,SING,CA,C,no,N,4,,160580,27800,SAR
5,,SING,CA,HA2,no,N,5,,160580,27800,SAR
6,,SING,CA,HA3,no,N,6,,160580,27800,SAR
7,,DOUB,C,O,no,N,7,,160580,27800,SAR
8,,SING,C,OXT,no,N,8,,160580,27800,SAR
9,,SING,CN,HN1,no,N,9,,160580,27800,SAR
10,,SING,CN,HN2,no,N,10,,160580,27800,SAR
11,,SING,CN,HN3,no,N,11,,160580,27800,SAR
12,,SING,OXT,HXT,no,N,12,,160580,27800,SAR
1,,SING,N,CN,no,N,1,,160581,27800,MLE
2,,SING,N,CA,no,N,2,,160581,27800,MLE
3,,SING,N,H,no,N,3,,160581,27800,MLE
4,,SING,CN,HN1,no,N,4,,160581,27800,MLE
5,,SING,CN,HN2,no,N,5,,160581,27800,MLE
6,,SING,CN,HN3,no,N,6,,160581,27800,MLE
7,,SING,CA,CB,no,N,7,,160581,27800,MLE
8,,SING,CA,C,no,N,8,,160581,27800,MLE
9,,SING,CA,HA,no,N,9,,160581,27800,MLE
10,,SING,CB,CG,no,N,10,,160581,27800,MLE
11,,SING,CB,HB2,no,N,11,,160581,27800,MLE
12,,SING,CB,HB3,no,N,12,,160581,27800,MLE
13,,SING,CG,CD1,no,N,13,,160581,27800,MLE
14,,SING,CG,CD2,no,N,14,,160581,27800,MLE
15,,SING,CG,HG,no,N,15,,160581,27800,MLE
16,,SING,CD1,HD11,no,N,16,,160581,27800,MLE
17,,SING,CD1,HD12,no,N,17,,160581,27800,MLE
18,,SING,CD1,HD13,no,N,18,,160581,27800,MLE
19,,SING,CD2,HD21,no,N,19,,160581,27800,MLE
20,,SING,CD2,HD22,no,N,20,,160581,27800,MLE
21,,SING,CD2,HD23,no,N,21,,160581,27800,MLE
22,,DOUB,C,O,no,N,22,,160581,27800,MLE
23,,SING,C,OXT,no,N,23,,160581,27800,MLE
24,,SING,OXT,HXT,no,N,24,,160581,27800,MLE
1,,SING,N,CN,no,N,1,,160582,27800,MVA
2,,SING,N,CA,no,N,2,,160582,27800,MVA
3,,SING,N,H,no,N,3,,160582,27800,MVA
4,,SING,CN,HN1,no,N,4,,160582,27800,MVA
5,,SING,CN,HN2,no,N,5,,160582,27800,MVA
6,,SING,CN,HN3,no,N,6,,160582,27800,MVA
7,,SING,CA,CB,no,N,7,,160582,27800,MVA
8,,SING,CA,C,no,N,8,,160582,27800,MVA
9,,SING,CA,HA,no,N,9,,160582,27800,MVA
10,,SING,CB,CG1,no,N,10,,160582,27800,MVA
11,,SING,CB,CG2,no,N,11,,160582,27800,MVA
12,,SING,CB,HB,no,N,12,,160582,27800,MVA
13,,SING,CG1,HG11,no,N,13,,160582,27800,MVA
14,,SING,CG1,HG12,no,N,14,,160582,27800,MVA
15,,SING,CG1,HG13,no,N,15,,160582,27800,MVA
16,,SING,CG2,HG21,no,N,16,,160582,27800,MVA
17,,SING,CG2,HG22,no,N,17,,160582,27800,MVA
18,,SING,CG2,HG23,no,N,18,,160582,27800,MVA
19,,DOUB,C,O,no,N,19,,160582,27800,MVA
20,,SING,C,OXT,no,N,20,,160582,27800,MVA
21,,SING,OXT,HXT,no,N,21,,160582,27800,MVA
1,,SING,N,CA,no,N,1,,160757,27812,SEP
2,,SING,N,H,no,N,2,,160757,27812,SEP
3,,SING,N,H2,no,N,3,,160757,27812,SEP
4,,SING,CA,CB,no,N,4,,160757,27812,SEP
5,,SING,CA,C,no,N,5,,160757,27812,SEP
6,,SING,CA,HA,no,N,6,,160757,27812,SEP
7,,SING,CB,OG,no,N,7,,160757,27812,SEP
8,,SING,CB,HB2,no,N,8,,160757,27812,SEP
9,,SING,CB,HB3,no,N,9,,160757,27812,SEP
10,,SING,OG,P,no,N,10,,160757,27812,SEP
11,,DOUB,C,O,no,N,11,,160757,27812,SEP
12,,SING,C,OXT,no,N,12,,160757,27812,SEP
13,,SING,OXT,HXT,no,N,13,,160757,27812,SEP
14,,DOUB,P,O1P,no,N,14,,160757,27812,SEP
15,,SING,P,O2P,no,N,15,,160757,27812,SEP
16,,SING,P,O3P,no,N,16,,160757,27812,SEP
17,,SING,O2P,HOP2,no,N,17,,160757,27812,SEP
18,,SING,O3P,HOP3,no,N,18,,160757,27812,SEP
1,,SING,N,CA,no,N,1,,160758,27812,TPO
2,,SING,N,H,no,N,2,,160758,27812,TPO
3,,SING,N,H2,no,N,3,,160758,27812,TPO
4,,SING,CA,CB,no,N,4,,160758,27812,TPO
5,,SING,CA,C,no,N,5,,160758,27812,TPO
6,,SING,CA,HA,no,N,6,,160758,27812,TPO
7,,SING,CB,CG2,no,N,7,,160758,27812,TPO
8,,SING,CB,OG1,no,N,8,,160758,27812,TPO
9,,SING,CB,HB,no,N,9,,160758,27812,TPO
10,,SING,CG2,HG21,no,N,10,,160758,27812,TPO
11,,SING,CG2,HG22,no,N,11,,160758,27812,TPO
12,,SING,CG2,HG23,no,N,12,,160758,27812,TPO
13,,SING,OG1,P,no,N,13,,160758,27812,TPO
14,,DOUB,P,O1P,no,N,14,,160758,27812,TPO
15,,SING,P,O2P,no,N,15,,160758,27812,TPO
16,,SING,P,O3P,no,N,16,,160758,27812,TPO
17,,SING,O2P,HOP2,no,N,17,,160758,27812,TPO
18,,SING,O3P,HOP3,no,N,18,,160758,27812,TPO
19,,DOUB,C,O,no,N,19,,160758,27812,TPO
20,,SING,C,OXT,no,N,20,,160758,27812,TPO
21,,SING,OXT,HXT,no,N,21,,160758,27812,TPO
1,,SING,C12,C11,yes,N,1,,160940,27826,Y55
2,,DOUB,C12,C13,yes,N,2,,160940,27826,Y55
3,,DOUB,C11,C10,yes,N,3,,160940,27826,Y55
4,,SING,C13,O4,yes,N,4,,160940,27826,Y55
5,,SING,C10,O4,yes,N,5,,160940,27826,Y55
6,,SING,C10,C7,no,N,6,,160940,27826,Y55
7,,DOUB,C8,C7,yes,N,7,,160940,27826,Y55
8,,SING,C8,C9,yes,N,8,,160940,27826,Y55
9,,SING,C7,C6,yes,N,9,,160940,27826,Y55
10,,DOUB,C9,C3,yes,N,10,,160940,27826,Y55
11,,DOUB,C6,C2,yes,N,11,,160940,27826,Y55
12,,SING,C3,C2,yes,N,12,,160940,27826,Y55
13,,SING,C3,C4,no,N,13,,160940,27826,Y55
14,,SING,C2,C1,no,N,14,,160940,27826,Y55
15,,SING,C4,C5,no,N,15,,160940,27826,Y55
16,,DOUB,C1,O1,no,N,16,,160940,27826,Y55
17,,SING,C1,N,no,N,17,,160940,27826,Y55
18,,SING,C5,N,no,N,18,,160940,27826,Y55
19,,DOUB,C5,O2,no,N,19,,160940,27826,Y55
20,,SING,N,O3,no,N,20,,160940,27826,Y55
21,,SING,C11,H1,no,N,21,,160940,27826,Y55
22,,SING,C12,H2,no,N,22,,160940,27826,Y55
23,,SING,C13,H3,no,N,23,,160940,27826,Y55
24,,SING,C4,H4,no,N,24,,160940,27826,Y55
25,,SING,C4,H5,no,N,25,,160940,27826,Y55
26,,SING,C6,H6,no,N,26,,160940,27826,Y55
27,,SING,C8,H7,no,N,27,,160940,27826,Y55
28,,SING,C9,H8,no,N,28,,160940,27826,Y55
29,,SING,O3,H9,no,N,29,,160940,27826,Y55
1,,SING,N,CA,no,N,1,,161007,27830,TRP
2,,SING,N,H,no,N,2,,161007,27830,TRP
3,,SING,N,H2,no,N,3,,161007,27830,TRP
4,,SING,CA,C,no,N,4,,161007,27830,TRP
5,,SING,CA,CB,no,N,5,,161007,27830,TRP
6,,SING,CA,HA,no,N,6,,161007,27830,TRP
7,,DOUB,C,O,no,N,7,,161007,27830,TRP
8,,SING,C,OXT,no,N,8,,161007,27830,TRP
9,,SING,CB,CG,no,N,9,,161007,27830,TRP
10,,SING,CB,HB2,no,N,10,,161007,27830,TRP
11,,SING,CB,HB3,no,N,11,,161007,27830,TRP
12,,DOUB,CG,CD1,yes,N,12,,161007,27830,TRP
13,,SING,CG,CD2,yes,N,13,,161007,27830,TRP
14,,SING,CD1,NE1,yes,N,14,,161007,27830,TRP
15,,SING,CD1,HD1,no,N,15,,161007,27830,TRP
16,,DOUB,CD2,CE2,yes,N,16,,161007,27830,TRP
17,,SING,CD2,CE3,yes,N,17,,161007,27830,TRP
18,,SING,NE1,CE2,yes,N,18,,161007,27830,TRP
19,,SING,NE1,HE1,no,N,19,,161007,27830,TRP
20,,SING,CE2,CZ2,yes,N,20,,161007,27830,TRP
21,,DOUB,CE3,CZ3,yes,N,21,,161007,27830,TRP
22,,SING,CE3,HE3,no,N,22,,161007,27830,TRP
23,,DOUB,CZ2,CH2,yes,N,23,,161007,27830,TRP
24,,SING,CZ2,HZ2,no,N,24,,161007,27830,TRP
25,,SING,CZ3,CH2,yes,N,25,,161007,27830,TRP
26,,SING,CZ3,HZ3,no,N,26,,161007,27830,TRP
27,,SING,CH2,HH2,no,N,27,,161007,27830,TRP
28,,SING,OXT,HXT,no,N,28,,161007,27830,TRP
1,,SING,N,CA,no,N,1,,161162,27840,GLU
2,,SING,N,H,no,N,2,,161162,27840,GLU
3,,SING,N,H2,no,N,3,,161162,27840,GLU
4,,SING,CA,C,no,N,4,,161162,27840,GLU
5,,SING,CA,CB,no,N,5,,161162,27840,GLU
6,,SING,CA,HA,no,N,6,,161162,27840,GLU
7,,DOUB,C,O,no,N,7,,161162,27840,GLU
8,,SING,C,OXT,no,N,8,,161162,27840,GLU
9,,SING,CB,CG,no,N,9,,161162,27840,GLU
10,,SING,CB,HB2,no,N,10,,161162,27840,GLU
11,,SING,CB,HB3,no,N,11,,161162,27840,GLU
12,,SING,CG,CD,no,N,12,,161162,27840,GLU
13,,SING,CG,HG2,no,N,13,,161162,27840,GLU
14,,SING,CG,HG3,no,N,14,,161162,27840,GLU
15,,DOUB,CD,OE1,no,N,15,,161162,27840,GLU
16,,SING,CD,OE2,no,N,16,,161162,27840,GLU
17,,SING,OE2,HE2,no,N,17,,161162,27840,GLU
18,,SING,OXT,HXT,no,N,18,,161162,27840,GLU
1,,SING,N,CA,no,N,1,,161180,27841,GLU
2,,SING,N,H,no,N,2,,161180,27841,GLU
3,,SING,N,H2,no,N,3,,161180,27841,GLU
4,,SING,CA,C,no,N,4,,161180,27841,GLU
5,,SING,CA,CB,no,N,5,,161180,27841,GLU
6,,SING,CA,HA,no,N,6,,161180,27841,GLU
7,,DOUB,C,O,no,N,7,,161180,27841,GLU
8,,SING,C,OXT,no,N,8,,161180,27841,GLU
9,,SING,CB,CG,no,N,9,,161180,27841,GLU
10,,SING,CB,HB2,no,N,10,,161180,27841,GLU
11,,SING,CB,HB3,no,N,11,,161180,27841,GLU
12,,SING,CG,CD,no,N,12,,161180,27841,GLU
13,,SING,CG,HG2,no,N,13,,161180,27841,GLU
14,,SING,CG,HG3,no,N,14,,161180,27841,GLU
15,,DOUB,CD,OE1,no,N,15,,161180,27841,GLU
16,,SING,CD,OE2,no,N,16,,161180,27841,GLU
17,,SING,OE2,HE2,no,N,17,,161180,27841,GLU
18,,SING,OXT,HXT,no,N,18,,161180,27841,GLU
1,,SING,N,CA,no,N,1,,161198,27842,GLU
2,,SING,N,H,no,N,2,,161198,27842,GLU
3,,SING,N,H2,no,N,3,,161198,27842,GLU
4,,SING,CA,C,no,N,4,,161198,27842,GLU
5,,SING,CA,CB,no,N,5,,161198,27842,GLU
6,,SING,CA,HA,no,N,6,,161198,27842,GLU
7,,DOUB,C,O,no,N,7,,161198,27842,GLU
8,,SING,C,OXT,no,N,8,,161198,27842,GLU
9,,SING,CB,CG,no,N,9,,161198,27842,GLU
10,,SING,CB,HB2,no,N,10,,161198,27842,GLU
11,,SING,CB,HB3,no,N,11,,161198,27842,GLU
12,,SING,CG,CD,no,N,12,,161198,27842,GLU
13,,SING,CG,HG2,no,N,13,,161198,27842,GLU
14,,SING,CG,HG3,no,N,14,,161198,27842,GLU
15,,DOUB,CD,OE1,no,N,15,,161198,27842,GLU
16,,SING,CD,OE2,no,N,16,,161198,27842,GLU
17,,SING,OE2,HE2,no,N,17,,161198,27842,GLU
18,,SING,OXT,HXT,no,N,18,,161198,27842,GLU
1,,SING,N,CD,no,N,1,,161218,27843,KAI
2,,SING,N,CA,no,N,2,,161218,27843,KAI
3,,SING,N,HN1,no,N,3,,161218,27843,KAI
4,,SING,CD,CG,no,N,4,,161218,27843,KAI
5,,SING,CD,HD1,no,N,5,,161218,27843,KAI
6,,SING,CD,HD2,no,N,6,,161218,27843,KAI
7,,DOUB,CD1,CG2,no,N,7,,161218,27843,KAI
8,,SING,CD1,HD11,no,N,8,,161218,27843,KAI
9,,SING,CD1,HD12,no,N,9,,161218,27843,KAI
10,,SING,CD2,CG2,no,N,10,,161218,27843,KAI
11,,SING,CD2,HD21,no,N,11,,161218,27843,KAI
12,,SING,CD2,HD22,no,N,12,,161218,27843,KAI
13,,SING,CD2,HD23,no,N,13,,161218,27843,KAI
14,,SING,CA,CB,no,N,14,,161218,27843,KAI
15,,SING,CA,C,no,N,15,,161218,27843,KAI
16,,SING,CA,HA,no,N,16,,161218,27843,KAI
17,,SING,CB,CB1,no,N,17,,161218,27843,KAI
18,,SING,CB,CG,no,N,18,,161218,27843,KAI
19,,SING,CB,HB,no,N,19,,161218,27843,KAI
20,,SING,CB1,CG1,no,N,20,,161218,27843,KAI
21,,SING,CB1,HB11,no,N,21,,161218,27843,KAI
22,,SING,CB1,HB12,no,N,22,,161218,27843,KAI
23,,SING,CG,CG2,no,N,23,,161218,27843,KAI
24,,SING,CG,HG,no,N,24,,161218,27843,KAI
25,,SING,CG1,OD1,no,N,25,,161218,27843,KAI
26,,DOUB,CG1,OD2,no,N,26,,161218,27843,KAI
27,,DOUB,C,O,no,N,27,,161218,27843,KAI
28,,SING,C,OXT,no,N,28,,161218,27843,KAI
29,,SING,OD1,HOD1,no,N,29,,161218,27843,KAI
30,,SING,OXT,HXT,no,N,30,,161218,27843,KAI
1,,SING,P1,O2P,no,N,1,,161361,27853,C2E
2,,DOUB,O1P,P1,no,N,2,,161361,27853,C2E
3,,SING,O5',P1,no,N,3,,161361,27853,C2E
4,,SING,C5',O5',no,N,4,,161361,27853,C2E
5,,SING,C4',O4',no,N,5,,161361,27853,C2E
6,,SING,C4',C5',no,N,6,,161361,27853,C2E
7,,SING,C3',C4',no,N,7,,161361,27853,C2E
8,,SING,O3',P11,no,N,8,,161361,27853,C2E
9,,SING,O3',C3',no,N,9,,161361,27853,C2E
10,,SING,C2',C3',no,N,10,,161361,27853,C2E
11,,SING,C2',C1',no,N,11,,161361,27853,C2E
12,,SING,O2',C2',no,N,12,,161361,27853,C2E
13,,SING,C1',O4',no,N,13,,161361,27853,C2E
14,,SING,C1',N9,no,N,14,,161361,27853,C2E
15,,SING,N9,C4,yes,N,15,,161361,27853,C2E
16,,SING,N9,C8,yes,N,16,,161361,27853,C2E
17,,DOUB,C8,N7,yes,N,17,,161361,27853,C2E
18,,SING,C5,N7,yes,N,18,,161361,27853,C2E
19,,SING,C5,C6,no,N,19,,161361,27853,C2E
20,,DOUB,C6,O6,no,N,20,,161361,27853,C2E
21,,SING,N1,C6,no,N,21,,161361,27853,C2E
22,,SING,C2,N1,no,N,22,,161361,27853,C2E
23,,SING,N2,C2,no,N,23,,161361,27853,C2E
24,,DOUB,N3,C2,no,N,24,,161361,27853,C2E
25,,SING,N3,C4,no,N,25,,161361,27853,C2E
26,,DOUB,C4,C5,yes,N,26,,161361,27853,C2E
27,,SING,P11,O21,no,N,27,,161361,27853,C2E
28,,SING,P11,O5A,no,N,28,,161361,27853,C2E
29,,DOUB,O11,P11,no,N,29,,161361,27853,C2E
30,,SING,C5A,O5A,no,N,30,,161361,27853,C2E
31,,SING,C5A,C4A,no,N,31,,161361,27853,C2E
32,,SING,C4A,O4A,no,N,32,,161361,27853,C2E
33,,SING,C4A,C3A,no,N,33,,161361,27853,C2E
34,,SING,O4A,C1A,no,N,34,,161361,27853,C2E
35,,SING,C3A,C2A,no,N,35,,161361,27853,C2E
36,,SING,O3A,C3A,no,N,36,,161361,27853,C2E
37,,SING,O3A,P1,no,N,37,,161361,27853,C2E
38,,SING,C2A,O2A,no,N,38,,161361,27853,C2E
39,,SING,C1A,C2A,no,N,39,,161361,27853,C2E
40,,SING,C1A,N91,no,N,40,,161361,27853,C2E
41,,SING,N91,C41,yes,N,41,,161361,27853,C2E
42,,DOUB,C81,N71,yes,N,42,,161361,27853,C2E
43,,SING,C81,N91,yes,N,43,,161361,27853,C2E
44,,SING,N71,C51,yes,N,44,,161361,27853,C2E
45,,DOUB,C51,C41,yes,N,45,,161361,27853,C2E
46,,SING,C51,C61,no,N,46,,161361,27853,C2E
47,,DOUB,C61,O61,no,N,47,,161361,27853,C2E
48,,SING,C61,N11,no,N,48,,161361,27853,C2E
49,,SING,C21,N11,no,N,49,,161361,27853,C2E
50,,SING,C21,N21,no,N,50,,161361,27853,C2E
51,,DOUB,N31,C21,no,N,51,,161361,27853,C2E
52,,SING,C41,N31,no,N,52,,161361,27853,C2E
53,,SING,O2P,HO2P,no,N,53,,161361,27853,C2E
54,,SING,C5',H5'1,no,N,54,,161361,27853,C2E
55,,SING,C5',H5'2,no,N,55,,161361,27853,C2E
56,,SING,C4',H4',no,N,56,,161361,27853,C2E
57,,SING,C3',H3',no,N,57,,161361,27853,C2E
58,,SING,C2',H2',no,N,58,,161361,27853,C2E
59,,SING,O2',HO2',no,N,59,,161361,27853,C2E
60,,SING,C1',H1',no,N,60,,161361,27853,C2E
61,,SING,C8,H8,no,N,61,,161361,27853,C2E
62,,SING,N1,HN1,no,N,62,,161361,27853,C2E
63,,SING,N2,HN21,no,N,63,,161361,27853,C2E
64,,SING,N2,HN22,no,N,64,,161361,27853,C2E
65,,SING,O21,HO21,no,N,65,,161361,27853,C2E
66,,SING,C5A,H511,no,N,66,,161361,27853,C2E
67,,SING,C5A,H512,no,N,67,,161361,27853,C2E
68,,SING,C4A,H4A,no,N,68,,161361,27853,C2E
69,,SING,C3A,H3A,no,N,69,,161361,27853,C2E
70,,SING,C2A,H2A,no,N,70,,161361,27853,C2E
71,,SING,O2A,HO2A,no,N,71,,161361,27853,C2E
72,,SING,C1A,H1A,no,N,72,,161361,27853,C2E
73,,SING,C81,H81,no,N,73,,161361,27853,C2E
74,,SING,N11,HN11,no,N,74,,161361,27853,C2E
75,,SING,N21,HN24,no,N,75,,161361,27853,C2E
76,,SING,N21,HN23,no,N,76,,161361,27853,C2E
1,,SING,CHA,C1A,no,N,1,,161601,27869,HEM
2,,DOUB,CHA,C4D,no,N,2,,161601,27869,HEM
3,,SING,CHA,HHA,no,N,3,,161601,27869,HEM
4,,SING,CHB,C4A,no,N,4,,161601,27869,HEM
5,,DOUB,CHB,C1B,no,N,5,,161601,27869,HEM
6,,SING,CHB,HHB,no,N,6,,161601,27869,HEM
7,,SING,CHC,C4B,no,N,7,,161601,27869,HEM
8,,DOUB,CHC,C1C,no,N,8,,161601,27869,HEM
9,,SING,CHC,HHC,no,N,9,,161601,27869,HEM
10,,DOUB,CHD,C4C,no,N,10,,161601,27869,HEM
11,,SING,CHD,C1D,no,N,11,,161601,27869,HEM
12,,SING,CHD,HHD,no,N,12,,161601,27869,HEM
13,,DOUB,C1A,C2A,yes,N,13,,161601,27869,HEM
14,,SING,C1A,NA,yes,N,14,,161601,27869,HEM
15,,SING,C2A,C3A,yes,N,15,,161601,27869,HEM
16,,SING,C2A,CAA,no,N,16,,161601,27869,HEM
17,,DOUB,C3A,C4A,yes,N,17,,161601,27869,HEM
18,,SING,C3A,CMA,no,N,18,,161601,27869,HEM
19,,SING,C4A,NA,yes,N,19,,161601,27869,HEM
20,,SING,CMA,HMA,no,N,20,,161601,27869,HEM
21,,SING,CMA,HMAA,no,N,21,,161601,27869,HEM
22,,SING,CMA,HMAB,no,N,22,,161601,27869,HEM
23,,SING,CAA,CBA,no,N,23,,161601,27869,HEM
24,,SING,CAA,HAA,no,N,24,,161601,27869,HEM
25,,SING,CAA,HAAA,no,N,25,,161601,27869,HEM
26,,SING,CBA,CGA,no,N,26,,161601,27869,HEM
27,,SING,CBA,HBA,no,N,27,,161601,27869,HEM
28,,SING,CBA,HBAA,no,N,28,,161601,27869,HEM
29,,DOUB,CGA,O1A,no,N,29,,161601,27869,HEM
30,,SING,CGA,O2A,no,N,30,,161601,27869,HEM
31,,SING,C1B,C2B,no,N,31,,161601,27869,HEM
32,,SING,C1B,NB,no,N,32,,161601,27869,HEM
33,,DOUB,C2B,C3B,no,N,33,,161601,27869,HEM
34,,SING,C2B,CMB,no,N,34,,161601,27869,HEM
35,,SING,C3B,C4B,no,N,35,,161601,27869,HEM
36,,SING,C3B,CAB,no,N,36,,161601,27869,HEM
37,,DOUB,C4B,NB,no,N,37,,161601,27869,HEM
38,,SING,CMB,HMB,no,N,38,,161601,27869,HEM
39,,SING,CMB,HMBA,no,N,39,,161601,27869,HEM
40,,SING,CMB,HMBB,no,N,40,,161601,27869,HEM
41,,DOUB,CAB,CBB,no,N,41,,161601,27869,HEM
42,,SING,CAB,HAB,no,N,42,,161601,27869,HEM
43,,SING,CBB,HBB,no,N,43,,161601,27869,HEM
44,,SING,CBB,HBBA,no,N,44,,161601,27869,HEM
45,,SING,C1C,C2C,yes,N,45,,161601,27869,HEM
46,,SING,C1C,NC,yes,N,46,,161601,27869,HEM
47,,DOUB,C2C,C3C,yes,N,47,,161601,27869,HEM
48,,SING,C2C,CMC,no,N,48,,161601,27869,HEM
49,,SING,C3C,C4C,yes,N,49,,161601,27869,HEM
50,,SING,C3C,CAC,no,N,50,,161601,27869,HEM
51,,SING,C4C,NC,yes,N,51,,161601,27869,HEM
52,,SING,CMC,HMC,no,N,52,,161601,27869,HEM
53,,SING,CMC,HMCA,no,N,53,,161601,27869,HEM
54,,SING,CMC,HMCB,no,N,54,,161601,27869,HEM
55,,DOUB,CAC,CBC,no,N,55,,161601,27869,HEM
56,,SING,CAC,HAC,no,N,56,,161601,27869,HEM
57,,SING,CBC,HBC,no,N,57,,161601,27869,HEM
58,,SING,CBC,HBCA,no,N,58,,161601,27869,HEM
59,,SING,C1D,C2D,no,N,59,,161601,27869,HEM
60,,DOUB,C1D,ND,no,N,60,,161601,27869,HEM
61,,DOUB,C2D,C3D,no,N,61,,161601,27869,HEM
62,,SING,C2D,CMD,no,N,62,,161601,27869,HEM
63,,SING,C3D,C4D,no,N,63,,161601,27869,HEM
64,,SING,C3D,CAD,no,N,64,,161601,27869,HEM
65,,SING,C4D,ND,no,N,65,,161601,27869,HEM
66,,SING,CMD,HMD,no,N,66,,161601,27869,HEM
67,,SING,CMD,HMDA,no,N,67,,161601,27869,HEM
68,,SING,CMD,HMDB,no,N,68,,161601,27869,HEM
69,,SING,CAD,CBD,no,N,69,,161601,27869,HEM
70,,SING,CAD,HAD,no,N,70,,161601,27869,HEM
71,,SING,CAD,HADA,no,N,71,,161601,27869,HEM
72,,SING,CBD,CGD,no,N,72,,161601,27869,HEM
73,,SING,CBD,HBD,no,N,73,,161601,27869,HEM
74,,SING,CBD,HBDA,no,N,74,,161601,27869,HEM
75,,DOUB,CGD,O1D,no,N,75,,161601,27869,HEM
76,,SING,CGD,O2D,no,N,76,,161601,27869,HEM
77,,SING,O2A,H2A,no,N,77,,161601,27869,HEM
78,,SING,O2D,H2D,no,N,78,,161601,27869,HEM
79,,SING,FE,NA,no,N,79,,161601,27869,HEM
80,,SING,FE,NB,no,N,80,,161601,27869,HEM
81,,SING,FE,NC,no,N,81,,161601,27869,HEM
82,,SING,FE,ND,no,N,82,,161601,27869,HEM
1,,DOUB,C,O,no,N,1,,161655,27873,ACE
2,,SING,C,CH3,no,N,2,,161655,27873,ACE
3,,SING,C,H,no,N,3,,161655,27873,ACE
4,,SING,CH3,H1,no,N,4,,161655,27873,ACE
5,,SING,CH3,H2,no,N,5,,161655,27873,ACE
6,,SING,CH3,H3,no,N,6,,161655,27873,ACE
1,,SING,N,CA,no,N,1,,161656,27873,MED
2,,SING,N,H,no,N,2,,161656,27873,MED
3,,SING,N,H2,no,N,3,,161656,27873,MED
4,,SING,CA,C,no,N,4,,161656,27873,MED
5,,SING,CA,CB,no,N,5,,161656,27873,MED
6,,SING,CA,HA,no,N,6,,161656,27873,MED
7,,DOUB,C,O,no,N,7,,161656,27873,MED
8,,SING,C,OXT,no,N,8,,161656,27873,MED
9,,SING,CB,CG,no,N,9,,161656,27873,MED
10,,SING,CB,HB2,no,N,10,,161656,27873,MED
11,,SING,CB,HB3,no,N,11,,161656,27873,MED
12,,SING,CG,SD,no,N,12,,161656,27873,MED
13,,SING,CG,HG2,no,N,13,,161656,27873,MED
14,,SING,CG,HG3,no,N,14,,161656,27873,MED
15,,SING,SD,CE,no,N,15,,161656,27873,MED
16,,SING,CE,HE1,no,N,16,,161656,27873,MED
17,,SING,CE,HE2,no,N,17,,161656,27873,MED
18,,SING,CE,HE3,no,N,18,,161656,27873,MED
19,,SING,OXT,HXT,no,N,19,,161656,27873,MED
1,,SING,N,CA,no,N,1,,161657,27873,DLE
2,,SING,N,H,no,N,2,,161657,27873,DLE
3,,SING,N,H2,no,N,3,,161657,27873,DLE
4,,SING,CA,CB,no,N,4,,161657,27873,DLE
5,,SING,CA,C,no,N,5,,161657,27873,DLE
6,,SING,CA,HA,no,N,6,,161657,27873,DLE
7,,SING,CB,CG,no,N,7,,161657,27873,DLE
8,,SING,CB,HB2,no,N,8,,161657,27873,DLE
9,,SING,CB,HB3,no,N,9,,161657,27873,DLE
10,,SING,CG,CD1,no,N,10,,161657,27873,DLE
11,,SING,CG,CD2,no,N,11,,161657,27873,DLE
12,,SING,CG,HG,no,N,12,,161657,27873,DLE
13,,SING,CD1,HD11,no,N,13,,161657,27873,DLE
14,,SING,CD1,HD12,no,N,14,,161657,27873,DLE
15,,SING,CD1,HD13,no,N,15,,161657,27873,DLE
16,,SING,CD2,HD21,no,N,16,,161657,27873,DLE
17,,SING,CD2,HD22,no,N,17,,161657,27873,DLE
18,,SING,CD2,HD23,no,N,18,,161657,27873,DLE
19,,DOUB,C,O,no,N,19,,161657,27873,DLE
20,,SING,C,OXT,no,N,20,,161657,27873,DLE
21,,SING,OXT,HXT,no,N,21,,161657,27873,DLE
1,,SING,N,CA,no,N,1,,161658,27873,DTR
2,,SING,N,H,no,N,2,,161658,27873,DTR
3,,SING,N,HN2,no,N,3,,161658,27873,DTR
4,,SING,CA,CB,no,N,4,,161658,27873,DTR
5,,SING,CA,C,no,N,5,,161658,27873,DTR
6,,SING,CA,HA,no,N,6,,161658,27873,DTR
7,,SING,CB,CG,no,N,7,,161658,27873,DTR
8,,SING,CB,HB2,no,N,8,,161658,27873,DTR
9,,SING,CB,HB3,no,N,9,,161658,27873,DTR
10,,DOUB,CG,CD1,yes,N,10,,161658,27873,DTR
11,,SING,CG,CD2,yes,N,11,,161658,27873,DTR
12,,SING,CD1,NE1,yes,N,12,,161658,27873,DTR
13,,SING,CD1,HD1,no,N,13,,161658,27873,DTR
14,,SING,NE1,CE2,yes,N,14,,161658,27873,DTR
15,,SING,NE1,HE1,no,N,15,,161658,27873,DTR
16,,DOUB,CE2,CZ2,yes,N,16,,161658,27873,DTR
17,,SING,CE2,CD2,yes,N,17,,161658,27873,DTR
18,,SING,CZ2,CH2,yes,N,18,,161658,27873,DTR
19,,SING,CZ2,HZ2,no,N,19,,161658,27873,DTR
20,,DOUB,CH2,CZ3,yes,N,20,,161658,27873,DTR
21,,SING,CH2,HH2,no,N,21,,161658,27873,DTR
22,,SING,CZ3,CE3,yes,N,22,,161658,27873,DTR
23,,SING,CZ3,HZ3,no,N,23,,161658,27873,DTR
24,,DOUB,CE3,CD2,yes,N,24,,161658,27873,DTR
25,,SING,CE3,HE3,no,N,25,,161658,27873,DTR
26,,DOUB,C,O,no,N,26,,161658,27873,DTR
27,,SING,C,OXT,no,N,27,,161658,27873,DTR
28,,SING,OXT,HXT,no,N,28,,161658,27873,DTR
1,,SING,N,CA,no,N,1,,161659,27873,DCY
2,,SING,N,H,no,N,2,,161659,27873,DCY
3,,SING,N,H2,no,N,3,,161659,27873,DCY
4,,SING,CA,C,no,N,4,,161659,27873,DCY
5,,SING,CA,CB,no,N,5,,161659,27873,DCY
6,,SING,CA,HA,no,N,6,,161659,27873,DCY
7,,DOUB,C,O,no,N,7,,161659,27873,DCY
8,,SING,C,OXT,no,N,8,,161659,27873,DCY
9,,SING,CB,SG,no,N,9,,161659,27873,DCY
10,,SING,CB,HB2,no,N,10,,161659,27873,DCY
11,,SING,CB,HB3,no,N,11,,161659,27873,DCY
12,,SING,SG,HG,no,N,12,,161659,27873,DCY
13,,SING,OXT,HXT,no,N,13,,161659,27873,DCY
1,,SING,N,CA,no,N,1,,161660,27873,DSG
2,,SING,N,H,no,N,2,,161660,27873,DSG
3,,SING,N,H2,no,N,3,,161660,27873,DSG
4,,SING,CA,C,no,N,4,,161660,27873,DSG
5,,SING,CA,CB,no,N,5,,161660,27873,DSG
6,,SING,CA,HA,no,N,6,,161660,27873,DSG
7,,DOUB,C,O,no,N,7,,161660,27873,DSG
8,,SING,C,OXT,no,N,8,,161660,27873,DSG
9,,SING,CB,CG,no,N,9,,161660,27873,DSG
10,,SING,CB,HB2,no,N,10,,161660,27873,DSG
11,,SING,CB,HB3,no,N,11,,161660,27873,DSG
12,,DOUB,CG,OD1,no,N,12,,161660,27873,DSG
13,,SING,CG,ND2,no,N,13,,161660,27873,DSG
14,,SING,ND2,HD21,no,N,14,,161660,27873,DSG
15,,SING,ND2,HD22,no,N,15,,161660,27873,DSG
16,,SING,OXT,HXT,no,N,16,,161660,27873,DSG
1,,SING,N,CA,no,N,1,,161661,27873,DLY
2,,SING,N,H,no,N,2,,161661,27873,DLY
3,,SING,N,H2,no,N,3,,161661,27873,DLY
4,,SING,CA,C,no,N,4,,161661,27873,DLY
5,,SING,CA,CB,no,N,5,,161661,27873,DLY
6,,SING,CA,HA,no,N,6,,161661,27873,DLY
7,,DOUB,C,O,no,N,7,,161661,27873,DLY
8,,SING,C,OXT,no,N,8,,161661,27873,DLY
9,,SING,CB,CG,no,N,9,,161661,27873,DLY
10,,SING,CB,HB2,no,N,10,,161661,27873,DLY
11,,SING,CB,HB3,no,N,11,,161661,27873,DLY
12,,SING,CG,CD,no,N,12,,161661,27873,DLY
13,,SING,CG,HG2,no,N,13,,161661,27873,DLY
14,,SING,CG,HG3,no,N,14,,161661,27873,DLY
15,,SING,CD,CE,no,N,15,,161661,27873,DLY
16,,SING,CD,HD2,no,N,16,,161661,27873,DLY
17,,SING,CD,HD3,no,N,17,,161661,27873,DLY
18,,SING,CE,NZ,no,N,18,,161661,27873,DLY
19,,SING,CE,HE2,no,N,19,,161661,27873,DLY
20,,SING,CE,HE3,no,N,20,,161661,27873,DLY
21,,SING,NZ,HZ1,no,N,21,,161661,27873,DLY
22,,SING,NZ,HZ2,no,N,22,,161661,27873,DLY
23,,SING,OXT,HXT,no,N,23,,161661,27873,DLY
1,,SING,N,HN1,no,N,1,,161662,27873,NH2
2,,SING,N,HN2,no,N,2,,161662,27873,NH2
1,,SING,P1,O2P,no,N,1,,161730,27876,C2E
2,,DOUB,O1P,P1,no,N,2,,161730,27876,C2E
3,,SING,O5',P1,no,N,3,,161730,27876,C2E
4,,SING,C5',O5',no,N,4,,161730,27876,C2E
5,,SING,C4',O4',no,N,5,,161730,27876,C2E
6,,SING,C4',C5',no,N,6,,161730,27876,C2E
7,,SING,C3',C4',no,N,7,,161730,27876,C2E
8,,SING,O3',P11,no,N,8,,161730,27876,C2E
9,,SING,O3',C3',no,N,9,,161730,27876,C2E
10,,SING,C2',C3',no,N,10,,161730,27876,C2E
11,,SING,C2',C1',no,N,11,,161730,27876,C2E
12,,SING,O2',C2',no,N,12,,161730,27876,C2E
13,,SING,C1',O4',no,N,13,,161730,27876,C2E
14,,SING,C1',N9,no,N,14,,161730,27876,C2E
15,,SING,N9,C4,yes,N,15,,161730,27876,C2E
16,,SING,N9,C8,yes,N,16,,161730,27876,C2E
17,,DOUB,C8,N7,yes,N,17,,161730,27876,C2E
18,,SING,C5,N7,yes,N,18,,161730,27876,C2E
19,,SING,C5,C6,no,N,19,,161730,27876,C2E
20,,DOUB,C6,O6,no,N,20,,161730,27876,C2E
21,,SING,N1,C6,no,N,21,,161730,27876,C2E
22,,SING,C2,N1,no,N,22,,161730,27876,C2E
23,,SING,N2,C2,no,N,23,,161730,27876,C2E
24,,DOUB,N3,C2,no,N,24,,161730,27876,C2E
25,,SING,N3,C4,no,N,25,,161730,27876,C2E
26,,DOUB,C4,C5,yes,N,26,,161730,27876,C2E
27,,SING,P11,O21,no,N,27,,161730,27876,C2E
28,,SING,P11,O5A,no,N,28,,161730,27876,C2E
29,,DOUB,O11,P11,no,N,29,,161730,27876,C2E
30,,SING,C5A,O5A,no,N,30,,161730,27876,C2E
31,,SING,C5A,C4A,no,N,31,,161730,27876,C2E
32,,SING,C4A,O4A,no,N,32,,161730,27876,C2E
33,,SING,C4A,C3A,no,N,33,,161730,27876,C2E
34,,SING,O4A,C1A,no,N,34,,161730,27876,C2E
35,,SING,C3A,C2A,no,N,35,,161730,27876,C2E
36,,SING,O3A,C3A,no,N,36,,161730,27876,C2E
37,,SING,O3A,P1,no,N,37,,161730,27876,C2E
38,,SING,C2A,O2A,no,N,38,,161730,27876,C2E
39,,SING,C1A,C2A,no,N,39,,161730,27876,C2E
40,,SING,C1A,N91,no,N,40,,161730,27876,C2E
41,,SING,N91,C41,yes,N,41,,161730,27876,C2E
42,,DOUB,C81,N71,yes,N,42,,161730,27876,C2E
43,,SING,C81,N91,yes,N,43,,161730,27876,C2E
44,,SING,N71,C51,yes,N,44,,161730,27876,C2E
45,,DOUB,C51,C41,yes,N,45,,161730,27876,C2E
46,,SING,C51,C61,no,N,46,,161730,27876,C2E
47,,DOUB,C61,O61,no,N,47,,161730,27876,C2E
48,,SING,C61,N11,no,N,48,,161730,27876,C2E
49,,SING,C21,N11,no,N,49,,161730,27876,C2E
50,,SING,C21,N21,no,N,50,,161730,27876,C2E
51,,DOUB,N31,C21,no,N,51,,161730,27876,C2E
52,,SING,C41,N31,no,N,52,,161730,27876,C2E
53,,SING,O2P,HO2P,no,N,53,,161730,27876,C2E
54,,SING,C5',H5'1,no,N,54,,161730,27876,C2E
55,,SING,C5',H5'2,no,N,55,,161730,27876,C2E
56,,SING,C4',H4',no,N,56,,161730,27876,C2E
57,,SING,C3',H3',no,N,57,,161730,27876,C2E
58,,SING,C2',H2',no,N,58,,161730,27876,C2E
59,,SING,O2',HO2',no,N,59,,161730,27876,C2E
60,,SING,C1',H1',no,N,60,,161730,27876,C2E
61,,SING,C8,H8,no,N,61,,161730,27876,C2E
62,,SING,N1,HN1,no,N,62,,161730,27876,C2E
63,,SING,N2,HN21,no,N,63,,161730,27876,C2E
64,,SING,N2,HN22,no,N,64,,161730,27876,C2E
65,,SING,O21,HO21,no,N,65,,161730,27876,C2E
66,,SING,C5A,H511,no,N,66,,161730,27876,C2E
67,,SING,C5A,H512,no,N,67,,161730,27876,C2E
68,,SING,C4A,H4A,no,N,68,,161730,27876,C2E
69,,SING,C3A,H3A,no,N,69,,161730,27876,C2E
70,,SING,C2A,H2A,no,N,70,,161730,27876,C2E
71,,SING,O2A,HO2A,no,N,71,,161730,27876,C2E
72,,SING,C1A,H1A,no,N,72,,161730,27876,C2E
73,,SING,C81,H81,no,N,73,,161730,27876,C2E
74,,SING,N11,HN11,no,N,74,,161730,27876,C2E
75,,SING,N21,HN24,no,N,75,,161730,27876,C2E
76,,SING,N21,HN23,no,N,76,,161730,27876,C2E
1,,DOUB,PB,O1B,no,N,1,,161784,27879,ADP
2,,SING,PB,O2B,no,N,2,,161784,27879,ADP
3,,SING,PB,O3B,no,N,3,,161784,27879,ADP
4,,SING,PB,O3A,no,N,4,,161784,27879,ADP
5,,SING,O2B,HOB2,no,N,5,,161784,27879,ADP
6,,SING,O3B,HOB3,no,N,6,,161784,27879,ADP
7,,DOUB,PA,O1A,no,N,7,,161784,27879,ADP
8,,SING,PA,O2A,no,N,8,,161784,27879,ADP
9,,SING,PA,O3A,no,N,9,,161784,27879,ADP
10,,SING,PA,O5',no,N,10,,161784,27879,ADP
11,,SING,O2A,HOA2,no,N,11,,161784,27879,ADP
12,,SING,O5',C5',no,N,12,,161784,27879,ADP
13,,SING,C5',C4',no,N,13,,161784,27879,ADP
14,,SING,C5',H5'1,no,N,14,,161784,27879,ADP
15,,SING,C5',H5'2,no,N,15,,161784,27879,ADP
16,,SING,C4',O4',no,N,16,,161784,27879,ADP
17,,SING,C4',C3',no,N,17,,161784,27879,ADP
18,,SING,C4',H4',no,N,18,,161784,27879,ADP
19,,SING,O4',C1',no,N,19,,161784,27879,ADP
20,,SING,C3',O3',no,N,20,,161784,27879,ADP
21,,SING,C3',C2',no,N,21,,161784,27879,ADP
22,,SING,C3',H3',no,N,22,,161784,27879,ADP
23,,SING,O3',HO3',no,N,23,,161784,27879,ADP
24,,SING,C2',O2',no,N,24,,161784,27879,ADP
25,,SING,C2',C1',no,N,25,,161784,27879,ADP
26,,SING,C2',H2',no,N,26,,161784,27879,ADP
27,,SING,O2',HO2',no,N,27,,161784,27879,ADP
28,,SING,C1',N9,no,N,28,,161784,27879,ADP
29,,SING,C1',H1',no,N,29,,161784,27879,ADP
30,,SING,N9,C8,yes,N,30,,161784,27879,ADP
31,,SING,N9,C4,yes,N,31,,161784,27879,ADP
32,,DOUB,C8,N7,yes,N,32,,161784,27879,ADP
33,,SING,C8,H8,no,N,33,,161784,27879,ADP
34,,SING,N7,C5,yes,N,34,,161784,27879,ADP
35,,SING,C5,C6,yes,N,35,,161784,27879,ADP
36,,DOUB,C5,C4,yes,N,36,,161784,27879,ADP
37,,SING,C6,N6,no,N,37,,161784,27879,ADP
38,,DOUB,C6,N1,yes,N,38,,161784,27879,ADP
39,,SING,N6,HN61,no,N,39,,161784,27879,ADP
40,,SING,N6,HN62,no,N,40,,161784,27879,ADP
41,,SING,N1,C2,yes,N,41,,161784,27879,ADP
42,,DOUB,C2,N3,yes,N,42,,161784,27879,ADP
43,,SING,C2,H2,no,N,43,,161784,27879,ADP
44,,SING,N3,C4,yes,N,44,,161784,27879,ADP
1,,SING,AL,F1,no,N,1,,161785,27879,ALF
2,,SING,AL,F2,no,N,2,,161785,27879,ALF
3,,SING,AL,F3,no,N,3,,161785,27879,ALF
4,,SING,AL,F4,no,N,4,,161785,27879,ALF
1,,SING,N,CA,no,N,1,,161866,27884,SEP
2,,SING,N,H,no,N,2,,161866,27884,SEP
3,,SING,N,H2,no,N,3,,161866,27884,SEP
4,,SING,CA,CB,no,N,4,,161866,27884,SEP
5,,SING,CA,C,no,N,5,,161866,27884,SEP
6,,SING,CA,HA,no,N,6,,161866,27884,SEP
7,,SING,CB,OG,no,N,7,,161866,27884,SEP
8,,SING,CB,HB2,no,N,8,,161866,27884,SEP
9,,SING,CB,HB3,no,N,9,,161866,27884,SEP
10,,SING,OG,P,no,N,10,,161866,27884,SEP
11,,DOUB,C,O,no,N,11,,161866,27884,SEP
12,,SING,C,OXT,no,N,12,,161866,27884,SEP
13,,SING,OXT,HXT,no,N,13,,161866,27884,SEP
14,,DOUB,P,O1P,no,N,14,,161866,27884,SEP
15,,SING,P,O2P,no,N,15,,161866,27884,SEP
16,,SING,P,O3P,no,N,16,,161866,27884,SEP
17,,SING,O2P,HOP2,no,N,17,,161866,27884,SEP
18,,SING,O3P,HOP3,no,N,18,,161866,27884,SEP
1,,DOUB,O2,C5,no,N,1,,161945,27890,J01
2,,SING,C5,C4,no,N,2,,161945,27890,J01
3,,SING,C5,N1,no,N,3,,161945,27890,J01
4,,SING,C4,C3,no,N,4,,161945,27890,J01
5,,SING,C4,H4C1,no,N,5,,161945,27890,J01
6,,SING,C4,H4C2,no,N,6,,161945,27890,J01
7,,SING,C3,N1,no,N,7,,161945,27890,J01
8,,SING,C3,O1,no,N,8,,161945,27890,J01
9,,SING,C3,H3,no,N,9,,161945,27890,J01
10,,SING,N1,C2,no,N,10,,161945,27890,J01
11,,SING,O1,C1,no,N,11,,161945,27890,J01
12,,SING,C1,C2,no,N,12,,161945,27890,J01
13,,DOUB,C1,C6,no,Z,13,,161945,27890,J01
14,,SING,C2,C8,no,N,14,,161945,27890,J01
15,,SING,C2,H2,no,N,15,,161945,27890,J01
16,,DOUB,C8,O5,no,N,16,,161945,27890,J01
17,,SING,C8,O4,no,N,17,,161945,27890,J01
18,,SING,O4,H4,no,N,18,,161945,27890,J01
19,,SING,C6,C7,no,N,19,,161945,27890,J01
20,,SING,C6,H6,no,N,20,,161945,27890,J01
21,,SING,C7,O3,no,N,21,,161945,27890,J01
22,,SING,C7,H7C1,no,N,22,,161945,27890,J01
23,,SING,C7,H7C2,no,N,23,,161945,27890,J01
24,,SING,O3,HA,no,N,24,,161945,27890,J01
1,,SING,NAK,CAO,no,N,1,,162352,27929,NXL
2,,SING,CAJ,CAO,no,N,2,,162352,27929,NXL
3,,SING,CAJ,N,no,N,3,,162352,27929,NXL
4,,SING,OAL,SAR,no,N,4,,162352,27929,NXL
5,,SING,CAO,CAH,no,N,5,,162352,27929,NXL
6,,SING,CAN,N,no,N,6,,162352,27929,NXL
7,,DOUB,CAN,OAC,no,N,7,,162352,27929,NXL
8,,DOUB,OAG,SAR,no,N,8,,162352,27929,NXL
9,,SING,N,CA,no,N,9,,162352,27929,NXL
10,,DOUB,SAR,OAE,no,N,10,,162352,27929,NXL
11,,SING,SAR,OAD,no,N,11,,162352,27929,NXL
12,,DOUB,O,C,no,N,12,,162352,27929,NXL
13,,SING,CAH,CB,no,N,13,,162352,27929,NXL
14,,SING,CA,C,no,N,14,,162352,27929,NXL
15,,SING,CA,CB,no,N,15,,162352,27929,NXL
16,,SING,C,NAA,no,N,16,,162352,27929,NXL
17,,SING,NAK,OAL,no,N,17,,162352,27929,NXL
18,,SING,CAN,H1,no,N,18,,162352,27929,NXL
19,,SING,CAJ,H2,no,N,19,,162352,27929,NXL
20,,SING,CAJ,H3,no,N,20,,162352,27929,NXL
21,,SING,CA,H4,no,N,21,,162352,27929,NXL
22,,SING,NAA,H5,no,N,22,,162352,27929,NXL
23,,SING,NAA,H6,no,N,23,,162352,27929,NXL
24,,SING,CB,H7,no,N,24,,162352,27929,NXL
25,,SING,CB,H8,no,N,25,,162352,27929,NXL
26,,SING,CAH,H9,no,N,26,,162352,27929,NXL
27,,SING,CAH,H10,no,N,27,,162352,27929,NXL
28,,SING,CAO,H11,no,N,28,,162352,27929,NXL
29,,SING,NAK,H12,no,N,29,,162352,27929,NXL
30,,SING,OAD,H13,no,N,30,,162352,27929,NXL
1,,SING,C1,C2,no,N,1,,162500,27946,REA
2,,SING,C1,C6,no,N,2,,162500,27946,REA
3,,SING,C1,C16,no,N,3,,162500,27946,REA
4,,SING,C1,C17,no,N,4,,162500,27946,REA
5,,SING,C2,C3,no,N,5,,162500,27946,REA
6,,SING,C2,H21,no,N,6,,162500,27946,REA
7,,SING,C2,H22,no,N,7,,162500,27946,REA
8,,SING,C3,C4,no,N,8,,162500,27946,REA
9,,SING,C3,H31,no,N,9,,162500,27946,REA
10,,SING,C3,H32,no,N,10,,162500,27946,REA
11,,SING,C4,C5,no,N,11,,162500,27946,REA
12,,SING,C4,H41,no,N,12,,162500,27946,REA
13,,SING,C4,H42,no,N,13,,162500,27946,REA
14,,DOUB,C5,C6,no,N,14,,162500,27946,REA
15,,SING,C5,C18,no,N,15,,162500,27946,REA
16,,SING,C6,C7,no,N,16,,162500,27946,REA
17,,DOUB,C7,C8,no,E,17,,162500,27946,REA
18,,SING,C7,H7,no,N,18,,162500,27946,REA
19,,SING,C8,C9,no,N,19,,162500,27946,REA
20,,SING,C8,H8,no,N,20,,162500,27946,REA
21,,DOUB,C9,C10,no,E,21,,162500,27946,REA
22,,SING,C9,C19,no,N,22,,162500,27946,REA
23,,SING,C10,C11,no,N,23,,162500,27946,REA
24,,SING,C10,H10,no,N,24,,162500,27946,REA
25,,DOUB,C11,C12,no,E,25,,162500,27946,REA
26,,SING,C11,H11,no,N,26,,162500,27946,REA
27,,SING,C12,C13,no,N,27,,162500,27946,REA
28,,SING,C12,H12,no,N,28,,162500,27946,REA
29,,DOUB,C13,C14,no,E,29,,162500,27946,REA
30,,SING,C13,C20,no,N,30,,162500,27946,REA
31,,SING,C14,C15,no,N,31,,162500,27946,REA
32,,SING,C14,H14,no,N,32,,162500,27946,REA
33,,DOUB,C15,O1,no,N,33,,162500,27946,REA
34,,SING,C15,O2,no,N,34,,162500,27946,REA
35,,SING,C16,H161,no,N,35,,162500,27946,REA
36,,SING,C16,H162,no,N,36,,162500,27946,REA
37,,SING,C16,H163,no,N,37,,162500,27946,REA
38,,SING,C17,H171,no,N,38,,162500,27946,REA
39,,SING,C17,H172,no,N,39,,162500,27946,REA
40,,SING,C17,H173,no,N,40,,162500,27946,REA
41,,SING,C18,H181,no,N,41,,162500,27946,REA
42,,SING,C18,H182,no,N,42,,162500,27946,REA
43,,SING,C18,H183,no,N,43,,162500,27946,REA
44,,SING,C19,H191,no,N,44,,162500,27946,REA
45,,SING,C19,H192,no,N,45,,162500,27946,REA
46,,SING,C19,H193,no,N,46,,162500,27946,REA
47,,SING,C20,H201,no,N,47,,162500,27946,REA
48,,SING,C20,H202,no,N,48,,162500,27946,REA
49,,SING,C20,H203,no,N,49,,162500,27946,REA
50,,SING,O2,HO2,no,N,50,,162500,27946,REA
1,,SING,N,CA,no,N,1,,162515,27947,CSD
2,,SING,N,H,no,N,2,,162515,27947,CSD
3,,SING,N,H2,no,N,3,,162515,27947,CSD
4,,SING,CA,CB,no,N,4,,162515,27947,CSD
5,,SING,CA,C,no,N,5,,162515,27947,CSD
6,,SING,CA,HA,no,N,6,,162515,27947,CSD
7,,SING,CB,SG,no,N,7,,162515,27947,CSD
8,,SING,CB,HB2,no,N,8,,162515,27947,CSD
9,,SING,CB,HB3,no,N,9,,162515,27947,CSD
10,,DOUB,SG,OD1,no,N,10,,162515,27947,CSD
11,,SING,SG,OD2,no,N,11,,162515,27947,CSD
12,,DOUB,C,O,no,N,12,,162515,27947,CSD
13,,SING,C,OXT,no,N,13,,162515,27947,CSD
14,,SING,OXT,HXT,no,N,14,,162515,27947,CSD
15,,SING,OD2,HD2,no,N,15,,162515,27947,CSD
1,,DOUB,PG,O1G,no,N,1,,162628,27954,ATP
2,,SING,PG,O2G,no,N,2,,162628,27954,ATP
3,,SING,PG,O3G,no,N,3,,162628,27954,ATP
4,,SING,PG,O3B,no,N,4,,162628,27954,ATP
5,,SING,O2G,HOG2,no,N,5,,162628,27954,ATP
6,,SING,O3G,HOG3,no,N,6,,162628,27954,ATP
7,,DOUB,PB,O1B,no,N,7,,162628,27954,ATP
8,,SING,PB,O2B,no,N,8,,162628,27954,ATP
9,,SING,PB,O3B,no,N,9,,162628,27954,ATP
10,,SING,PB,O3A,no,N,10,,162628,27954,ATP
11,,SING,O2B,HOB2,no,N,11,,162628,27954,ATP
12,,DOUB,PA,O1A,no,N,12,,162628,27954,ATP
13,,SING,PA,O2A,no,N,13,,162628,27954,ATP
14,,SING,PA,O3A,no,N,14,,162628,27954,ATP
15,,SING,PA,O5',no,N,15,,162628,27954,ATP
16,,SING,O2A,HOA2,no,N,16,,162628,27954,ATP
17,,SING,O5',C5',no,N,17,,162628,27954,ATP
18,,SING,C5',C4',no,N,18,,162628,27954,ATP
19,,SING,C5',H5'1,no,N,19,,162628,27954,ATP
20,,SING,C5',H5'2,no,N,20,,162628,27954,ATP
21,,SING,C4',O4',no,N,21,,162628,27954,ATP
22,,SING,C4',C3',no,N,22,,162628,27954,ATP
23,,SING,C4',H4',no,N,23,,162628,27954,ATP
24,,SING,O4',C1',no,N,24,,162628,27954,ATP
25,,SING,C3',O3',no,N,25,,162628,27954,ATP
26,,SING,C3',C2',no,N,26,,162628,27954,ATP
27,,SING,C3',H3',no,N,27,,162628,27954,ATP
28,,SING,O3',HO3',no,N,28,,162628,27954,ATP
29,,SING,C2',O2',no,N,29,,162628,27954,ATP
30,,SING,C2',C1',no,N,30,,162628,27954,ATP
31,,SING,C2',H2',no,N,31,,162628,27954,ATP
32,,SING,O2',HO2',no,N,32,,162628,27954,ATP
33,,SING,C1',N9,no,N,33,,162628,27954,ATP
34,,SING,C1',H1',no,N,34,,162628,27954,ATP
35,,SING,N9,C8,yes,N,35,,162628,27954,ATP
36,,SING,N9,C4,yes,N,36,,162628,27954,ATP
37,,DOUB,C8,N7,yes,N,37,,162628,27954,ATP
38,,SING,C8,H8,no,N,38,,162628,27954,ATP
39,,SING,N7,C5,yes,N,39,,162628,27954,ATP
40,,SING,C5,C6,yes,N,40,,162628,27954,ATP
41,,DOUB,C5,C4,yes,N,41,,162628,27954,ATP
42,,SING,C6,N6,no,N,42,,162628,27954,ATP
43,,DOUB,C6,N1,yes,N,43,,162628,27954,ATP
44,,SING,N6,HN61,no,N,44,,162628,27954,ATP
45,,SING,N6,HN62,no,N,45,,162628,27954,ATP
46,,SING,N1,C2,yes,N,46,,162628,27954,ATP
47,,DOUB,C2,N3,yes,N,47,,162628,27954,ATP
48,,SING,C2,H2,no,N,48,,162628,27954,ATP
49,,SING,N3,C4,yes,N,49,,162628,27954,ATP
1,,SING,N,CA,no,N,1,,162729,27960,DSN
2,,SING,N,H,no,N,2,,162729,27960,DSN
3,,SING,N,H2,no,N,3,,162729,27960,DSN
4,,SING,CA,C,no,N,4,,162729,27960,DSN
5,,SING,CA,CB,no,N,5,,162729,27960,DSN
6,,SING,CA,HA,no,N,6,,162729,27960,DSN
7,,DOUB,C,O,no,N,7,,162729,27960,DSN
8,,SING,C,OXT,no,N,8,,162729,27960,DSN
9,,SING,OXT,HXT,no,N,9,,162729,27960,DSN
10,,SING,CB,OG,no,N,10,,162729,27960,DSN
11,,SING,CB,HB2,no,N,11,,162729,27960,DSN
12,,SING,CB,HB3,no,N,12,,162729,27960,DSN
13,,SING,OG,HG,no,N,13,,162729,27960,DSN
1,,DOUB,PA,O1A,no,N,1,,162965,27976,NAP
2,,SING,PA,O2A,no,N,2,,162965,27976,NAP
3,,SING,PA,O5B,no,N,3,,162965,27976,NAP
4,,SING,PA,O3,no,N,4,,162965,27976,NAP
5,,SING,O2A,HOA2,no,N,5,,162965,27976,NAP
6,,SING,O5B,C5B,no,N,6,,162965,27976,NAP
7,,SING,C5B,C4B,no,N,7,,162965,27976,NAP
8,,SING,C5B,H51A,no,N,8,,162965,27976,NAP
9,,SING,C5B,H52A,no,N,9,,162965,27976,NAP
10,,SING,C4B,O4B,no,N,10,,162965,27976,NAP
11,,SING,C4B,C3B,no,N,11,,162965,27976,NAP
12,,SING,C4B,H4B,no,N,12,,162965,27976,NAP
13,,SING,O4B,C1B,no,N,13,,162965,27976,NAP
14,,SING,C3B,O3B,no,N,14,,162965,27976,NAP
15,,SING,C3B,C2B,no,N,15,,162965,27976,NAP
16,,SING,C3B,H3B,no,N,16,,162965,27976,NAP
17,,SING,O3B,HO3A,no,N,17,,162965,27976,NAP
18,,SING,C2B,O2B,no,N,18,,162965,27976,NAP
19,,SING,C2B,C1B,no,N,19,,162965,27976,NAP
20,,SING,C2B,H2B,no,N,20,,162965,27976,NAP
21,,SING,O2B,P2B,no,N,21,,162965,27976,NAP
22,,SING,C1B,N9A,no,N,22,,162965,27976,NAP
23,,SING,C1B,H1B,no,N,23,,162965,27976,NAP
24,,SING,N9A,C8A,yes,N,24,,162965,27976,NAP
25,,SING,N9A,C4A,yes,N,25,,162965,27976,NAP
26,,DOUB,C8A,N7A,yes,N,26,,162965,27976,NAP
27,,SING,C8A,H8A,no,N,27,,162965,27976,NAP
28,,SING,N7A,C5A,yes,N,28,,162965,27976,NAP
29,,SING,C5A,C6A,yes,N,29,,162965,27976,NAP
30,,DOUB,C5A,C4A,yes,N,30,,162965,27976,NAP
31,,SING,C6A,N6A,no,N,31,,162965,27976,NAP
32,,DOUB,C6A,N1A,yes,N,32,,162965,27976,NAP
33,,SING,N6A,H61A,no,N,33,,162965,27976,NAP
34,,SING,N6A,H62A,no,N,34,,162965,27976,NAP
35,,SING,N1A,C2A,yes,N,35,,162965,27976,NAP
36,,DOUB,C2A,N3A,yes,N,36,,162965,27976,NAP
37,,SING,C2A,H2A,no,N,37,,162965,27976,NAP
38,,SING,N3A,C4A,yes,N,38,,162965,27976,NAP
39,,SING,O3,PN,no,N,39,,162965,27976,NAP
40,,DOUB,PN,O1N,no,N,40,,162965,27976,NAP
41,,SING,PN,O2N,no,N,41,,162965,27976,NAP
42,,SING,PN,O5D,no,N,42,,162965,27976,NAP
43,,SING,O5D,C5D,no,N,43,,162965,27976,NAP
44,,SING,C5D,C4D,no,N,44,,162965,27976,NAP
45,,SING,C5D,H51N,no,N,45,,162965,27976,NAP
46,,SING,C5D,H52N,no,N,46,,162965,27976,NAP
47,,SING,C4D,O4D,no,N,47,,162965,27976,NAP
48,,SING,C4D,C3D,no,N,48,,162965,27976,NAP
49,,SING,C4D,H4D,no,N,49,,162965,27976,NAP
50,,SING,O4D,C1D,no,N,50,,162965,27976,NAP
51,,SING,C3D,O3D,no,N,51,,162965,27976,NAP
52,,SING,C3D,C2D,no,N,52,,162965,27976,NAP
53,,SING,C3D,H3D,no,N,53,,162965,27976,NAP
54,,SING,O3D,HO3N,no,N,54,,162965,27976,NAP
55,,SING,C2D,O2D,no,N,55,,162965,27976,NAP
56,,SING,C2D,C1D,no,N,56,,162965,27976,NAP
57,,SING,C2D,H2D,no,N,57,,162965,27976,NAP
58,,SING,O2D,HO2N,no,N,58,,162965,27976,NAP
59,,SING,C1D,N1N,no,N,59,,162965,27976,NAP
60,,SING,C1D,H1D,no,N,60,,162965,27976,NAP
61,,SING,N1N,C2N,yes,N,61,,162965,27976,NAP
62,,DOUB,N1N,C6N,yes,N,62,,162965,27976,NAP
63,,DOUB,C2N,C3N,yes,N,63,,162965,27976,NAP
64,,SING,C2N,H2N,no,N,64,,162965,27976,NAP
65,,SING,C3N,C7N,no,N,65,,162965,27976,NAP
66,,SING,C3N,C4N,yes,N,66,,162965,27976,NAP
67,,DOUB,C7N,O7N,no,N,67,,162965,27976,NAP
68,,SING,C7N,N7N,no,N,68,,162965,27976,NAP
69,,SING,N7N,H71N,no,N,69,,162965,27976,NAP
70,,SING,N7N,H72N,no,N,70,,162965,27976,NAP
71,,DOUB,C4N,C5N,yes,N,71,,162965,27976,NAP
72,,SING,C4N,H4N,no,N,72,,162965,27976,NAP
73,,SING,C5N,C6N,yes,N,73,,162965,27976,NAP
74,,SING,C5N,H5N,no,N,74,,162965,27976,NAP
75,,SING,C6N,H6N,no,N,75,,162965,27976,NAP
76,,DOUB,P2B,O1X,no,N,76,,162965,27976,NAP
77,,SING,P2B,O2X,no,N,77,,162965,27976,NAP
78,,SING,P2B,O3X,no,N,78,,162965,27976,NAP
79,,SING,O2X,HOP2,no,N,79,,162965,27976,NAP
80,,SING,O3X,HOP3,no,N,80,,162965,27976,NAP
1,,SING,CHA,C1A,no,N,1,,163155,27987,HEM
2,,DOUB,CHA,C4D,no,N,2,,163155,27987,HEM
3,,SING,CHA,HHA,no,N,3,,163155,27987,HEM
4,,SING,CHB,C4A,no,N,4,,163155,27987,HEM
5,,DOUB,CHB,C1B,no,N,5,,163155,27987,HEM
6,,SING,CHB,HHB,no,N,6,,163155,27987,HEM
7,,SING,CHC,C4B,no,N,7,,163155,27987,HEM
8,,DOUB,CHC,C1C,no,N,8,,163155,27987,HEM
9,,SING,CHC,HHC,no,N,9,,163155,27987,HEM
10,,DOUB,CHD,C4C,no,N,10,,163155,27987,HEM
11,,SING,CHD,C1D,no,N,11,,163155,27987,HEM
12,,SING,CHD,HHD,no,N,12,,163155,27987,HEM
13,,DOUB,C1A,C2A,yes,N,13,,163155,27987,HEM
14,,SING,C1A,NA,yes,N,14,,163155,27987,HEM
15,,SING,C2A,C3A,yes,N,15,,163155,27987,HEM
16,,SING,C2A,CAA,no,N,16,,163155,27987,HEM
17,,DOUB,C3A,C4A,yes,N,17,,163155,27987,HEM
18,,SING,C3A,CMA,no,N,18,,163155,27987,HEM
19,,SING,C4A,NA,yes,N,19,,163155,27987,HEM
20,,SING,CMA,HMA,no,N,20,,163155,27987,HEM
21,,SING,CMA,HMAA,no,N,21,,163155,27987,HEM
22,,SING,CMA,HMAB,no,N,22,,163155,27987,HEM
23,,SING,CAA,CBA,no,N,23,,163155,27987,HEM
24,,SING,CAA,HAA,no,N,24,,163155,27987,HEM
25,,SING,CAA,HAAA,no,N,25,,163155,27987,HEM
26,,SING,CBA,CGA,no,N,26,,163155,27987,HEM
27,,SING,CBA,HBA,no,N,27,,163155,27987,HEM
28,,SING,CBA,HBAA,no,N,28,,163155,27987,HEM
29,,DOUB,CGA,O1A,no,N,29,,163155,27987,HEM
30,,SING,CGA,O2A,no,N,30,,163155,27987,HEM
31,,SING,C1B,C2B,no,N,31,,163155,27987,HEM
32,,SING,C1B,NB,no,N,32,,163155,27987,HEM
33,,DOUB,C2B,C3B,no,N,33,,163155,27987,HEM
34,,SING,C2B,CMB,no,N,34,,163155,27987,HEM
35,,SING,C3B,C4B,no,N,35,,163155,27987,HEM
36,,SING,C3B,CAB,no,N,36,,163155,27987,HEM
37,,DOUB,C4B,NB,no,N,37,,163155,27987,HEM
38,,SING,CMB,HMB,no,N,38,,163155,27987,HEM
39,,SING,CMB,HMBA,no,N,39,,163155,27987,HEM
40,,SING,CMB,HMBB,no,N,40,,163155,27987,HEM
41,,DOUB,CAB,CBB,no,N,41,,163155,27987,HEM
42,,SING,CAB,HAB,no,N,42,,163155,27987,HEM
43,,SING,CBB,HBB,no,N,43,,163155,27987,HEM
44,,SING,CBB,HBBA,no,N,44,,163155,27987,HEM
45,,SING,C1C,C2C,yes,N,45,,163155,27987,HEM
46,,SING,C1C,NC,yes,N,46,,163155,27987,HEM
47,,DOUB,C2C,C3C,yes,N,47,,163155,27987,HEM
48,,SING,C2C,CMC,no,N,48,,163155,27987,HEM
49,,SING,C3C,C4C,yes,N,49,,163155,27987,HEM
50,,SING,C3C,CAC,no,N,50,,163155,27987,HEM
51,,SING,C4C,NC,yes,N,51,,163155,27987,HEM
52,,SING,CMC,HMC,no,N,52,,163155,27987,HEM
53,,SING,CMC,HMCA,no,N,53,,163155,27987,HEM
54,,SING,CMC,HMCB,no,N,54,,163155,27987,HEM
55,,DOUB,CAC,CBC,no,N,55,,163155,27987,HEM
56,,SING,CAC,HAC,no,N,56,,163155,27987,HEM
57,,SING,CBC,HBC,no,N,57,,163155,27987,HEM
58,,SING,CBC,HBCA,no,N,58,,163155,27987,HEM
59,,SING,C1D,C2D,no,N,59,,163155,27987,HEM
60,,DOUB,C1D,ND,no,N,60,,163155,27987,HEM
61,,DOUB,C2D,C3D,no,N,61,,163155,27987,HEM
62,,SING,C2D,CMD,no,N,62,,163155,27987,HEM
63,,SING,C3D,C4D,no,N,63,,163155,27987,HEM
64,,SING,C3D,CAD,no,N,64,,163155,27987,HEM
65,,SING,C4D,ND,no,N,65,,163155,27987,HEM
66,,SING,CMD,HMD,no,N,66,,163155,27987,HEM
67,,SING,CMD,HMDA,no,N,67,,163155,27987,HEM
68,,SING,CMD,HMDB,no,N,68,,163155,27987,HEM
69,,SING,CAD,CBD,no,N,69,,163155,27987,HEM
70,,SING,CAD,HAD,no,N,70,,163155,27987,HEM
71,,SING,CAD,HADA,no,N,71,,163155,27987,HEM
72,,SING,CBD,CGD,no,N,72,,163155,27987,HEM
73,,SING,CBD,HBD,no,N,73,,163155,27987,HEM
74,,SING,CBD,HBDA,no,N,74,,163155,27987,HEM
75,,DOUB,CGD,O1D,no,N,75,,163155,27987,HEM
76,,SING,CGD,O2D,no,N,76,,163155,27987,HEM
77,,SING,O2A,H2A,no,N,77,,163155,27987,HEM
78,,SING,O2D,H2D,no,N,78,,163155,27987,HEM
79,,SING,FE,NA,no,N,79,,163155,27987,HEM
80,,SING,FE,NB,no,N,80,,163155,27987,HEM
81,,SING,FE,NC,no,N,81,,163155,27987,HEM
82,,SING,FE,ND,no,N,82,,163155,27987,HEM
1,,SING,N,CA,no,N,1,,163286,27995,SEP
2,,SING,N,H,no,N,2,,163286,27995,SEP
3,,SING,N,H2,no,N,3,,163286,27995,SEP
4,,SING,CA,CB,no,N,4,,163286,27995,SEP
5,,SING,CA,C,no,N,5,,163286,27995,SEP
6,,SING,CA,HA,no,N,6,,163286,27995,SEP
7,,SING,CB,OG,no,N,7,,163286,27995,SEP
8,,SING,CB,HB2,no,N,8,,163286,27995,SEP
9,,SING,CB,HB3,no,N,9,,163286,27995,SEP
10,,SING,OG,P,no,N,10,,163286,27995,SEP
11,,DOUB,C,O,no,N,11,,163286,27995,SEP
12,,SING,C,OXT,no,N,12,,163286,27995,SEP
13,,SING,OXT,HXT,no,N,13,,163286,27995,SEP
14,,DOUB,P,O1P,no,N,14,,163286,27995,SEP
15,,SING,P,O2P,no,N,15,,163286,27995,SEP
16,,SING,P,O3P,no,N,16,,163286,27995,SEP
17,,SING,O2P,HOP2,no,N,17,,163286,27995,SEP
18,,SING,O3P,HOP3,no,N,18,,163286,27995,SEP
1,,SING,N,CA,no,N,1,,163287,27995,TPO
2,,SING,N,H,no,N,2,,163287,27995,TPO
3,,SING,N,H2,no,N,3,,163287,27995,TPO
4,,SING,CA,CB,no,N,4,,163287,27995,TPO
5,,SING,CA,C,no,N,5,,163287,27995,TPO
6,,SING,CA,HA,no,N,6,,163287,27995,TPO
7,,SING,CB,CG2,no,N,7,,163287,27995,TPO
8,,SING,CB,OG1,no,N,8,,163287,27995,TPO
9,,SING,CB,HB,no,N,9,,163287,27995,TPO
10,,SING,CG2,HG21,no,N,10,,163287,27995,TPO
11,,SING,CG2,HG22,no,N,11,,163287,27995,TPO
12,,SING,CG2,HG23,no,N,12,,163287,27995,TPO
13,,SING,OG1,P,no,N,13,,163287,27995,TPO
14,,DOUB,P,O1P,no,N,14,,163287,27995,TPO
15,,SING,P,O2P,no,N,15,,163287,27995,TPO
16,,SING,P,O3P,no,N,16,,163287,27995,TPO
17,,SING,O2P,HOP2,no,N,17,,163287,27995,TPO
18,,SING,O3P,HOP3,no,N,18,,163287,27995,TPO
19,,DOUB,C,O,no,N,19,,163287,27995,TPO
20,,SING,C,OXT,no,N,20,,163287,27995,TPO
21,,SING,OXT,HXT,no,N,21,,163287,27995,TPO
1,,SING,FE1,S1,no,N,1,,163412,28002,FES
2,,SING,FE1,S2,no,N,2,,163412,28002,FES
3,,SING,FE2,S1,no,N,3,,163412,28002,FES
4,,SING,FE2,S2,no,N,4,,163412,28002,FES
1,,SING,FE1,S1,no,N,1,,163429,28003,FES
2,,SING,FE1,S2,no,N,2,,163429,28003,FES
3,,SING,FE2,S1,no,N,3,,163429,28003,FES
4,,SING,FE2,S2,no,N,4,,163429,28003,FES
1,,DOUB,PG,O1G,no,N,1,,163515,28015,GTP
2,,SING,PG,O2G,no,N,2,,163515,28015,GTP
3,,SING,PG,O3G,no,N,3,,163515,28015,GTP
4,,SING,PG,O3B,no,N,4,,163515,28015,GTP
5,,SING,O2G,HOG2,no,N,5,,163515,28015,GTP
6,,SING,O3G,HOG3,no,N,6,,163515,28015,GTP
7,,SING,O3B,PB,no,N,7,,163515,28015,GTP
8,,DOUB,PB,O1B,no,N,8,,163515,28015,GTP
9,,SING,PB,O2B,no,N,9,,163515,28015,GTP
10,,SING,PB,O3A,no,N,10,,163515,28015,GTP
11,,SING,O2B,HOB2,no,N,11,,163515,28015,GTP
12,,SING,O3A,PA,no,N,12,,163515,28015,GTP
13,,DOUB,PA,O1A,no,N,13,,163515,28015,GTP
14,,SING,PA,O2A,no,N,14,,163515,28015,GTP
15,,SING,PA,O5',no,N,15,,163515,28015,GTP
16,,SING,O2A,HOA2,no,N,16,,163515,28015,GTP
17,,SING,O5',C5',no,N,17,,163515,28015,GTP
18,,SING,C5',C4',no,N,18,,163515,28015,GTP
19,,SING,C5',H5',no,N,19,,163515,28015,GTP
20,,SING,C5',H5'',no,N,20,,163515,28015,GTP
21,,SING,C4',O4',no,N,21,,163515,28015,GTP
22,,SING,C4',C3',no,N,22,,163515,28015,GTP
23,,SING,C4',H4',no,N,23,,163515,28015,GTP
24,,SING,O4',C1',no,N,24,,163515,28015,GTP
25,,SING,C3',O3',no,N,25,,163515,28015,GTP
26,,SING,C3',C2',no,N,26,,163515,28015,GTP
27,,SING,C3',H3',no,N,27,,163515,28015,GTP
28,,SING,O3',HO3',no,N,28,,163515,28015,GTP
29,,SING,C2',O2',no,N,29,,163515,28015,GTP
30,,SING,C2',C1',no,N,30,,163515,28015,GTP
31,,SING,C2',H2',no,N,31,,163515,28015,GTP
32,,SING,O2',HO2',no,N,32,,163515,28015,GTP
33,,SING,C1',N9,no,N,33,,163515,28015,GTP
34,,SING,C1',H1',no,N,34,,163515,28015,GTP
35,,SING,N9,C8,yes,N,35,,163515,28015,GTP
36,,SING,N9,C4,yes,N,36,,163515,28015,GTP
37,,DOUB,C8,N7,yes,N,37,,163515,28015,GTP
38,,SING,C8,H8,no,N,38,,163515,28015,GTP
39,,SING,N7,C5,yes,N,39,,163515,28015,GTP
40,,SING,C5,C6,no,N,40,,163515,28015,GTP
41,,DOUB,C5,C4,yes,N,41,,163515,28015,GTP
42,,DOUB,C6,O6,no,N,42,,163515,28015,GTP
43,,SING,C6,N1,no,N,43,,163515,28015,GTP
44,,SING,N1,C2,no,N,44,,163515,28015,GTP
45,,SING,N1,HN1,no,N,45,,163515,28015,GTP
46,,SING,C2,N2,no,N,46,,163515,28015,GTP
47,,DOUB,C2,N3,no,N,47,,163515,28015,GTP
48,,SING,N2,HN21,no,N,48,,163515,28015,GTP
49,,SING,N2,HN22,no,N,49,,163515,28015,GTP
50,,SING,N3,C4,no,N,50,,163515,28015,GTP
1,,DOUB,C,O,no,N,1,,163583,2802,ACE
2,,SING,C,CH3,no,N,2,,163583,2802,ACE
3,,SING,C,H,no,N,3,,163583,2802,ACE
4,,SING,CH3,H1,no,N,4,,163583,2802,ACE
5,,SING,CH3,H2,no,N,5,,163583,2802,ACE
6,,SING,CH3,H3,no,N,6,,163583,2802,ACE
1,,SING,N,CA,no,N,1,,163584,2802,AIB
2,,SING,N,H,no,N,2,,163584,2802,AIB
3,,SING,N,H2,no,N,3,,163584,2802,AIB
4,,SING,CA,C,no,N,4,,163584,2802,AIB
5,,SING,CA,CB1,no,N,5,,163584,2802,AIB
6,,SING,CA,CB2,no,N,6,,163584,2802,AIB
7,,DOUB,C,O,no,N,7,,163584,2802,AIB
8,,SING,C,OXT,no,N,8,,163584,2802,AIB
9,,SING,OXT,HO2,no,N,9,,163584,2802,AIB
10,,SING,CB1,HB11,no,N,10,,163584,2802,AIB
11,,SING,CB1,HB12,no,N,11,,163584,2802,AIB
12,,SING,CB1,HB13,no,N,12,,163584,2802,AIB
13,,SING,CB2,HB21,no,N,13,,163584,2802,AIB
14,,SING,CB2,HB22,no,N,14,,163584,2802,AIB
15,,SING,CB2,HB23,no,N,15,,163584,2802,AIB
1,,SING,N,CA,no,N,1,,163585,2802,PHL
2,,SING,N,H,no,N,2,,163585,2802,PHL
3,,SING,N,H2,no,N,3,,163585,2802,PHL
4,,SING,CA,C,no,N,4,,163585,2802,PHL
5,,SING,CA,CB,no,N,5,,163585,2802,PHL
6,,SING,CA,HA,no,N,6,,163585,2802,PHL
7,,SING,C,O,no,N,7,,163585,2802,PHL
8,,SING,C,HC1,no,N,8,,163585,2802,PHL
9,,SING,C,HC2,no,N,9,,163585,2802,PHL
10,,SING,O,HO,no,N,10,,163585,2802,PHL
11,,SING,CB,CG,no,N,11,,163585,2802,PHL
12,,SING,CB,HB2,no,N,12,,163585,2802,PHL
13,,SING,CB,HB3,no,N,13,,163585,2802,PHL
14,,DOUB,CG,CD1,yes,N,14,,163585,2802,PHL
15,,SING,CG,CD2,yes,N,15,,163585,2802,PHL
16,,SING,CD1,CE1,yes,N,16,,163585,2802,PHL
17,,SING,CD1,HD1,no,N,17,,163585,2802,PHL
18,,DOUB,CD2,CE2,yes,N,18,,163585,2802,PHL
19,,SING,CD2,HD2,no,N,19,,163585,2802,PHL
20,,DOUB,CE1,CZ,yes,N,20,,163585,2802,PHL
21,,SING,CE1,HE1,no,N,21,,163585,2802,PHL
22,,SING,CE2,CZ,yes,N,22,,163585,2802,PHL
23,,SING,CE2,HE2,no,N,23,,163585,2802,PHL
24,,SING,CZ,HZ,no,N,24,,163585,2802,PHL
1,,DOUB,PG,O1G,no,N,1,,163619,28021,GTP
2,,SING,PG,O2G,no,N,2,,163619,28021,GTP
3,,SING,PG,O3G,no,N,3,,163619,28021,GTP
4,,SING,PG,O3B,no,N,4,,163619,28021,GTP
5,,SING,O2G,HOG2,no,N,5,,163619,28021,GTP
6,,SING,O3G,HOG3,no,N,6,,163619,28021,GTP
7,,SING,O3B,PB,no,N,7,,163619,28021,GTP
8,,DOUB,PB,O1B,no,N,8,,163619,28021,GTP
9,,SING,PB,O2B,no,N,9,,163619,28021,GTP
10,,SING,PB,O3A,no,N,10,,163619,28021,GTP
11,,SING,O2B,HOB2,no,N,11,,163619,28021,GTP
12,,SING,O3A,PA,no,N,12,,163619,28021,GTP
13,,DOUB,PA,O1A,no,N,13,,163619,28021,GTP
14,,SING,PA,O2A,no,N,14,,163619,28021,GTP
15,,SING,PA,O5',no,N,15,,163619,28021,GTP
16,,SING,O2A,HOA2,no,N,16,,163619,28021,GTP
17,,SING,O5',C5',no,N,17,,163619,28021,GTP
18,,SING,C5',C4',no,N,18,,163619,28021,GTP
19,,SING,C5',H5',no,N,19,,163619,28021,GTP
20,,SING,C5',H5'',no,N,20,,163619,28021,GTP
21,,SING,C4',O4',no,N,21,,163619,28021,GTP
22,,SING,C4',C3',no,N,22,,163619,28021,GTP
23,,SING,C4',H4',no,N,23,,163619,28021,GTP
24,,SING,O4',C1',no,N,24,,163619,28021,GTP
25,,SING,C3',O3',no,N,25,,163619,28021,GTP
26,,SING,C3',C2',no,N,26,,163619,28021,GTP
27,,SING,C3',H3',no,N,27,,163619,28021,GTP
28,,SING,O3',HO3',no,N,28,,163619,28021,GTP
29,,SING,C2',O2',no,N,29,,163619,28021,GTP
30,,SING,C2',C1',no,N,30,,163619,28021,GTP
31,,SING,C2',H2',no,N,31,,163619,28021,GTP
32,,SING,O2',HO2',no,N,32,,163619,28021,GTP
33,,SING,C1',N9,no,N,33,,163619,28021,GTP
34,,SING,C1',H1',no,N,34,,163619,28021,GTP
35,,SING,N9,C8,yes,N,35,,163619,28021,GTP
36,,SING,N9,C4,yes,N,36,,163619,28021,GTP
37,,DOUB,C8,N7,yes,N,37,,163619,28021,GTP
38,,SING,C8,H8,no,N,38,,163619,28021,GTP
39,,SING,N7,C5,yes,N,39,,163619,28021,GTP
40,,SING,C5,C6,no,N,40,,163619,28021,GTP
41,,DOUB,C5,C4,yes,N,41,,163619,28021,GTP
42,,DOUB,C6,O6,no,N,42,,163619,28021,GTP
43,,SING,C6,N1,no,N,43,,163619,28021,GTP
44,,SING,N1,C2,no,N,44,,163619,28021,GTP
45,,SING,N1,HN1,no,N,45,,163619,28021,GTP
46,,SING,C2,N2,no,N,46,,163619,28021,GTP
47,,DOUB,C2,N3,no,N,47,,163619,28021,GTP
48,,SING,N2,HN21,no,N,48,,163619,28021,GTP
49,,SING,N2,HN22,no,N,49,,163619,28021,GTP
50,,SING,N3,C4,no,N,50,,163619,28021,GTP
1,,DOUB,PG,O1G,no,N,1,,163638,28022,GTP
2,,SING,PG,O2G,no,N,2,,163638,28022,GTP
3,,SING,PG,O3G,no,N,3,,163638,28022,GTP
4,,SING,PG,O3B,no,N,4,,163638,28022,GTP
5,,SING,O2G,HOG2,no,N,5,,163638,28022,GTP
6,,SING,O3G,HOG3,no,N,6,,163638,28022,GTP
7,,SING,O3B,PB,no,N,7,,163638,28022,GTP
8,,DOUB,PB,O1B,no,N,8,,163638,28022,GTP
9,,SING,PB,O2B,no,N,9,,163638,28022,GTP
10,,SING,PB,O3A,no,N,10,,163638,28022,GTP
11,,SING,O2B,HOB2,no,N,11,,163638,28022,GTP
12,,SING,O3A,PA,no,N,12,,163638,28022,GTP
13,,DOUB,PA,O1A,no,N,13,,163638,28022,GTP
14,,SING,PA,O2A,no,N,14,,163638,28022,GTP
15,,SING,PA,O5',no,N,15,,163638,28022,GTP
16,,SING,O2A,HOA2,no,N,16,,163638,28022,GTP
17,,SING,O5',C5',no,N,17,,163638,28022,GTP
18,,SING,C5',C4',no,N,18,,163638,28022,GTP
19,,SING,C5',H5',no,N,19,,163638,28022,GTP
20,,SING,C5',H5'',no,N,20,,163638,28022,GTP
21,,SING,C4',O4',no,N,21,,163638,28022,GTP
22,,SING,C4',C3',no,N,22,,163638,28022,GTP
23,,SING,C4',H4',no,N,23,,163638,28022,GTP
24,,SING,O4',C1',no,N,24,,163638,28022,GTP
25,,SING,C3',O3',no,N,25,,163638,28022,GTP
26,,SING,C3',C2',no,N,26,,163638,28022,GTP
27,,SING,C3',H3',no,N,27,,163638,28022,GTP
28,,SING,O3',HO3',no,N,28,,163638,28022,GTP
29,,SING,C2',O2',no,N,29,,163638,28022,GTP
30,,SING,C2',C1',no,N,30,,163638,28022,GTP
31,,SING,C2',H2',no,N,31,,163638,28022,GTP
32,,SING,O2',HO2',no,N,32,,163638,28022,GTP
33,,SING,C1',N9,no,N,33,,163638,28022,GTP
34,,SING,C1',H1',no,N,34,,163638,28022,GTP
35,,SING,N9,C8,yes,N,35,,163638,28022,GTP
36,,SING,N9,C4,yes,N,36,,163638,28022,GTP
37,,DOUB,C8,N7,yes,N,37,,163638,28022,GTP
38,,SING,C8,H8,no,N,38,,163638,28022,GTP
39,,SING,N7,C5,yes,N,39,,163638,28022,GTP
40,,SING,C5,C6,no,N,40,,163638,28022,GTP
41,,DOUB,C5,C4,yes,N,41,,163638,28022,GTP
42,,DOUB,C6,O6,no,N,42,,163638,28022,GTP
43,,SING,C6,N1,no,N,43,,163638,28022,GTP
44,,SING,N1,C2,no,N,44,,163638,28022,GTP
45,,SING,N1,HN1,no,N,45,,163638,28022,GTP
46,,SING,C2,N2,no,N,46,,163638,28022,GTP
47,,DOUB,C2,N3,no,N,47,,163638,28022,GTP
48,,SING,N2,HN21,no,N,48,,163638,28022,GTP
49,,SING,N2,HN22,no,N,49,,163638,28022,GTP
50,,SING,N3,C4,no,N,50,,163638,28022,GTP
1,,DOUB,PG,O1G,no,N,1,,163915,28046,GNP
2,,SING,PG,O2G,no,N,2,,163915,28046,GNP
3,,SING,PG,O3G,no,N,3,,163915,28046,GNP
4,,SING,PG,N3B,no,N,4,,163915,28046,GNP
5,,SING,O2G,HOG2,no,N,5,,163915,28046,GNP
6,,SING,O3G,HOG3,no,N,6,,163915,28046,GNP
7,,SING,N3B,PB,no,N,7,,163915,28046,GNP
8,,SING,N3B,HNB3,no,N,8,,163915,28046,GNP
9,,DOUB,PB,O1B,no,N,9,,163915,28046,GNP
10,,SING,PB,O2B,no,N,10,,163915,28046,GNP
11,,SING,PB,O3A,no,N,11,,163915,28046,GNP
12,,SING,O2B,HOB2,no,N,12,,163915,28046,GNP
13,,SING,O3A,PA,no,N,13,,163915,28046,GNP
14,,DOUB,PA,O1A,no,N,14,,163915,28046,GNP
15,,SING,PA,O2A,no,N,15,,163915,28046,GNP
16,,SING,PA,O5',no,N,16,,163915,28046,GNP
17,,SING,O2A,HOA2,no,N,17,,163915,28046,GNP
18,,SING,O5',C5',no,N,18,,163915,28046,GNP
19,,SING,C5',C4',no,N,19,,163915,28046,GNP
20,,SING,C5',H5'2,no,N,20,,163915,28046,GNP
21,,SING,C5',H5'1,no,N,21,,163915,28046,GNP
22,,SING,C4',O4',no,N,22,,163915,28046,GNP
23,,SING,C4',C3',no,N,23,,163915,28046,GNP
24,,SING,C4',H4',no,N,24,,163915,28046,GNP
25,,SING,O4',C1',no,N,25,,163915,28046,GNP
26,,SING,C3',O3',no,N,26,,163915,28046,GNP
27,,SING,C3',C2',no,N,27,,163915,28046,GNP
28,,SING,C3',H3',no,N,28,,163915,28046,GNP
29,,SING,O3',HO3',no,N,29,,163915,28046,GNP
30,,SING,C2',O2',no,N,30,,163915,28046,GNP
31,,SING,C2',C1',no,N,31,,163915,28046,GNP
32,,SING,C2',H2',no,N,32,,163915,28046,GNP
33,,SING,O2',HO2',no,N,33,,163915,28046,GNP
34,,SING,C1',N9,no,N,34,,163915,28046,GNP
35,,SING,C1',H1',no,N,35,,163915,28046,GNP
36,,SING,N9,C8,yes,N,36,,163915,28046,GNP
37,,SING,N9,C4,yes,N,37,,163915,28046,GNP
38,,DOUB,C8,N7,yes,N,38,,163915,28046,GNP
39,,SING,C8,H8,no,N,39,,163915,28046,GNP
40,,SING,N7,C5,yes,N,40,,163915,28046,GNP
41,,SING,C5,C6,yes,N,41,,163915,28046,GNP
42,,DOUB,C5,C4,yes,N,42,,163915,28046,GNP
43,,DOUB,C6,O6,no,N,43,,163915,28046,GNP
44,,SING,C6,N1,yes,N,44,,163915,28046,GNP
45,,SING,N1,C2,yes,N,45,,163915,28046,GNP
46,,SING,N1,HN1,no,N,46,,163915,28046,GNP
47,,SING,C2,N2,no,N,47,,163915,28046,GNP
48,,DOUB,C2,N3,yes,N,48,,163915,28046,GNP
49,,SING,N2,HN21,no,N,49,,163915,28046,GNP
50,,SING,N2,HN22,no,N,50,,163915,28046,GNP
51,,SING,N3,C4,yes,N,51,,163915,28046,GNP
1,,DOUB,PB,O1B,no,N,1,,163934,28047,GDP
2,,SING,PB,O2B,no,N,2,,163934,28047,GDP
3,,SING,PB,O3B,no,N,3,,163934,28047,GDP
4,,SING,PB,O3A,no,N,4,,163934,28047,GDP
5,,SING,O2B,HOB2,no,N,5,,163934,28047,GDP
6,,SING,O3B,HOB3,no,N,6,,163934,28047,GDP
7,,SING,O3A,PA,no,N,7,,163934,28047,GDP
8,,DOUB,PA,O1A,no,N,8,,163934,28047,GDP
9,,SING,PA,O2A,no,N,9,,163934,28047,GDP
10,,SING,PA,O5',no,N,10,,163934,28047,GDP
11,,SING,O2A,HOA2,no,N,11,,163934,28047,GDP
12,,SING,O5',C5',no,N,12,,163934,28047,GDP
13,,SING,C5',C4',no,N,13,,163934,28047,GDP
14,,SING,C5',H5',no,N,14,,163934,28047,GDP
15,,SING,C5',H5'',no,N,15,,163934,28047,GDP
16,,SING,C4',O4',no,N,16,,163934,28047,GDP
17,,SING,C4',C3',no,N,17,,163934,28047,GDP
18,,SING,C4',H4',no,N,18,,163934,28047,GDP
19,,SING,O4',C1',no,N,19,,163934,28047,GDP
20,,SING,C3',O3',no,N,20,,163934,28047,GDP
21,,SING,C3',C2',no,N,21,,163934,28047,GDP
22,,SING,C3',H3',no,N,22,,163934,28047,GDP
23,,SING,O3',HO3',no,N,23,,163934,28047,GDP
24,,SING,C2',O2',no,N,24,,163934,28047,GDP
25,,SING,C2',C1',no,N,25,,163934,28047,GDP
26,,SING,C2',H2',no,N,26,,163934,28047,GDP
27,,SING,O2',HO2',no,N,27,,163934,28047,GDP
28,,SING,C1',N9,no,N,28,,163934,28047,GDP
29,,SING,C1',H1',no,N,29,,163934,28047,GDP
30,,SING,N9,C8,yes,N,30,,163934,28047,GDP
31,,SING,N9,C4,yes,N,31,,163934,28047,GDP
32,,DOUB,C8,N7,yes,N,32,,163934,28047,GDP
33,,SING,C8,H8,no,N,33,,163934,28047,GDP
34,,SING,N7,C5,yes,N,34,,163934,28047,GDP
35,,SING,C5,C6,no,N,35,,163934,28047,GDP
36,,DOUB,C5,C4,yes,N,36,,163934,28047,GDP
37,,DOUB,C6,O6,no,N,37,,163934,28047,GDP
38,,SING,C6,N1,no,N,38,,163934,28047,GDP
39,,SING,N1,C2,no,N,39,,163934,28047,GDP
40,,SING,N1,HN1,no,N,40,,163934,28047,GDP
41,,SING,C2,N2,no,N,41,,163934,28047,GDP
42,,DOUB,C2,N3,no,N,42,,163934,28047,GDP
43,,SING,N2,HN21,no,N,43,,163934,28047,GDP
44,,SING,N2,HN22,no,N,44,,163934,28047,GDP
45,,SING,N3,C4,no,N,45,,163934,28047,GDP
1,,DOUB,C1,C2,yes,N,1,,164081,28057,LCM
2,,SING,C1,C6,yes,N,2,,164081,28057,LCM
3,,SING,C2,C3,yes,N,3,,164081,28057,LCM
4,,SING,C2,O26,no,N,4,,164081,28057,LCM
5,,DOUB,C3,C4,yes,N,5,,164081,28057,LCM
6,,SING,C3,O25,no,N,6,,164081,28057,LCM
7,,SING,C4,C5,yes,N,7,,164081,28057,LCM
8,,SING,C4,C7,no,N,8,,164081,28057,LCM
9,,DOUB,C5,C6,yes,N,9,,164081,28057,LCM
10,,SING,C7,N8,no,N,10,,164081,28057,LCM
11,,DOUB,C7,O9,no,N,11,,164081,28057,LCM
12,,SING,N8,C10,no,N,12,,164081,28057,LCM
13,,SING,C10,C11,no,N,13,,164081,28057,LCM
14,,SING,C11,C12,no,N,14,,164081,28057,LCM
15,,SING,C12,C13,no,N,15,,164081,28057,LCM
16,,SING,C13,N14,no,N,16,,164081,28057,LCM
17,,SING,N14,C15,no,N,17,,164081,28057,LCM
18,,SING,C15,C16,no,N,18,,164081,28057,LCM
19,,DOUB,C15,O17,no,N,19,,164081,28057,LCM
20,,DOUB,C16,C18,yes,N,20,,164081,28057,LCM
21,,SING,C16,C22,yes,N,21,,164081,28057,LCM
22,,SING,C18,C19,yes,N,22,,164081,28057,LCM
23,,SING,C18,O23,no,N,23,,164081,28057,LCM
24,,DOUB,C19,C20,yes,N,24,,164081,28057,LCM
25,,SING,C19,O24,no,N,25,,164081,28057,LCM
26,,SING,C20,C21,yes,N,26,,164081,28057,LCM
27,,DOUB,C21,C22,yes,N,27,,164081,28057,LCM
28,,SING,C1,H1,no,N,28,,164081,28057,LCM
29,,SING,C5,H5,no,N,29,,164081,28057,LCM
30,,SING,C6,H6,no,N,30,,164081,28057,LCM
31,,SING,N8,HN8,no,N,31,,164081,28057,LCM
32,,SING,C10,H10,no,N,32,,164081,28057,LCM
33,,SING,C10,H10A,no,N,33,,164081,28057,LCM
34,,SING,C11,H11,no,N,34,,164081,28057,LCM
35,,SING,C11,H11A,no,N,35,,164081,28057,LCM
36,,SING,C12,H12,no,N,36,,164081,28057,LCM
37,,SING,C12,H12A,no,N,37,,164081,28057,LCM
38,,SING,C13,H13,no,N,38,,164081,28057,LCM
39,,SING,C13,H13A,no,N,39,,164081,28057,LCM
40,,SING,N14,HN14,no,N,40,,164081,28057,LCM
41,,SING,C20,H20,no,N,41,,164081,28057,LCM
42,,SING,C21,H21,no,N,42,,164081,28057,LCM
43,,SING,C22,H22,no,N,43,,164081,28057,LCM
44,,SING,O23,HO23,no,N,44,,164081,28057,LCM
45,,SING,O24,HO24,no,N,45,,164081,28057,LCM
46,,SING,O25,HO25,no,N,46,,164081,28057,LCM
47,,SING,O26,HO26,no,N,47,,164081,28057,LCM
1,,SING,N,CN,no,N,1,,164177,28066,BMT
2,,SING,N,CA,no,N,2,,164177,28066,BMT
3,,SING,N,H,no,N,3,,164177,28066,BMT
4,,SING,CN,HN1,no,N,4,,164177,28066,BMT
5,,SING,CN,HN2,no,N,5,,164177,28066,BMT
6,,SING,CN,HN3,no,N,6,,164177,28066,BMT
7,,SING,CA,C,no,N,7,,164177,28066,BMT
8,,SING,CA,CB,no,N,8,,164177,28066,BMT
9,,SING,CA,HA,no,N,9,,164177,28066,BMT
10,,DOUB,C,O,no,N,10,,164177,28066,BMT
11,,SING,C,OXT,no,N,11,,164177,28066,BMT
12,,SING,OXT,HXT,no,N,12,,164177,28066,BMT
13,,SING,CB,OG1,no,N,13,,164177,28066,BMT
14,,SING,CB,CG2,no,N,14,,164177,28066,BMT
15,,SING,CB,HB,no,N,15,,164177,28066,BMT
16,,SING,OG1,HG1,no,N,16,,164177,28066,BMT
17,,SING,CG2,CD1,no,N,17,,164177,28066,BMT
18,,SING,CG2,CD2,no,N,18,,164177,28066,BMT
19,,SING,CG2,HG2,no,N,19,,164177,28066,BMT
20,,SING,CD1,HD11,no,N,20,,164177,28066,BMT
21,,SING,CD1,HD12,no,N,21,,164177,28066,BMT
22,,SING,CD1,HD13,no,N,22,,164177,28066,BMT
23,,SING,CD2,CE,no,N,23,,164177,28066,BMT
24,,SING,CD2,HD22,no,N,24,,164177,28066,BMT
25,,SING,CD2,HD23,no,N,25,,164177,28066,BMT
26,,DOUB,CE,CZ,no,E,26,,164177,28066,BMT
27,,SING,CE,HE,no,N,27,,164177,28066,BMT
28,,SING,CZ,CH,no,N,28,,164177,28066,BMT
29,,SING,CZ,HZ,no,N,29,,164177,28066,BMT
30,,SING,CH,HH1,no,N,30,,164177,28066,BMT
31,,SING,CH,HH2,no,N,31,,164177,28066,BMT
32,,SING,CH,HH3,no,N,32,,164177,28066,BMT
1,,SING,N,CN,no,N,1,,164178,28066,MLE
2,,SING,N,CA,no,N,2,,164178,28066,MLE
3,,SING,N,H,no,N,3,,164178,28066,MLE
4,,SING,CN,HN1,no,N,4,,164178,28066,MLE
5,,SING,CN,HN2,no,N,5,,164178,28066,MLE
6,,SING,CN,HN3,no,N,6,,164178,28066,MLE
7,,SING,CA,CB,no,N,7,,164178,28066,MLE
8,,SING,CA,C,no,N,8,,164178,28066,MLE
9,,SING,CA,HA,no,N,9,,164178,28066,MLE
10,,SING,CB,CG,no,N,10,,164178,28066,MLE
11,,SING,CB,HB2,no,N,11,,164178,28066,MLE
12,,SING,CB,HB3,no,N,12,,164178,28066,MLE
13,,SING,CG,CD1,no,N,13,,164178,28066,MLE
14,,SING,CG,CD2,no,N,14,,164178,28066,MLE
15,,SING,CG,HG,no,N,15,,164178,28066,MLE
16,,SING,CD1,HD11,no,N,16,,164178,28066,MLE
17,,SING,CD1,HD12,no,N,17,,164178,28066,MLE
18,,SING,CD1,HD13,no,N,18,,164178,28066,MLE
19,,SING,CD2,HD21,no,N,19,,164178,28066,MLE
20,,SING,CD2,HD22,no,N,20,,164178,28066,MLE
21,,SING,CD2,HD23,no,N,21,,164178,28066,MLE
22,,DOUB,C,O,no,N,22,,164178,28066,MLE
23,,SING,C,OXT,no,N,23,,164178,28066,MLE
24,,SING,OXT,HXT,no,N,24,,164178,28066,MLE
1,,SING,N,CN,no,N,1,,164179,28066,MVA
2,,SING,N,CA,no,N,2,,164179,28066,MVA
3,,SING,N,H,no,N,3,,164179,28066,MVA
4,,SING,CN,HN1,no,N,4,,164179,28066,MVA
5,,SING,CN,HN2,no,N,5,,164179,28066,MVA
6,,SING,CN,HN3,no,N,6,,164179,28066,MVA
7,,SING,CA,CB,no,N,7,,164179,28066,MVA
8,,SING,CA,C,no,N,8,,164179,28066,MVA
9,,SING,CA,HA,no,N,9,,164179,28066,MVA
10,,SING,CB,CG1,no,N,10,,164179,28066,MVA
11,,SING,CB,CG2,no,N,11,,164179,28066,MVA
12,,SING,CB,HB,no,N,12,,164179,28066,MVA
13,,SING,CG1,HG11,no,N,13,,164179,28066,MVA
14,,SING,CG1,HG12,no,N,14,,164179,28066,MVA
15,,SING,CG1,HG13,no,N,15,,164179,28066,MVA
16,,SING,CG2,HG21,no,N,16,,164179,28066,MVA
17,,SING,CG2,HG22,no,N,17,,164179,28066,MVA
18,,SING,CG2,HG23,no,N,18,,164179,28066,MVA
19,,DOUB,C,O,no,N,19,,164179,28066,MVA
20,,SING,C,OXT,no,N,20,,164179,28066,MVA
21,,SING,OXT,HXT,no,N,21,,164179,28066,MVA
1,,SING,N,CA,no,N,1,,164180,28066,SAR
2,,SING,N,CN,no,N,2,,164180,28066,SAR
3,,SING,N,H,no,N,3,,164180,28066,SAR
4,,SING,CA,C,no,N,4,,164180,28066,SAR
5,,SING,CA,HA2,no,N,5,,164180,28066,SAR
6,,SING,CA,HA3,no,N,6,,164180,28066,SAR
7,,DOUB,C,O,no,N,7,,164180,28066,SAR
8,,SING,C,OXT,no,N,8,,164180,28066,SAR
9,,SING,CN,HN1,no,N,9,,164180,28066,SAR
10,,SING,CN,HN2,no,N,10,,164180,28066,SAR
11,,SING,CN,HN3,no,N,11,,164180,28066,SAR
12,,SING,OXT,HXT,no,N,12,,164180,28066,SAR
1,,SING,N,CA,no,N,1,,164181,28066,DAL
2,,SING,N,H,no,N,2,,164181,28066,DAL
3,,SING,N,H2,no,N,3,,164181,28066,DAL
4,,SING,CA,CB,no,N,4,,164181,28066,DAL
5,,SING,CA,C,no,N,5,,164181,28066,DAL
6,,SING,CA,HA,no,N,6,,164181,28066,DAL
7,,SING,CB,HB1,no,N,7,,164181,28066,DAL
8,,SING,CB,HB2,no,N,8,,164181,28066,DAL
9,,SING,CB,HB3,no,N,9,,164181,28066,DAL
10,,DOUB,C,O,no,N,10,,164181,28066,DAL
11,,SING,C,OXT,no,N,11,,164181,28066,DAL
12,,SING,OXT,HXT,no,N,12,,164181,28066,DAL
1,,SING,F1,MG,no,N,1,,164315,28097,MGF
2,,SING,MG,F2,no,N,2,,164315,28097,MGF
3,,SING,MG,F3,no,N,3,,164315,28097,MGF
1,,SING,C1,C2,no,N,1,,164316,28097,G6P
2,,SING,C1,O1,no,N,2,,164316,28097,G6P
3,,SING,C1,O5,no,N,3,,164316,28097,G6P
4,,SING,C1,H1,no,N,4,,164316,28097,G6P
5,,SING,C2,C3,no,N,5,,164316,28097,G6P
6,,SING,C2,O2,no,N,6,,164316,28097,G6P
7,,SING,C2,H2,no,N,7,,164316,28097,G6P
8,,SING,C3,C4,no,N,8,,164316,28097,G6P
9,,SING,C3,O3,no,N,9,,164316,28097,G6P
10,,SING,C3,H3,no,N,10,,164316,28097,G6P
11,,SING,C4,C5,no,N,11,,164316,28097,G6P
12,,SING,C4,O4,no,N,12,,164316,28097,G6P
13,,SING,C4,H4,no,N,13,,164316,28097,G6P
14,,SING,C5,C6,no,N,14,,164316,28097,G6P
15,,SING,C5,O5,no,N,15,,164316,28097,G6P
16,,SING,C5,H5,no,N,16,,164316,28097,G6P
17,,SING,C6,O6,no,N,17,,164316,28097,G6P
18,,SING,C6,H61,no,N,18,,164316,28097,G6P
19,,SING,C6,H62,no,N,19,,164316,28097,G6P
20,,SING,O1,HO1,no,N,20,,164316,28097,G6P
21,,SING,O2,HO2,no,N,21,,164316,28097,G6P
22,,SING,O3,HO3,no,N,22,,164316,28097,G6P
23,,SING,O4,HO4,no,N,23,,164316,28097,G6P
24,,SING,O6,P,no,N,24,,164316,28097,G6P
25,,SING,P,O1P,no,N,25,,164316,28097,G6P
26,,SING,P,O2P,no,N,26,,164316,28097,G6P
27,,DOUB,P,O3P,no,N,27,,164316,28097,G6P
28,,SING,O1P,HO1P,no,N,28,,164316,28097,G6P
29,,SING,O2P,HO2P,no,N,29,,164316,28097,G6P
1,,DOUB,C,O,no,N,1,,164435,28123,ACE
2,,SING,C,CH3,no,N,2,,164435,28123,ACE
3,,SING,C,H,no,N,3,,164435,28123,ACE
4,,SING,CH3,H1,no,N,4,,164435,28123,ACE
5,,SING,CH3,H2,no,N,5,,164435,28123,ACE
6,,SING,CH3,H3,no,N,6,,164435,28123,ACE
1,,SING,N,CA,no,N,1,,164436,28123,MHO
2,,SING,N,H,no,N,2,,164436,28123,MHO
3,,SING,N,H2,no,N,3,,164436,28123,MHO
4,,SING,CA,CB,no,N,4,,164436,28123,MHO
5,,SING,CA,C,no,N,5,,164436,28123,MHO
6,,SING,CA,HA,no,N,6,,164436,28123,MHO
7,,SING,CB,CG,no,N,7,,164436,28123,MHO
8,,SING,CB,HB2,no,N,8,,164436,28123,MHO
9,,SING,CB,HB3,no,N,9,,164436,28123,MHO
10,,SING,CG,SD,no,N,10,,164436,28123,MHO
11,,SING,CG,HG2,no,N,11,,164436,28123,MHO
12,,SING,CG,HG3,no,N,12,,164436,28123,MHO
13,,SING,SD,CE,no,N,13,,164436,28123,MHO
14,,DOUB,SD,OD1,no,N,14,,164436,28123,MHO
15,,SING,CE,HE1,no,N,15,,164436,28123,MHO
16,,SING,CE,HE2,no,N,16,,164436,28123,MHO
17,,SING,CE,HE3,no,N,17,,164436,28123,MHO
18,,DOUB,C,O,no,N,18,,164436,28123,MHO
19,,SING,C,OXT,no,N,19,,164436,28123,MHO
20,,SING,OXT,HXT,no,N,20,,164436,28123,MHO
1,,SING,N,HN1,no,N,1,,164437,28123,NH2
2,,SING,N,HN2,no,N,2,,164437,28123,NH2
1,,DOUB,C,O,no,N,1,,164457,28124,ACE
2,,SING,C,CH3,no,N,2,,164457,28124,ACE
3,,SING,C,H,no,N,3,,164457,28124,ACE
4,,SING,CH3,H1,no,N,4,,164457,28124,ACE
5,,SING,CH3,H2,no,N,5,,164457,28124,ACE
6,,SING,CH3,H3,no,N,6,,164457,28124,ACE
1,,SING,OAD,CZ3,no,N,1,,164458,28124,4PQ
2,,DOUB,CZ3,CE3,yes,N,2,,164458,28124,4PQ
3,,SING,CZ3,CH2,yes,N,3,,164458,28124,4PQ
4,,SING,CE3,CD2,yes,N,4,,164458,28124,4PQ
5,,DOUB,CH2,CZ2,yes,N,5,,164458,28124,4PQ
6,,DOUB,CD2,CE2,yes,N,6,,164458,28124,4PQ
7,,SING,CD2,CG,yes,N,7,,164458,28124,4PQ
8,,SING,CZ2,CE2,yes,N,8,,164458,28124,4PQ
9,,SING,CB,CG,no,N,9,,164458,28124,4PQ
10,,SING,CB,CA,no,N,10,,164458,28124,4PQ
11,,SING,CE2,NE1,yes,N,11,,164458,28124,4PQ
12,,SING,N,CA,no,N,12,,164458,28124,4PQ
13,,DOUB,CG,CD1,yes,N,13,,164458,28124,4PQ
14,,SING,CA,C,no,N,14,,164458,28124,4PQ
15,,SING,NE1,CD1,yes,N,15,,164458,28124,4PQ
16,,DOUB,C,O,no,N,16,,164458,28124,4PQ
17,,SING,C,OXT,no,N,17,,164458,28124,4PQ
18,,SING,N,H1,no,N,18,,164458,28124,4PQ
19,,SING,N,H2,no,N,19,,164458,28124,4PQ
20,,SING,CA,H4,no,N,20,,164458,28124,4PQ
21,,SING,CB,H5,no,N,21,,164458,28124,4PQ
22,,SING,CB,H6,no,N,22,,164458,28124,4PQ
23,,SING,CD1,H7,no,N,23,,164458,28124,4PQ
24,,SING,NE1,H8,no,N,24,,164458,28124,4PQ
25,,SING,CZ2,H9,no,N,25,,164458,28124,4PQ
26,,SING,CH2,H10,no,N,26,,164458,28124,4PQ
27,,SING,CE3,H11,no,N,27,,164458,28124,4PQ
28,,SING,OXT,HXT,no,N,28,,164458,28124,4PQ
29,,SING,OAD,H13,no,N,29,,164458,28124,4PQ
1,,SING,N,HN1,no,N,1,,164459,28124,NH2
2,,SING,N,HN2,no,N,2,,164459,28124,NH2
1,,DOUB,C,O,no,N,1,,164477,28125,ACE
2,,SING,C,CH3,no,N,2,,164477,28125,ACE
3,,SING,C,H,no,N,3,,164477,28125,ACE
4,,SING,CH3,H1,no,N,4,,164477,28125,ACE
5,,SING,CH3,H2,no,N,5,,164477,28125,ACE
6,,SING,CH3,H3,no,N,6,,164477,28125,ACE
1,,SING,CA,C,no,N,1,,164478,28125,KYN
2,,DOUB,O,C,no,N,2,,164478,28125,KYN
3,,SING,C,OXT,no,N,3,,164478,28125,KYN
4,,SING,N,CA,no,N,4,,164478,28125,KYN
5,,SING,N,H,no,N,5,,164478,28125,KYN
6,,SING,N,H2,no,N,6,,164478,28125,KYN
7,,SING,OXT,HXT,no,N,7,,164478,28125,KYN
8,,SING,CD2,C1,no,N,8,,164478,28125,KYN
9,,DOUB,O2,C1,no,N,9,,164478,28125,KYN
10,,SING,C1,CB,no,N,10,,164478,28125,KYN
11,,SING,CG,N1,no,N,11,,164478,28125,KYN
12,,SING,N1,HN1,no,N,12,,164478,28125,KYN
13,,SING,N1,HN1A,no,N,13,,164478,28125,KYN
14,,SING,CB,CA,no,N,14,,164478,28125,KYN
15,,SING,CA,HA,no,N,15,,164478,28125,KYN
16,,SING,CB,HB,no,N,16,,164478,28125,KYN
17,,SING,CB,HBA,no,N,17,,164478,28125,KYN
18,,DOUB,CD1,CG,yes,N,18,,164478,28125,KYN
19,,SING,CD2,CG,yes,N,19,,164478,28125,KYN
20,,DOUB,CZ,CE1,yes,N,20,,164478,28125,KYN
21,,SING,CZ,CE2,yes,N,21,,164478,28125,KYN
22,,SING,CZ,HZ,no,N,22,,164478,28125,KYN
23,,SING,CE1,CD1,yes,N,23,,164478,28125,KYN
24,,SING,CD1,HD1,no,N,24,,164478,28125,KYN
25,,DOUB,CE2,CD2,yes,N,25,,164478,28125,KYN
26,,SING,CE1,HE1,no,N,26,,164478,28125,KYN
27,,SING,CE2,HE2,no,N,27,,164478,28125,KYN
1,,SING,N,HN1,no,N,1,,164479,28125,NH2
2,,SING,N,HN2,no,N,2,,164479,28125,NH2
1,,DOUB,C,O,no,N,1,,164497,28126,ACE
2,,SING,C,CH3,no,N,2,,164497,28126,ACE
3,,SING,C,H,no,N,3,,164497,28126,ACE
4,,SING,CH3,H1,no,N,4,,164497,28126,ACE
5,,SING,CH3,H2,no,N,5,,164497,28126,ACE
6,,SING,CH3,H3,no,N,6,,164497,28126,ACE
1,,SING,N,CA,no,N,1,,164498,28126,MHO
2,,SING,N,H,no,N,2,,164498,28126,MHO
3,,SING,N,H2,no,N,3,,164498,28126,MHO
4,,SING,CA,CB,no,N,4,,164498,28126,MHO
5,,SING,CA,C,no,N,5,,164498,28126,MHO
6,,SING,CA,HA,no,N,6,,164498,28126,MHO
7,,SING,CB,CG,no,N,7,,164498,28126,MHO
8,,SING,CB,HB2,no,N,8,,164498,28126,MHO
9,,SING,CB,HB3,no,N,9,,164498,28126,MHO
10,,SING,CG,SD,no,N,10,,164498,28126,MHO
11,,SING,CG,HG2,no,N,11,,164498,28126,MHO
12,,SING,CG,HG3,no,N,12,,164498,28126,MHO
13,,SING,SD,CE,no,N,13,,164498,28126,MHO
14,,DOUB,SD,OD1,no,N,14,,164498,28126,MHO
15,,SING,CE,HE1,no,N,15,,164498,28126,MHO
16,,SING,CE,HE2,no,N,16,,164498,28126,MHO
17,,SING,CE,HE3,no,N,17,,164498,28126,MHO
18,,DOUB,C,O,no,N,18,,164498,28126,MHO
19,,SING,C,OXT,no,N,19,,164498,28126,MHO
20,,SING,OXT,HXT,no,N,20,,164498,28126,MHO
1,,SING,N,HN1,no,N,1,,164499,28126,NH2
2,,SING,N,HN2,no,N,2,,164499,28126,NH2
1,,DOUB,C,O,no,N,1,,164519,28127,ACE
2,,SING,C,CH3,no,N,2,,164519,28127,ACE
3,,SING,C,H,no,N,3,,164519,28127,ACE
4,,SING,CH3,H1,no,N,4,,164519,28127,ACE
5,,SING,CH3,H2,no,N,5,,164519,28127,ACE
6,,SING,CH3,H3,no,N,6,,164519,28127,ACE
1,,SING,N,CA,no,N,1,,164520,28127,MHO
2,,SING,N,H,no,N,2,,164520,28127,MHO
3,,SING,N,H2,no,N,3,,164520,28127,MHO
4,,SING,CA,CB,no,N,4,,164520,28127,MHO
5,,SING,CA,C,no,N,5,,164520,28127,MHO
6,,SING,CA,HA,no,N,6,,164520,28127,MHO
7,,SING,CB,CG,no,N,7,,164520,28127,MHO
8,,SING,CB,HB2,no,N,8,,164520,28127,MHO
9,,SING,CB,HB3,no,N,9,,164520,28127,MHO
10,,SING,CG,SD,no,N,10,,164520,28127,MHO
11,,SING,CG,HG2,no,N,11,,164520,28127,MHO
12,,SING,CG,HG3,no,N,12,,164520,28127,MHO
13,,SING,SD,CE,no,N,13,,164520,28127,MHO
14,,DOUB,SD,OD1,no,N,14,,164520,28127,MHO
15,,SING,CE,HE1,no,N,15,,164520,28127,MHO
16,,SING,CE,HE2,no,N,16,,164520,28127,MHO
17,,SING,CE,HE3,no,N,17,,164520,28127,MHO
18,,DOUB,C,O,no,N,18,,164520,28127,MHO
19,,SING,C,OXT,no,N,19,,164520,28127,MHO
20,,SING,OXT,HXT,no,N,20,,164520,28127,MHO
1,,SING,N,HN1,no,N,1,,164521,28127,NH2
2,,SING,N,HN2,no,N,2,,164521,28127,NH2
1,,DOUB,C,O,no,N,1,,164541,28128,ACE
2,,SING,C,CH3,no,N,2,,164541,28128,ACE
3,,SING,C,H,no,N,3,,164541,28128,ACE
4,,SING,CH3,H1,no,N,4,,164541,28128,ACE
5,,SING,CH3,H2,no,N,5,,164541,28128,ACE
6,,SING,CH3,H3,no,N,6,,164541,28128,ACE
1,,SING,N,CA,no,N,1,,164542,28128,OMT
2,,SING,N,H,no,N,2,,164542,28128,OMT
3,,SING,N,H2,no,N,3,,164542,28128,OMT
4,,SING,CA,CB,no,N,4,,164542,28128,OMT
5,,SING,CA,C,no,N,5,,164542,28128,OMT
6,,SING,CA,HA,no,N,6,,164542,28128,OMT
7,,SING,CB,CG,no,N,7,,164542,28128,OMT
8,,SING,CB,HB2,no,N,8,,164542,28128,OMT
9,,SING,CB,HB3,no,N,9,,164542,28128,OMT
10,,SING,CG,SD,no,N,10,,164542,28128,OMT
11,,SING,CG,HG2,no,N,11,,164542,28128,OMT
12,,SING,CG,HG3,no,N,12,,164542,28128,OMT
13,,SING,SD,CE,no,N,13,,164542,28128,OMT
14,,DOUB,SD,OD1,no,N,14,,164542,28128,OMT
15,,DOUB,SD,OD2,no,N,15,,164542,28128,OMT
16,,SING,CE,HE1,no,N,16,,164542,28128,OMT
17,,SING,CE,HE2,no,N,17,,164542,28128,OMT
18,,SING,CE,HE3,no,N,18,,164542,28128,OMT
19,,DOUB,C,O,no,N,19,,164542,28128,OMT
20,,SING,C,OXT,no,N,20,,164542,28128,OMT
21,,SING,OXT,HXT,no,N,21,,164542,28128,OMT
1,,SING,N,HN1,no,N,1,,164543,28128,NH2
2,,SING,N,HN2,no,N,2,,164543,28128,NH2
1,,DOUB,C,O,no,N,1,,164561,28129,ACE
2,,SING,C,CH3,no,N,2,,164561,28129,ACE
3,,SING,C,H,no,N,3,,164561,28129,ACE
4,,SING,CH3,H1,no,N,4,,164561,28129,ACE
5,,SING,CH3,H2,no,N,5,,164561,28129,ACE
6,,SING,CH3,H3,no,N,6,,164561,28129,ACE
1,,DOUB,O,C,no,N,1,,164562,28129,NFK
2,,SING,C,OXT,no,N,2,,164562,28129,NFK
3,,SING,C,CA,no,N,3,,164562,28129,NFK
4,,DOUB,OD1,CG,no,N,4,,164562,28129,NFK
5,,SING,CA,CB,no,N,5,,164562,28129,NFK
6,,SING,CA,N,no,N,6,,164562,28129,NFK
7,,SING,CG,CB,no,N,7,,164562,28129,NFK
8,,SING,CG,CD2,no,N,8,,164562,28129,NFK
9,,DOUB,CD2,CAJ,yes,N,9,,164562,28129,NFK
10,,SING,CD2,CAO,yes,N,10,,164562,28129,NFK
11,,SING,CAJ,CAH,yes,N,11,,164562,28129,NFK
12,,SING,NAL,CAO,no,N,12,,164562,28129,NFK
13,,SING,NAL,CAF,no,N,13,,164562,28129,NFK
14,,DOUB,CAO,CAI,yes,N,14,,164562,28129,NFK
15,,DOUB,CAH,CAG,yes,N,15,,164562,28129,NFK
16,,SING,CAI,CAG,yes,N,16,,164562,28129,NFK
17,,DOUB,CAF,OAB,no,N,17,,164562,28129,NFK
18,,SING,OXT,H1,no,N,18,,164562,28129,NFK
19,,SING,CA,H2,no,N,19,,164562,28129,NFK
20,,SING,N,H3,no,N,20,,164562,28129,NFK
21,,SING,N,H4,no,N,21,,164562,28129,NFK
22,,SING,CB,H6,no,N,22,,164562,28129,NFK
23,,SING,CB,H7,no,N,23,,164562,28129,NFK
24,,SING,CAJ,H8,no,N,24,,164562,28129,NFK
25,,SING,CAH,H9,no,N,25,,164562,28129,NFK
26,,SING,CAG,H10,no,N,26,,164562,28129,NFK
27,,SING,CAI,H11,no,N,27,,164562,28129,NFK
28,,SING,NAL,H12,no,N,28,,164562,28129,NFK
29,,SING,CAF,H13,no,N,29,,164562,28129,NFK
1,,SING,N,HN1,no,N,1,,164563,28129,NH2
2,,SING,N,HN2,no,N,2,,164563,28129,NH2
1,,DOUB,C,O,no,N,1,,164582,28130,ACE
2,,SING,C,CH3,no,N,2,,164582,28130,ACE
3,,SING,C,H,no,N,3,,164582,28130,ACE
4,,SING,CH3,H1,no,N,4,,164582,28130,ACE
5,,SING,CH3,H2,no,N,5,,164582,28130,ACE
6,,SING,CH3,H3,no,N,6,,164582,28130,ACE
1,,SING,N,HN1,no,N,1,,164583,28130,NH2
2,,SING,N,HN2,no,N,2,,164583,28130,NH2
1,,SING,C1,C2,no,N,1,,164691,285,AAC
2,,SING,C1,O1,no,N,2,,164691,285,AAC
3,,DOUB,C1,O2,no,N,3,,164691,285,AAC
4,,SING,C2,N1,no,N,4,,164691,285,AAC
5,,SING,C2,HC21,no,N,5,,164691,285,AAC
6,,SING,C2,HC22,no,N,6,,164691,285,AAC
7,,SING,C3,C4,no,N,7,,164691,285,AAC
8,,SING,C3,N1,no,N,8,,164691,285,AAC
9,,DOUB,C3,O3,no,N,9,,164691,285,AAC
10,,SING,C4,HC41,no,N,10,,164691,285,AAC
11,,SING,C4,HC42,no,N,11,,164691,285,AAC
12,,SING,C4,HC43,no,N,12,,164691,285,AAC
13,,SING,N1,HN1,no,N,13,,164691,285,AAC
14,,SING,O1,HO1,no,N,14,,164691,285,AAC
1,,SING,FE,NA,no,N,1,,164692,285,HEC
2,,SING,FE,NB,no,N,2,,164692,285,HEC
3,,SING,FE,NC,no,N,3,,164692,285,HEC
4,,SING,FE,ND,no,N,4,,164692,285,HEC
5,,DOUB,CHA,C1A,no,N,5,,164692,285,HEC
6,,SING,CHA,C4D,no,N,6,,164692,285,HEC
7,,SING,CHA,HHA,no,N,7,,164692,285,HEC
8,,DOUB,CHB,C4A,no,N,8,,164692,285,HEC
9,,SING,CHB,C1B,no,N,9,,164692,285,HEC
10,,SING,CHB,HHB,no,N,10,,164692,285,HEC
11,,DOUB,CHC,C4B,no,N,11,,164692,285,HEC
12,,SING,CHC,C1C,no,N,12,,164692,285,HEC
13,,SING,CHC,HHC,no,N,13,,164692,285,HEC
14,,DOUB,CHD,C4C,no,N,14,,164692,285,HEC
15,,SING,CHD,C1D,no,N,15,,164692,285,HEC
16,,SING,CHD,HHD,no,N,16,,164692,285,HEC
17,,SING,NA,C1A,yes,N,17,,164692,285,HEC
18,,SING,NA,C4A,yes,N,18,,164692,285,HEC
19,,SING,C1A,C2A,yes,N,19,,164692,285,HEC
20,,DOUB,C2A,C3A,yes,N,20,,164692,285,HEC
21,,SING,C2A,CAA,no,N,21,,164692,285,HEC
22,,SING,C3A,C4A,yes,N,22,,164692,285,HEC
23,,SING,C3A,CMA,no,N,23,,164692,285,HEC
24,,SING,CMA,HMA1,no,N,24,,164692,285,HEC
25,,SING,CMA,HMA2,no,N,25,,164692,285,HEC
26,,SING,CMA,HMA3,no,N,26,,164692,285,HEC
27,,SING,CAA,CBA,no,N,27,,164692,285,HEC
28,,SING,CAA,HAA1,no,N,28,,164692,285,HEC
29,,SING,CAA,HAA2,no,N,29,,164692,285,HEC
30,,SING,CBA,CGA,no,N,30,,164692,285,HEC
31,,SING,CBA,HBA1,no,N,31,,164692,285,HEC
32,,SING,CBA,HBA2,no,N,32,,164692,285,HEC
33,,DOUB,CGA,O1A,no,N,33,,164692,285,HEC
34,,SING,CGA,O2A,no,N,34,,164692,285,HEC
35,,SING,O2A,H2A,no,N,35,,164692,285,HEC
36,,SING,NB,C1B,yes,N,36,,164692,285,HEC
37,,SING,NB,C4B,yes,N,37,,164692,285,HEC
38,,DOUB,C1B,C2B,yes,N,38,,164692,285,HEC
39,,SING,C2B,C3B,yes,N,39,,164692,285,HEC
40,,SING,C2B,CMB,no,N,40,,164692,285,HEC
41,,SING,C3B,C4B,yes,N,41,,164692,285,HEC
42,,DOUB,C3B,CAB,no,E,42,,164692,285,HEC
43,,SING,CMB,HMB1,no,N,43,,164692,285,HEC
44,,SING,CMB,HMB2,no,N,44,,164692,285,HEC
45,,SING,CMB,HMB3,no,N,45,,164692,285,HEC
46,,SING,CAB,CBB,no,N,46,,164692,285,HEC
47,,SING,CAB,HAB,no,N,47,,164692,285,HEC
48,,SING,CBB,HBB1,no,N,48,,164692,285,HEC
49,,SING,CBB,HBB2,no,N,49,,164692,285,HEC
50,,SING,CBB,HBB3,no,N,50,,164692,285,HEC
51,,SING,NC,C1C,yes,N,51,,164692,285,HEC
52,,SING,NC,C4C,yes,N,52,,164692,285,HEC
53,,DOUB,C1C,C2C,yes,N,53,,164692,285,HEC
54,,SING,C2C,C3C,yes,N,54,,164692,285,HEC
55,,SING,C2C,CMC,no,N,55,,164692,285,HEC
56,,SING,C3C,C4C,yes,N,56,,164692,285,HEC
57,,DOUB,C3C,CAC,no,E,57,,164692,285,HEC
58,,SING,CMC,HMC1,no,N,58,,164692,285,HEC
59,,SING,CMC,HMC2,no,N,59,,164692,285,HEC
60,,SING,CMC,HMC3,no,N,60,,164692,285,HEC
61,,SING,CAC,CBC,no,N,61,,164692,285,HEC
62,,SING,CAC,HAC,no,N,62,,164692,285,HEC
63,,SING,CBC,HBC1,no,N,63,,164692,285,HEC
64,,SING,CBC,HBC2,no,N,64,,164692,285,HEC
65,,SING,CBC,HBC3,no,N,65,,164692,285,HEC
66,,SING,ND,C1D,yes,N,66,,164692,285,HEC
67,,SING,ND,C4D,yes,N,67,,164692,285,HEC
68,,DOUB,C1D,C2D,yes,N,68,,164692,285,HEC
69,,SING,C2D,C3D,yes,N,69,,164692,285,HEC
70,,SING,C2D,CMD,no,N,70,,164692,285,HEC
71,,DOUB,C3D,C4D,yes,N,71,,164692,285,HEC
72,,SING,C3D,CAD,no,N,72,,164692,285,HEC
73,,SING,CMD,HMD1,no,N,73,,164692,285,HEC
74,,SING,CMD,HMD2,no,N,74,,164692,285,HEC
75,,SING,CMD,HMD3,no,N,75,,164692,285,HEC
76,,SING,CAD,CBD,no,N,76,,164692,285,HEC
77,,SING,CAD,HAD1,no,N,77,,164692,285,HEC
78,,SING,CAD,HAD2,no,N,78,,164692,285,HEC
79,,SING,CBD,CGD,no,N,79,,164692,285,HEC
80,,SING,CBD,HBD1,no,N,80,,164692,285,HEC
81,,SING,CBD,HBD2,no,N,81,,164692,285,HEC
82,,DOUB,CGD,O1D,no,N,82,,164692,285,HEC
83,,SING,CGD,O2D,no,N,83,,164692,285,HEC
84,,SING,O2D,H2D,no,N,84,,164692,285,HEC
1,,SING,C1,C2,no,N,1,,164759,286,AAC
2,,SING,C1,O1,no,N,2,,164759,286,AAC
3,,DOUB,C1,O2,no,N,3,,164759,286,AAC
4,,SING,C2,N1,no,N,4,,164759,286,AAC
5,,SING,C2,HC21,no,N,5,,164759,286,AAC
6,,SING,C2,HC22,no,N,6,,164759,286,AAC
7,,SING,C3,C4,no,N,7,,164759,286,AAC
8,,SING,C3,N1,no,N,8,,164759,286,AAC
9,,DOUB,C3,O3,no,N,9,,164759,286,AAC
10,,SING,C4,HC41,no,N,10,,164759,286,AAC
11,,SING,C4,HC42,no,N,11,,164759,286,AAC
12,,SING,C4,HC43,no,N,12,,164759,286,AAC
13,,SING,N1,HN1,no,N,13,,164759,286,AAC
14,,SING,O1,HO1,no,N,14,,164759,286,AAC
1,,SING,FE,NA,no,N,1,,164760,286,HEC
2,,SING,FE,NB,no,N,2,,164760,286,HEC
3,,SING,FE,NC,no,N,3,,164760,286,HEC
4,,SING,FE,ND,no,N,4,,164760,286,HEC
5,,DOUB,CHA,C1A,no,N,5,,164760,286,HEC
6,,SING,CHA,C4D,no,N,6,,164760,286,HEC
7,,SING,CHA,HHA,no,N,7,,164760,286,HEC
8,,DOUB,CHB,C4A,no,N,8,,164760,286,HEC
9,,SING,CHB,C1B,no,N,9,,164760,286,HEC
10,,SING,CHB,HHB,no,N,10,,164760,286,HEC
11,,DOUB,CHC,C4B,no,N,11,,164760,286,HEC
12,,SING,CHC,C1C,no,N,12,,164760,286,HEC
13,,SING,CHC,HHC,no,N,13,,164760,286,HEC
14,,DOUB,CHD,C4C,no,N,14,,164760,286,HEC
15,,SING,CHD,C1D,no,N,15,,164760,286,HEC
16,,SING,CHD,HHD,no,N,16,,164760,286,HEC
17,,SING,NA,C1A,yes,N,17,,164760,286,HEC
18,,SING,NA,C4A,yes,N,18,,164760,286,HEC
19,,SING,C1A,C2A,yes,N,19,,164760,286,HEC
20,,DOUB,C2A,C3A,yes,N,20,,164760,286,HEC
21,,SING,C2A,CAA,no,N,21,,164760,286,HEC
22,,SING,C3A,C4A,yes,N,22,,164760,286,HEC
23,,SING,C3A,CMA,no,N,23,,164760,286,HEC
24,,SING,CMA,HMA1,no,N,24,,164760,286,HEC
25,,SING,CMA,HMA2,no,N,25,,164760,286,HEC
26,,SING,CMA,HMA3,no,N,26,,164760,286,HEC
27,,SING,CAA,CBA,no,N,27,,164760,286,HEC
28,,SING,CAA,HAA1,no,N,28,,164760,286,HEC
29,,SING,CAA,HAA2,no,N,29,,164760,286,HEC
30,,SING,CBA,CGA,no,N,30,,164760,286,HEC
31,,SING,CBA,HBA1,no,N,31,,164760,286,HEC
32,,SING,CBA,HBA2,no,N,32,,164760,286,HEC
33,,DOUB,CGA,O1A,no,N,33,,164760,286,HEC
34,,SING,CGA,O2A,no,N,34,,164760,286,HEC
35,,SING,O2A,H2A,no,N,35,,164760,286,HEC
36,,SING,NB,C1B,yes,N,36,,164760,286,HEC
37,,SING,NB,C4B,yes,N,37,,164760,286,HEC
38,,DOUB,C1B,C2B,yes,N,38,,164760,286,HEC
39,,SING,C2B,C3B,yes,N,39,,164760,286,HEC
40,,SING,C2B,CMB,no,N,40,,164760,286,HEC
41,,SING,C3B,C4B,yes,N,41,,164760,286,HEC
42,,DOUB,C3B,CAB,no,E,42,,164760,286,HEC
43,,SING,CMB,HMB1,no,N,43,,164760,286,HEC
44,,SING,CMB,HMB2,no,N,44,,164760,286,HEC
45,,SING,CMB,HMB3,no,N,45,,164760,286,HEC
46,,SING,CAB,CBB,no,N,46,,164760,286,HEC
47,,SING,CAB,HAB,no,N,47,,164760,286,HEC
48,,SING,CBB,HBB1,no,N,48,,164760,286,HEC
49,,SING,CBB,HBB2,no,N,49,,164760,286,HEC
50,,SING,CBB,HBB3,no,N,50,,164760,286,HEC
51,,SING,NC,C1C,yes,N,51,,164760,286,HEC
52,,SING,NC,C4C,yes,N,52,,164760,286,HEC
53,,DOUB,C1C,C2C,yes,N,53,,164760,286,HEC
54,,SING,C2C,C3C,yes,N,54,,164760,286,HEC
55,,SING,C2C,CMC,no,N,55,,164760,286,HEC
56,,SING,C3C,C4C,yes,N,56,,164760,286,HEC
57,,DOUB,C3C,CAC,no,E,57,,164760,286,HEC
58,,SING,CMC,HMC1,no,N,58,,164760,286,HEC
59,,SING,CMC,HMC2,no,N,59,,164760,286,HEC
60,,SING,CMC,HMC3,no,N,60,,164760,286,HEC
61,,SING,CAC,CBC,no,N,61,,164760,286,HEC
62,,SING,CAC,HAC,no,N,62,,164760,286,HEC
63,,SING,CBC,HBC1,no,N,63,,164760,286,HEC
64,,SING,CBC,HBC2,no,N,64,,164760,286,HEC
65,,SING,CBC,HBC3,no,N,65,,164760,286,HEC
66,,SING,ND,C1D,yes,N,66,,164760,286,HEC
67,,SING,ND,C4D,yes,N,67,,164760,286,HEC
68,,DOUB,C1D,C2D,yes,N,68,,164760,286,HEC
69,,SING,C2D,C3D,yes,N,69,,164760,286,HEC
70,,SING,C2D,CMD,no,N,70,,164760,286,HEC
71,,DOUB,C3D,C4D,yes,N,71,,164760,286,HEC
72,,SING,C3D,CAD,no,N,72,,164760,286,HEC
73,,SING,CMD,HMD1,no,N,73,,164760,286,HEC
74,,SING,CMD,HMD2,no,N,74,,164760,286,HEC
75,,SING,CMD,HMD3,no,N,75,,164760,286,HEC
76,,SING,CAD,CBD,no,N,76,,164760,286,HEC
77,,SING,CAD,HAD1,no,N,77,,164760,286,HEC
78,,SING,CAD,HAD2,no,N,78,,164760,286,HEC
79,,SING,CBD,CGD,no,N,79,,164760,286,HEC
80,,SING,CBD,HBD1,no,N,80,,164760,286,HEC
81,,SING,CBD,HBD2,no,N,81,,164760,286,HEC
82,,DOUB,CGD,O1D,no,N,82,,164760,286,HEC
83,,SING,CGD,O2D,no,N,83,,164760,286,HEC
84,,SING,O2D,H2D,no,N,84,,164760,286,HEC
1,,SING,N,CN,no,N,1,,164813,289,THC
2,,SING,N,CA,no,N,2,,164813,289,THC
3,,SING,N,H,no,N,3,,164813,289,THC
4,,DOUB,CN,ON,no,N,4,,164813,289,THC
5,,SING,CN,CM,no,N,5,,164813,289,THC
6,,SING,CM,HM1,no,N,6,,164813,289,THC
7,,SING,CM,HM2,no,N,7,,164813,289,THC
8,,SING,CM,HM3,no,N,8,,164813,289,THC
9,,SING,CA,CB,no,N,9,,164813,289,THC
10,,SING,CA,C,no,N,10,,164813,289,THC
11,,SING,CA,HA,no,N,11,,164813,289,THC
12,,SING,CB,OG1,no,N,12,,164813,289,THC
13,,SING,CB,CG2,no,N,13,,164813,289,THC
14,,SING,CB,HB,no,N,14,,164813,289,THC
15,,SING,OG1,HG1,no,N,15,,164813,289,THC
16,,SING,CG2,HG21,no,N,16,,164813,289,THC
17,,SING,CG2,HG22,no,N,17,,164813,289,THC
18,,SING,CG2,HG23,no,N,18,,164813,289,THC
19,,DOUB,C,O,no,N,19,,164813,289,THC
20,,SING,C,OXT,no,N,20,,164813,289,THC
21,,SING,OXT,HXT,no,N,21,,164813,289,THC
1,,SING,N,CA,no,N,1,,165100,2960,NLE
2,,SING,N,H,no,N,2,,165100,2960,NLE
3,,SING,N,HN2,no,N,3,,165100,2960,NLE
4,,SING,CA,C,no,N,4,,165100,2960,NLE
5,,SING,CA,CB,no,N,5,,165100,2960,NLE
6,,SING,CA,HA,no,N,6,,165100,2960,NLE
7,,DOUB,C,O,no,N,7,,165100,2960,NLE
8,,SING,C,OXT,no,N,8,,165100,2960,NLE
9,,SING,OXT,HXT,no,N,9,,165100,2960,NLE
10,,SING,CB,CG,no,N,10,,165100,2960,NLE
11,,SING,CB,HB2,no,N,11,,165100,2960,NLE
12,,SING,CB,HB3,no,N,12,,165100,2960,NLE
13,,SING,CG,CD,no,N,13,,165100,2960,NLE
14,,SING,CG,HG2,no,N,14,,165100,2960,NLE
15,,SING,CG,HG3,no,N,15,,165100,2960,NLE
16,,SING,CD,CE,no,N,16,,165100,2960,NLE
17,,SING,CD,HD2,no,N,17,,165100,2960,NLE
18,,SING,CD,HD3,no,N,18,,165100,2960,NLE
19,,SING,CE,HE1,no,N,19,,165100,2960,NLE
20,,SING,CE,HE2,no,N,20,,165100,2960,NLE
21,,SING,CE,HE3,no,N,21,,165100,2960,NLE
1,,SING,N,CA,no,N,1,,165101,2960,AAR
2,,SING,N,H,no,N,2,,165101,2960,AAR
3,,SING,N,H2,no,N,3,,165101,2960,AAR
4,,SING,CA,CB,no,N,4,,165101,2960,AAR
5,,SING,CA,C,no,N,5,,165101,2960,AAR
6,,SING,CA,HA,no,N,6,,165101,2960,AAR
7,,SING,CB,CG,no,N,7,,165101,2960,AAR
8,,SING,CB,HB2,no,N,8,,165101,2960,AAR
9,,SING,CB,HB3,no,N,9,,165101,2960,AAR
10,,SING,CG,CD,no,N,10,,165101,2960,AAR
11,,SING,CG,HG2,no,N,11,,165101,2960,AAR
12,,SING,CG,HG3,no,N,12,,165101,2960,AAR
13,,SING,CD,NE,no,N,13,,165101,2960,AAR
14,,SING,CD,HD2,no,N,14,,165101,2960,AAR
15,,SING,CD,HD3,no,N,15,,165101,2960,AAR
16,,SING,NE,CZ,no,N,16,,165101,2960,AAR
17,,SING,NE,HE,no,N,17,,165101,2960,AAR
18,,SING,CZ,NH1,no,N,18,,165101,2960,AAR
19,,DOUB,CZ,NH2,no,N,19,,165101,2960,AAR
20,,SING,NH1,HH11,no,N,20,,165101,2960,AAR
21,,SING,NH1,HH12,no,N,21,,165101,2960,AAR
22,,SING,NH2,HH21,no,N,22,,165101,2960,AAR
23,,SING,NH2,HH22,no,N,23,,165101,2960,AAR
24,,DOUB,C,O,no,N,24,,165101,2960,AAR
25,,SING,C,NT,no,N,25,,165101,2960,AAR
26,,SING,NT,HNT1,no,N,26,,165101,2960,AAR
27,,SING,NT,HNT2,no,N,27,,165101,2960,AAR
1,,SING,FE,NA,no,N,1,,165116,2968,HEC
2,,SING,FE,NB,no,N,2,,165116,2968,HEC
3,,SING,FE,NC,no,N,3,,165116,2968,HEC
4,,SING,FE,ND,no,N,4,,165116,2968,HEC
5,,DOUB,CHA,C1A,no,N,5,,165116,2968,HEC
6,,SING,CHA,C4D,no,N,6,,165116,2968,HEC
7,,SING,CHA,HHA,no,N,7,,165116,2968,HEC
8,,DOUB,CHB,C4A,no,N,8,,165116,2968,HEC
9,,SING,CHB,C1B,no,N,9,,165116,2968,HEC
10,,SING,CHB,HHB,no,N,10,,165116,2968,HEC
11,,DOUB,CHC,C4B,no,N,11,,165116,2968,HEC
12,,SING,CHC,C1C,no,N,12,,165116,2968,HEC
13,,SING,CHC,HHC,no,N,13,,165116,2968,HEC
14,,DOUB,CHD,C4C,no,N,14,,165116,2968,HEC
15,,SING,CHD,C1D,no,N,15,,165116,2968,HEC
16,,SING,CHD,HHD,no,N,16,,165116,2968,HEC
17,,SING,NA,C1A,yes,N,17,,165116,2968,HEC
18,,SING,NA,C4A,yes,N,18,,165116,2968,HEC
19,,SING,C1A,C2A,yes,N,19,,165116,2968,HEC
20,,DOUB,C2A,C3A,yes,N,20,,165116,2968,HEC
21,,SING,C2A,CAA,no,N,21,,165116,2968,HEC
22,,SING,C3A,C4A,yes,N,22,,165116,2968,HEC
23,,SING,C3A,CMA,no,N,23,,165116,2968,HEC
24,,SING,CMA,HMA1,no,N,24,,165116,2968,HEC
25,,SING,CMA,HMA2,no,N,25,,165116,2968,HEC
26,,SING,CMA,HMA3,no,N,26,,165116,2968,HEC
27,,SING,CAA,CBA,no,N,27,,165116,2968,HEC
28,,SING,CAA,HAA1,no,N,28,,165116,2968,HEC
29,,SING,CAA,HAA2,no,N,29,,165116,2968,HEC
30,,SING,CBA,CGA,no,N,30,,165116,2968,HEC
31,,SING,CBA,HBA1,no,N,31,,165116,2968,HEC
32,,SING,CBA,HBA2,no,N,32,,165116,2968,HEC
33,,DOUB,CGA,O1A,no,N,33,,165116,2968,HEC
34,,SING,CGA,O2A,no,N,34,,165116,2968,HEC
35,,SING,O2A,H2A,no,N,35,,165116,2968,HEC
36,,SING,NB,C1B,yes,N,36,,165116,2968,HEC
37,,SING,NB,C4B,yes,N,37,,165116,2968,HEC
38,,DOUB,C1B,C2B,yes,N,38,,165116,2968,HEC
39,,SING,C2B,C3B,yes,N,39,,165116,2968,HEC
40,,SING,C2B,CMB,no,N,40,,165116,2968,HEC
41,,SING,C3B,C4B,yes,N,41,,165116,2968,HEC
42,,DOUB,C3B,CAB,no,E,42,,165116,2968,HEC
43,,SING,CMB,HMB1,no,N,43,,165116,2968,HEC
44,,SING,CMB,HMB2,no,N,44,,165116,2968,HEC
45,,SING,CMB,HMB3,no,N,45,,165116,2968,HEC
46,,SING,CAB,CBB,no,N,46,,165116,2968,HEC
47,,SING,CAB,HAB,no,N,47,,165116,2968,HEC
48,,SING,CBB,HBB1,no,N,48,,165116,2968,HEC
49,,SING,CBB,HBB2,no,N,49,,165116,2968,HEC
50,,SING,CBB,HBB3,no,N,50,,165116,2968,HEC
51,,SING,NC,C1C,yes,N,51,,165116,2968,HEC
52,,SING,NC,C4C,yes,N,52,,165116,2968,HEC
53,,DOUB,C1C,C2C,yes,N,53,,165116,2968,HEC
54,,SING,C2C,C3C,yes,N,54,,165116,2968,HEC
55,,SING,C2C,CMC,no,N,55,,165116,2968,HEC
56,,SING,C3C,C4C,yes,N,56,,165116,2968,HEC
57,,DOUB,C3C,CAC,no,E,57,,165116,2968,HEC
58,,SING,CMC,HMC1,no,N,58,,165116,2968,HEC
59,,SING,CMC,HMC2,no,N,59,,165116,2968,HEC
60,,SING,CMC,HMC3,no,N,60,,165116,2968,HEC
61,,SING,CAC,CBC,no,N,61,,165116,2968,HEC
62,,SING,CAC,HAC,no,N,62,,165116,2968,HEC
63,,SING,CBC,HBC1,no,N,63,,165116,2968,HEC
64,,SING,CBC,HBC2,no,N,64,,165116,2968,HEC
65,,SING,CBC,HBC3,no,N,65,,165116,2968,HEC
66,,SING,ND,C1D,yes,N,66,,165116,2968,HEC
67,,SING,ND,C4D,yes,N,67,,165116,2968,HEC
68,,DOUB,C1D,C2D,yes,N,68,,165116,2968,HEC
69,,SING,C2D,C3D,yes,N,69,,165116,2968,HEC
70,,SING,C2D,CMD,no,N,70,,165116,2968,HEC
71,,DOUB,C3D,C4D,yes,N,71,,165116,2968,HEC
72,,SING,C3D,CAD,no,N,72,,165116,2968,HEC
73,,SING,CMD,HMD1,no,N,73,,165116,2968,HEC
74,,SING,CMD,HMD2,no,N,74,,165116,2968,HEC
75,,SING,CMD,HMD3,no,N,75,,165116,2968,HEC
76,,SING,CAD,CBD,no,N,76,,165116,2968,HEC
77,,SING,CAD,HAD1,no,N,77,,165116,2968,HEC
78,,SING,CAD,HAD2,no,N,78,,165116,2968,HEC
79,,SING,CBD,CGD,no,N,79,,165116,2968,HEC
80,,SING,CBD,HBD1,no,N,80,,165116,2968,HEC
81,,SING,CBD,HBD2,no,N,81,,165116,2968,HEC
82,,DOUB,CGD,O1D,no,N,82,,165116,2968,HEC
83,,SING,CGD,O2D,no,N,83,,165116,2968,HEC
84,,SING,O2D,H2D,no,N,84,,165116,2968,HEC
1,,SING,OOH,Coo,no,N,1,,165182,3,S_Ppt
2,,DOUB,=O,Coo,no,N,1,,165182,3,S_Ppt
3,,SING,Coo,Ca,no,N,1,,165182,3,S_Ppt
4,,SING,Ca,Ha,no,N,1,,165182,3,S_Ppt
5,,SING,Ca,N,no,N,1,,165182,3,S_Ppt
6,,SING,N,NH,no,N,1,,165182,3,S_Ppt
7,,SING,N,NH,no,N,1,,165182,3,S_Ppt
8,,SING,N,NH,no,N,1,,165182,3,S_Ppt
9,,SING,Ca,Cb,no,N,1,,165182,3,S_Ppt
10,,SING,Cb,Hb2,no,N,1,,165182,3,S_Ppt
11,,SING,Cb,Hb3,no,N,1,,165182,3,S_Ppt
12,,SING,Cb,Og,no,N,1,,165182,3,S_Ppt
1,,DOUB,P24,O26,no,N,1,,165354,30006,66S
2,,SING,P24,O23,no,N,2,,165354,30006,66S
3,,SING,P24,O27,no,N,3,,165354,30006,66S
4,,SING,O27,C28,no,N,4,,165354,30006,66S
5,,SING,C28,C29,no,N,5,,165354,30006,66S
6,,SING,C29,C30,no,N,6,,165354,30006,66S
7,,SING,C29,C31,no,N,7,,165354,30006,66S
8,,SING,C29,C32,no,N,8,,165354,30006,66S
9,,SING,C32,O33,no,N,9,,165354,30006,66S
10,,SING,C32,C34,no,N,10,,165354,30006,66S
11,,DOUB,C34,O35,no,N,11,,165354,30006,66S
12,,SING,C34,N36,no,N,12,,165354,30006,66S
13,,SING,N36,C37,no,N,13,,165354,30006,66S
14,,SING,C37,C38,no,N,14,,165354,30006,66S
15,,SING,C38,C39,no,N,15,,165354,30006,66S
16,,DOUB,C39,O40,no,N,16,,165354,30006,66S
17,,SING,C39,N41,no,N,17,,165354,30006,66S
18,,SING,N41,C42,no,N,18,,165354,30006,66S
19,,SING,C42,C43,no,N,19,,165354,30006,66S
20,,SING,C43,S1,no,N,20,,165354,30006,66S
21,,SING,S1,C1,no,N,21,,165354,30006,66S
22,,DOUB,C1,O1,no,N,22,,165354,30006,66S
23,,SING,C1,C2,no,N,23,,165354,30006,66S
24,,SING,C2,C3,no,N,24,,165354,30006,66S
25,,SING,C3,C4,no,N,25,,165354,30006,66S
26,,SING,C4,C5,no,N,26,,165354,30006,66S
27,,SING,C5,C6,no,N,27,,165354,30006,66S
28,,SING,C6,C7,no,N,28,,165354,30006,66S
29,,SING,C7,C8,no,N,29,,165354,30006,66S
30,,SING,O23,H1,no,N,30,,165354,30006,66S
31,,SING,C28,H28,no,N,31,,165354,30006,66S
32,,SING,C28,H28A,no,N,32,,165354,30006,66S
33,,SING,C30,H30,no,N,33,,165354,30006,66S
34,,SING,C30,H30A,no,N,34,,165354,30006,66S
35,,SING,C30,H30B,no,N,35,,165354,30006,66S
36,,SING,C31,H31,no,N,36,,165354,30006,66S
37,,SING,C31,H31A,no,N,37,,165354,30006,66S
38,,SING,C31,H31B,no,N,38,,165354,30006,66S
39,,SING,C32,H32,no,N,39,,165354,30006,66S
40,,SING,O33,HO33,no,N,40,,165354,30006,66S
41,,SING,N36,HN36,no,N,41,,165354,30006,66S
42,,SING,C37,H37,no,N,42,,165354,30006,66S
43,,SING,C37,H37A,no,N,43,,165354,30006,66S
44,,SING,C38,H38,no,N,44,,165354,30006,66S
45,,SING,C38,H38A,no,N,45,,165354,30006,66S
46,,SING,N41,HN41,no,N,46,,165354,30006,66S
47,,SING,C42,H42,no,N,47,,165354,30006,66S
48,,SING,C42,H42A,no,N,48,,165354,30006,66S
49,,SING,C43,H43,no,N,49,,165354,30006,66S
50,,SING,C43,H43A,no,N,50,,165354,30006,66S
51,,SING,C2,H2,no,N,51,,165354,30006,66S
52,,SING,C2,H2A,no,N,52,,165354,30006,66S
53,,SING,C3,H3,no,N,53,,165354,30006,66S
54,,SING,C3,H3A,no,N,54,,165354,30006,66S
55,,SING,C4,H4,no,N,55,,165354,30006,66S
56,,SING,C4,H4A,no,N,56,,165354,30006,66S
57,,SING,C5,H5,no,N,57,,165354,30006,66S
58,,SING,C5,H5A,no,N,58,,165354,30006,66S
59,,SING,C6,H6,no,N,59,,165354,30006,66S
60,,SING,C6,H6A,no,N,60,,165354,30006,66S
61,,SING,C7,H7,no,N,61,,165354,30006,66S
62,,SING,C7,H7A,no,N,62,,165354,30006,66S
63,,SING,C8,H8,no,N,63,,165354,30006,66S
64,,SING,C8,H8A,no,N,64,,165354,30006,66S
65,,SING,C8,H8B,no,N,65,,165354,30006,66S
66,,SING,P24,OP3,no,N,66,,165354,30006,66S
67,,SING,OP3,HOP3,no,N,67,,165354,30006,66S
1,,DOUB,O1',C1',no,N,1,,165504,30015,63T
2,,SING,C2',C1',no,N,2,,165504,30015,63T
3,,SING,C2',C3',no,N,3,,165504,30015,63T
4,,SING,C1',O4',no,N,4,,165504,30015,63T
5,,SING,O3',C3',no,N,5,,165504,30015,63T
6,,SING,C3',C4',no,N,6,,165504,30015,63T
7,,SING,O4',C4',no,N,7,,165504,30015,63T
8,,SING,C4',C5',no,N,8,,165504,30015,63T
9,,SING,O5',C5',no,N,9,,165504,30015,63T
10,,SING,O5',P,no,N,10,,165504,30015,63T
11,,DOUB,O1P,P,no,N,11,,165504,30015,63T
12,,SING,P,O2P,no,N,12,,165504,30015,63T
13,,SING,P,O1,no,N,13,,165504,30015,63T
14,,SING,C5',H5'1,no,N,14,,165504,30015,63T
15,,SING,C5',H5'2,no,N,15,,165504,30015,63T
16,,SING,C4',H4',no,N,16,,165504,30015,63T
17,,SING,C3',H3',no,N,17,,165504,30015,63T
18,,SING,O3',H1,no,N,18,,165504,30015,63T
19,,SING,C2',H2'2,no,N,19,,165504,30015,63T
20,,SING,C2',H2'1,no,N,20,,165504,30015,63T
21,,SING,O2P,H2,no,N,21,,165504,30015,63T
22,,SING,O1,H3,no,N,22,,165504,30015,63T
1,,SING,OP3,P,no,N,1,,165505,30015,8OG
2,,SING,OP3,HOP3,no,N,2,,165505,30015,8OG
3,,DOUB,P,OP1,no,N,3,,165505,30015,8OG
4,,SING,P,OP2,no,N,4,,165505,30015,8OG
5,,SING,P,O5',no,N,5,,165505,30015,8OG
6,,SING,OP2,HOP2,no,N,6,,165505,30015,8OG
7,,SING,O5',C5',no,N,7,,165505,30015,8OG
8,,SING,C5',C4',no,N,8,,165505,30015,8OG
9,,SING,C5',H5',no,N,9,,165505,30015,8OG
10,,SING,C5',H5'',no,N,10,,165505,30015,8OG
11,,SING,C4',O4',no,N,11,,165505,30015,8OG
12,,SING,C4',C3',no,N,12,,165505,30015,8OG
13,,SING,C4',H4',no,N,13,,165505,30015,8OG
14,,SING,O4',C1',no,N,14,,165505,30015,8OG
15,,SING,C3',O3',no,N,15,,165505,30015,8OG
16,,SING,C3',C2',no,N,16,,165505,30015,8OG
17,,SING,C3',H3',no,N,17,,165505,30015,8OG
18,,SING,O3',HO3',no,N,18,,165505,30015,8OG
19,,SING,C2',C1',no,N,19,,165505,30015,8OG
20,,SING,C2',H2',no,N,20,,165505,30015,8OG
21,,SING,C2',H2'',no,N,21,,165505,30015,8OG
22,,SING,C1',N9,no,N,22,,165505,30015,8OG
23,,SING,C1',H1',no,N,23,,165505,30015,8OG
24,,SING,N9,C8,no,N,24,,165505,30015,8OG
25,,SING,N9,C4,no,N,25,,165505,30015,8OG
26,,SING,C8,N7,no,N,26,,165505,30015,8OG
27,,DOUB,C8,O8,no,N,27,,165505,30015,8OG
28,,SING,N7,C5,no,N,28,,165505,30015,8OG
29,,SING,N7,H7,no,N,29,,165505,30015,8OG
30,,SING,C5,C6,no,N,30,,165505,30015,8OG
31,,DOUB,C5,C4,no,N,31,,165505,30015,8OG
32,,DOUB,C6,O6,no,N,32,,165505,30015,8OG
33,,SING,C6,N1,no,N,33,,165505,30015,8OG
34,,SING,N1,C2,no,N,34,,165505,30015,8OG
35,,SING,N1,H1,no,N,35,,165505,30015,8OG
36,,SING,C2,N2,no,N,36,,165505,30015,8OG
37,,DOUB,C2,N3,no,N,37,,165505,30015,8OG
38,,SING,N2,H21,no,N,38,,165505,30015,8OG
39,,SING,N2,H22,no,N,39,,165505,30015,8OG
40,,SING,N3,C4,no,N,40,,165505,30015,8OG
1,,DOUB,O1',C1',no,N,1,,165523,30016,63T
2,,SING,C2',C1',no,N,2,,165523,30016,63T
3,,SING,C2',C3',no,N,3,,165523,30016,63T
4,,SING,C1',O4',no,N,4,,165523,30016,63T
5,,SING,O3',C3',no,N,5,,165523,30016,63T
6,,SING,C3',C4',no,N,6,,165523,30016,63T
7,,SING,O4',C4',no,N,7,,165523,30016,63T
8,,SING,C4',C5',no,N,8,,165523,30016,63T
9,,SING,O5',C5',no,N,9,,165523,30016,63T
10,,SING,O5',P,no,N,10,,165523,30016,63T
11,,DOUB,O1P,P,no,N,11,,165523,30016,63T
12,,SING,P,O2P,no,N,12,,165523,30016,63T
13,,SING,P,O1,no,N,13,,165523,30016,63T
14,,SING,C5',H5'1,no,N,14,,165523,30016,63T
15,,SING,C5',H5'2,no,N,15,,165523,30016,63T
16,,SING,C4',H4',no,N,16,,165523,30016,63T
17,,SING,C3',H3',no,N,17,,165523,30016,63T
18,,SING,O3',H1,no,N,18,,165523,30016,63T
19,,SING,C2',H2'2,no,N,19,,165523,30016,63T
20,,SING,C2',H2'1,no,N,20,,165523,30016,63T
21,,SING,O2P,H2,no,N,21,,165523,30016,63T
22,,SING,O1,H3,no,N,22,,165523,30016,63T
1,,SING,OP3,P,no,N,1,,165524,30016,8OG
2,,SING,OP3,HOP3,no,N,2,,165524,30016,8OG
3,,DOUB,P,OP1,no,N,3,,165524,30016,8OG
4,,SING,P,OP2,no,N,4,,165524,30016,8OG
5,,SING,P,O5',no,N,5,,165524,30016,8OG
6,,SING,OP2,HOP2,no,N,6,,165524,30016,8OG
7,,SING,O5',C5',no,N,7,,165524,30016,8OG
8,,SING,C5',C4',no,N,8,,165524,30016,8OG
9,,SING,C5',H5',no,N,9,,165524,30016,8OG
10,,SING,C5',H5'',no,N,10,,165524,30016,8OG
11,,SING,C4',O4',no,N,11,,165524,30016,8OG
12,,SING,C4',C3',no,N,12,,165524,30016,8OG
13,,SING,C4',H4',no,N,13,,165524,30016,8OG
14,,SING,O4',C1',no,N,14,,165524,30016,8OG
15,,SING,C3',O3',no,N,15,,165524,30016,8OG
16,,SING,C3',C2',no,N,16,,165524,30016,8OG
17,,SING,C3',H3',no,N,17,,165524,30016,8OG
18,,SING,O3',HO3',no,N,18,,165524,30016,8OG
19,,SING,C2',C1',no,N,19,,165524,30016,8OG
20,,SING,C2',H2',no,N,20,,165524,30016,8OG
21,,SING,C2',H2'',no,N,21,,165524,30016,8OG
22,,SING,C1',N9,no,N,22,,165524,30016,8OG
23,,SING,C1',H1',no,N,23,,165524,30016,8OG
24,,SING,N9,C8,no,N,24,,165524,30016,8OG
25,,SING,N9,C4,no,N,25,,165524,30016,8OG
26,,SING,C8,N7,no,N,26,,165524,30016,8OG
27,,DOUB,C8,O8,no,N,27,,165524,30016,8OG
28,,SING,N7,C5,no,N,28,,165524,30016,8OG
29,,SING,N7,H7,no,N,29,,165524,30016,8OG
30,,SING,C5,C6,no,N,30,,165524,30016,8OG
31,,DOUB,C5,C4,no,N,31,,165524,30016,8OG
32,,DOUB,C6,O6,no,N,32,,165524,30016,8OG
33,,SING,C6,N1,no,N,33,,165524,30016,8OG
34,,SING,N1,C2,no,N,34,,165524,30016,8OG
35,,SING,N1,H1,no,N,35,,165524,30016,8OG
36,,SING,C2,N2,no,N,36,,165524,30016,8OG
37,,DOUB,C2,N3,no,N,37,,165524,30016,8OG
38,,SING,N2,H21,no,N,38,,165524,30016,8OG
39,,SING,N2,H22,no,N,39,,165524,30016,8OG
40,,SING,N3,C4,no,N,40,,165524,30016,8OG
1,,DOUB,C2,C1,yes,N,1,,165912,30038,80G
2,,SING,C1,C6,yes,N,2,,165912,30038,80G
3,,SING,C1,C7,yes,N,3,,165912,30038,80G
4,,SING,C3,C2,yes,N,4,,165912,30038,80G
5,,SING,C2,H2,no,N,5,,165912,30038,80G
6,,DOUB,C3,C4,yes,N,6,,165912,30038,80G
7,,SING,C3,H3,no,N,7,,165912,30038,80G
8,,SING,C12,C4,no,N,8,,165912,30038,80G
9,,SING,C4,C5,yes,N,9,,165912,30038,80G
10,,DOUB,C5,C6,yes,N,10,,165912,30038,80G
11,,SING,C5,H5,no,N,11,,165912,30038,80G
12,,SING,C6,H6,no,N,12,,165912,30038,80G
13,,SING,C7,S8,yes,N,13,,165912,30038,80G
14,,DOUB,C7,C11,yes,N,14,,165912,30038,80G
15,,SING,S8,C9,yes,N,15,,165912,30038,80G
16,,DOUB,C9,C10,yes,N,16,,165912,30038,80G
17,,SING,C9,H9,no,N,17,,165912,30038,80G
18,,SING,C11,C10,yes,N,18,,165912,30038,80G
19,,SING,C10,H10,no,N,19,,165912,30038,80G
20,,SING,C11,H11,no,N,20,,165912,30038,80G
21,,SING,C12,N13,no,N,21,,165912,30038,80G
22,,SING,C12,H12,no,N,22,,165912,30038,80G
23,,SING,C12,H12A,no,N,23,,165912,30038,80G
24,,SING,N13,HN13,no,N,24,,165912,30038,80G
25,,SING,N13,HN1A,no,N,25,,165912,30038,80G
1,,DOUB,C2,C1,yes,N,1,,166026,30044,80G
2,,SING,C1,C6,yes,N,2,,166026,30044,80G
3,,SING,C1,C7,yes,N,3,,166026,30044,80G
4,,SING,C3,C2,yes,N,4,,166026,30044,80G
5,,SING,C2,H2,no,N,5,,166026,30044,80G
6,,DOUB,C3,C4,yes,N,6,,166026,30044,80G
7,,SING,C3,H3,no,N,7,,166026,30044,80G
8,,SING,C12,C4,no,N,8,,166026,30044,80G
9,,SING,C4,C5,yes,N,9,,166026,30044,80G
10,,DOUB,C5,C6,yes,N,10,,166026,30044,80G
11,,SING,C5,H5,no,N,11,,166026,30044,80G
12,,SING,C6,H6,no,N,12,,166026,30044,80G
13,,SING,C7,S8,yes,N,13,,166026,30044,80G
14,,DOUB,C7,C11,yes,N,14,,166026,30044,80G
15,,SING,S8,C9,yes,N,15,,166026,30044,80G
16,,DOUB,C9,C10,yes,N,16,,166026,30044,80G
17,,SING,C9,H9,no,N,17,,166026,30044,80G
18,,SING,C11,C10,yes,N,18,,166026,30044,80G
19,,SING,C10,H10,no,N,19,,166026,30044,80G
20,,SING,C11,H11,no,N,20,,166026,30044,80G
21,,SING,C12,N13,no,N,21,,166026,30044,80G
22,,SING,C12,H12,no,N,22,,166026,30044,80G
23,,SING,C12,H12A,no,N,23,,166026,30044,80G
24,,SING,N13,HN13,no,N,24,,166026,30044,80G
25,,SING,N13,HN1A,no,N,25,,166026,30044,80G
1,,SING,N,CA,no,N,1,,166068,30046,DPR
2,,SING,N,CD,no,N,2,,166068,30046,DPR
3,,SING,N,H,no,N,3,,166068,30046,DPR
4,,SING,CA,CB,no,N,4,,166068,30046,DPR
5,,SING,CA,C,no,N,5,,166068,30046,DPR
6,,SING,CA,HA,no,N,6,,166068,30046,DPR
7,,SING,CB,CG,no,N,7,,166068,30046,DPR
8,,SING,CB,HB2,no,N,8,,166068,30046,DPR
9,,SING,CB,HB3,no,N,9,,166068,30046,DPR
10,,SING,CG,CD,no,N,10,,166068,30046,DPR
11,,SING,CG,HG2,no,N,11,,166068,30046,DPR
12,,SING,CG,HG3,no,N,12,,166068,30046,DPR
13,,SING,CD,HD2,no,N,13,,166068,30046,DPR
14,,SING,CD,HD3,no,N,14,,166068,30046,DPR
15,,DOUB,C,O,no,N,15,,166068,30046,DPR
16,,SING,C,OXT,no,N,16,,166068,30046,DPR
17,,SING,OXT,HXT,no,N,17,,166068,30046,DPR
1,,SING,C19,O6,no,N,1,,166105,30048,6FS
2,,SING,O6,C15,no,N,2,,166105,30048,6FS
3,,SING,N1,C20,no,N,3,,166105,30048,6FS
4,,SING,N1,C16,no,N,4,,166105,30048,6FS
5,,SING,C20,C21,no,N,5,,166105,30048,6FS
6,,DOUB,C15,C16,yes,N,6,,166105,30048,6FS
7,,SING,C15,C14,yes,N,7,,166105,30048,6FS
8,,DOUB,O5,S1,no,N,8,,166105,30048,6FS
9,,SING,C16,C17,yes,N,9,,166105,30048,6FS
10,,DOUB,O8,C21,no,N,10,,166105,30048,6FS
11,,DOUB,C14,C13,yes,N,11,,166105,30048,6FS
12,,SING,C21,O7,no,N,12,,166105,30048,6FS
13,,DOUB,C17,C18,yes,N,13,,166105,30048,6FS
14,,SING,C13,C18,yes,N,14,,166105,30048,6FS
15,,SING,C18,C12,no,N,15,,166105,30048,6FS
16,,SING,S1,C12,no,N,16,,166105,30048,6FS
17,,DOUB,S1,O4,no,N,17,,166105,30048,6FS
18,,SING,S1,C11,no,N,18,,166105,30048,6FS
19,,SING,C10,O3,no,N,19,,166105,30048,6FS
20,,SING,O3,C2,no,N,20,,166105,30048,6FS
21,,DOUB,C9,C11,no,E,21,,166105,30048,6FS
22,,SING,C9,C3,no,N,22,,166105,30048,6FS
23,,DOUB,C2,C3,yes,N,23,,166105,30048,6FS
24,,SING,C2,C1,yes,N,24,,166105,30048,6FS
25,,SING,C3,C4,yes,N,25,,166105,30048,6FS
26,,DOUB,C1,C6,yes,N,26,,166105,30048,6FS
27,,SING,C4,O2,no,N,27,,166105,30048,6FS
28,,DOUB,C4,C5,yes,N,28,,166105,30048,6FS
29,,SING,O2,C8,no,N,29,,166105,30048,6FS
30,,SING,C6,C5,yes,N,30,,166105,30048,6FS
31,,SING,C6,O1,no,N,31,,166105,30048,6FS
32,,SING,O1,C7,no,N,32,,166105,30048,6FS
33,,SING,C1,H1,no,N,33,,166105,30048,6FS
34,,SING,C5,H5,no,N,34,,166105,30048,6FS
35,,SING,C7,H72,no,N,35,,166105,30048,6FS
36,,SING,C7,H71,no,N,36,,166105,30048,6FS
37,,SING,C7,H73,no,N,37,,166105,30048,6FS
38,,SING,C8,H82,no,N,38,,166105,30048,6FS
39,,SING,C8,H81,no,N,39,,166105,30048,6FS
40,,SING,C8,H83,no,N,40,,166105,30048,6FS
41,,SING,C10,H10,no,N,41,,166105,30048,6FS
42,,SING,C10,H9M,no,N,42,,166105,30048,6FS
43,,SING,C10,H9L,no,N,43,,166105,30048,6FS
44,,SING,C11,H11,no,N,44,,166105,30048,6FS
45,,SING,C12,H9N,no,N,45,,166105,30048,6FS
46,,SING,C12,H12,no,N,46,,166105,30048,6FS
47,,SING,C13,H13,no,N,47,,166105,30048,6FS
48,,SING,C14,H14,no,N,48,,166105,30048,6FS
49,,SING,C19,H9P,no,N,49,,166105,30048,6FS
50,,SING,C19,H19,no,N,50,,166105,30048,6FS
51,,SING,C19,H9O,no,N,51,,166105,30048,6FS
52,,SING,O7,H2,no,N,52,,166105,30048,6FS
53,,SING,C17,H17,no,N,53,,166105,30048,6FS
54,,SING,C9,H9,no,N,54,,166105,30048,6FS
55,,SING,C20,H9Q,no,N,55,,166105,30048,6FS
56,,SING,C20,H20,no,N,56,,166105,30048,6FS
57,,SING,N1,H15,no,N,57,,166105,30048,6FS
1,,SING,N,CA,no,N,1,,166123,30049,DPR
2,,SING,N,CD,no,N,2,,166123,30049,DPR
3,,SING,N,H,no,N,3,,166123,30049,DPR
4,,SING,CA,CB,no,N,4,,166123,30049,DPR
5,,SING,CA,C,no,N,5,,166123,30049,DPR
6,,SING,CA,HA,no,N,6,,166123,30049,DPR
7,,SING,CB,CG,no,N,7,,166123,30049,DPR
8,,SING,CB,HB2,no,N,8,,166123,30049,DPR
9,,SING,CB,HB3,no,N,9,,166123,30049,DPR
10,,SING,CG,CD,no,N,10,,166123,30049,DPR
11,,SING,CG,HG2,no,N,11,,166123,30049,DPR
12,,SING,CG,HG3,no,N,12,,166123,30049,DPR
13,,SING,CD,HD2,no,N,13,,166123,30049,DPR
14,,SING,CD,HD3,no,N,14,,166123,30049,DPR
15,,DOUB,C,O,no,N,15,,166123,30049,DPR
16,,SING,C,OXT,no,N,16,,166123,30049,DPR
17,,SING,OXT,HXT,no,N,17,,166123,30049,DPR
1,,SING,C19,O6,no,N,1,,166140,30050,6FS
2,,SING,O6,C15,no,N,2,,166140,30050,6FS
3,,SING,N1,C20,no,N,3,,166140,30050,6FS
4,,SING,N1,C16,no,N,4,,166140,30050,6FS
5,,SING,C20,C21,no,N,5,,166140,30050,6FS
6,,DOUB,C15,C16,yes,N,6,,166140,30050,6FS
7,,SING,C15,C14,yes,N,7,,166140,30050,6FS
8,,DOUB,O5,S1,no,N,8,,166140,30050,6FS
9,,SING,C16,C17,yes,N,9,,166140,30050,6FS
10,,DOUB,O8,C21,no,N,10,,166140,30050,6FS
11,,DOUB,C14,C13,yes,N,11,,166140,30050,6FS
12,,SING,C21,O7,no,N,12,,166140,30050,6FS
13,,DOUB,C17,C18,yes,N,13,,166140,30050,6FS
14,,SING,C13,C18,yes,N,14,,166140,30050,6FS
15,,SING,C18,C12,no,N,15,,166140,30050,6FS
16,,SING,S1,C12,no,N,16,,166140,30050,6FS
17,,DOUB,S1,O4,no,N,17,,166140,30050,6FS
18,,SING,S1,C11,no,N,18,,166140,30050,6FS
19,,SING,C10,O3,no,N,19,,166140,30050,6FS
20,,SING,O3,C2,no,N,20,,166140,30050,6FS
21,,DOUB,C9,C11,no,E,21,,166140,30050,6FS
22,,SING,C9,C3,no,N,22,,166140,30050,6FS
23,,DOUB,C2,C3,yes,N,23,,166140,30050,6FS
24,,SING,C2,C1,yes,N,24,,166140,30050,6FS
25,,SING,C3,C4,yes,N,25,,166140,30050,6FS
26,,DOUB,C1,C6,yes,N,26,,166140,30050,6FS
27,,SING,C4,O2,no,N,27,,166140,30050,6FS
28,,DOUB,C4,C5,yes,N,28,,166140,30050,6FS
29,,SING,O2,C8,no,N,29,,166140,30050,6FS
30,,SING,C6,C5,yes,N,30,,166140,30050,6FS
31,,SING,C6,O1,no,N,31,,166140,30050,6FS
32,,SING,O1,C7,no,N,32,,166140,30050,6FS
33,,SING,C1,H1,no,N,33,,166140,30050,6FS
34,,SING,C5,H5,no,N,34,,166140,30050,6FS
35,,SING,C7,H72,no,N,35,,166140,30050,6FS
36,,SING,C7,H71,no,N,36,,166140,30050,6FS
37,,SING,C7,H73,no,N,37,,166140,30050,6FS
38,,SING,C8,H82,no,N,38,,166140,30050,6FS
39,,SING,C8,H81,no,N,39,,166140,30050,6FS
40,,SING,C8,H83,no,N,40,,166140,30050,6FS
41,,SING,C10,H10,no,N,41,,166140,30050,6FS
42,,SING,C10,H9M,no,N,42,,166140,30050,6FS
43,,SING,C10,H9L,no,N,43,,166140,30050,6FS
44,,SING,C11,H11,no,N,44,,166140,30050,6FS
45,,SING,C12,H9N,no,N,45,,166140,30050,6FS
46,,SING,C12,H12,no,N,46,,166140,30050,6FS
47,,SING,C13,H13,no,N,47,,166140,30050,6FS
48,,SING,C14,H14,no,N,48,,166140,30050,6FS
49,,SING,C19,H9P,no,N,49,,166140,30050,6FS
50,,SING,C19,H19,no,N,50,,166140,30050,6FS
51,,SING,C19,H9O,no,N,51,,166140,30050,6FS
52,,SING,O7,H2,no,N,52,,166140,30050,6FS
53,,SING,C17,H17,no,N,53,,166140,30050,6FS
54,,SING,C9,H9,no,N,54,,166140,30050,6FS
55,,SING,C20,H9Q,no,N,55,,166140,30050,6FS
56,,SING,C20,H20,no,N,56,,166140,30050,6FS
57,,SING,N1,H15,no,N,57,,166140,30050,6FS
1,,SING,N,CA,no,N,1,,166158,30051,DPR
2,,SING,N,CD,no,N,2,,166158,30051,DPR
3,,SING,N,H,no,N,3,,166158,30051,DPR
4,,SING,CA,CB,no,N,4,,166158,30051,DPR
5,,SING,CA,C,no,N,5,,166158,30051,DPR
6,,SING,CA,HA,no,N,6,,166158,30051,DPR
7,,SING,CB,CG,no,N,7,,166158,30051,DPR
8,,SING,CB,HB2,no,N,8,,166158,30051,DPR
9,,SING,CB,HB3,no,N,9,,166158,30051,DPR
10,,SING,CG,CD,no,N,10,,166158,30051,DPR
11,,SING,CG,HG2,no,N,11,,166158,30051,DPR
12,,SING,CG,HG3,no,N,12,,166158,30051,DPR
13,,SING,CD,HD2,no,N,13,,166158,30051,DPR
14,,SING,CD,HD3,no,N,14,,166158,30051,DPR
15,,DOUB,C,O,no,N,15,,166158,30051,DPR
16,,SING,C,OXT,no,N,16,,166158,30051,DPR
17,,SING,OXT,HXT,no,N,17,,166158,30051,DPR
1,,DOUB,P,OP1,no,N,1,,166175,30052,GS
2,,SING,P,S2P,no,N,2,,166175,30052,GS
3,,SING,P,OP3,no,N,3,,166175,30052,GS
4,,SING,P,O5',no,N,4,,166175,30052,GS
5,,SING,S2P,HSP2,no,N,5,,166175,30052,GS
6,,SING,OP3,HOP3,no,N,6,,166175,30052,GS
7,,SING,O5',C5',no,N,7,,166175,30052,GS
8,,SING,C5',C4',no,N,8,,166175,30052,GS
9,,SING,C5',H5',no,N,9,,166175,30052,GS
10,,SING,C5',H5'',no,N,10,,166175,30052,GS
11,,SING,C4',O4',no,N,11,,166175,30052,GS
12,,SING,C4',C3',no,N,12,,166175,30052,GS
13,,SING,C4',H4',no,N,13,,166175,30052,GS
14,,SING,O4',C1',no,N,14,,166175,30052,GS
15,,SING,C3',O3',no,N,15,,166175,30052,GS
16,,SING,C3',C2',no,N,16,,166175,30052,GS
17,,SING,C3',H3',no,N,17,,166175,30052,GS
18,,SING,O3',HO3',no,N,18,,166175,30052,GS
19,,SING,C2',C1',no,N,19,,166175,30052,GS
20,,SING,C2',H2',no,N,20,,166175,30052,GS
21,,SING,C2',H2'',no,N,21,,166175,30052,GS
22,,SING,C1',N9,no,N,22,,166175,30052,GS
23,,SING,C1',H1',no,N,23,,166175,30052,GS
24,,SING,N9,C8,yes,N,24,,166175,30052,GS
25,,SING,N9,C4,yes,N,25,,166175,30052,GS
26,,DOUB,C8,N7,yes,N,26,,166175,30052,GS
27,,SING,C8,H8,no,N,27,,166175,30052,GS
28,,SING,N7,C5,yes,N,28,,166175,30052,GS
29,,SING,C5,C6,no,N,29,,166175,30052,GS
30,,DOUB,C5,C4,yes,N,30,,166175,30052,GS
31,,DOUB,C6,O6,no,N,31,,166175,30052,GS
32,,SING,C6,N1,no,N,32,,166175,30052,GS
33,,SING,N1,C2,no,N,33,,166175,30052,GS
34,,SING,N1,HN1,no,N,34,,166175,30052,GS
35,,SING,C2,N2,no,N,35,,166175,30052,GS
36,,DOUB,C2,N3,no,N,36,,166175,30052,GS
37,,SING,N2,HN21,no,N,37,,166175,30052,GS
38,,SING,N2,HN22,no,N,38,,166175,30052,GS
39,,SING,N3,C4,no,N,39,,166175,30052,GS
1,,DOUB,P,OP1,no,N,1,,166215,30054,GS
2,,SING,P,S2P,no,N,2,,166215,30054,GS
3,,SING,P,OP3,no,N,3,,166215,30054,GS
4,,SING,P,O5',no,N,4,,166215,30054,GS
5,,SING,S2P,HSP2,no,N,5,,166215,30054,GS
6,,SING,OP3,HOP3,no,N,6,,166215,30054,GS
7,,SING,O5',C5',no,N,7,,166215,30054,GS
8,,SING,C5',C4',no,N,8,,166215,30054,GS
9,,SING,C5',H5',no,N,9,,166215,30054,GS
10,,SING,C5',H5'',no,N,10,,166215,30054,GS
11,,SING,C4',O4',no,N,11,,166215,30054,GS
12,,SING,C4',C3',no,N,12,,166215,30054,GS
13,,SING,C4',H4',no,N,13,,166215,30054,GS
14,,SING,O4',C1',no,N,14,,166215,30054,GS
15,,SING,C3',O3',no,N,15,,166215,30054,GS
16,,SING,C3',C2',no,N,16,,166215,30054,GS
17,,SING,C3',H3',no,N,17,,166215,30054,GS
18,,SING,O3',HO3',no,N,18,,166215,30054,GS
19,,SING,C2',C1',no,N,19,,166215,30054,GS
20,,SING,C2',H2',no,N,20,,166215,30054,GS
21,,SING,C2',H2'',no,N,21,,166215,30054,GS
22,,SING,C1',N9,no,N,22,,166215,30054,GS
23,,SING,C1',H1',no,N,23,,166215,30054,GS
24,,SING,N9,C8,yes,N,24,,166215,30054,GS
25,,SING,N9,C4,yes,N,25,,166215,30054,GS
26,,DOUB,C8,N7,yes,N,26,,166215,30054,GS
27,,SING,C8,H8,no,N,27,,166215,30054,GS
28,,SING,N7,C5,yes,N,28,,166215,30054,GS
29,,SING,C5,C6,no,N,29,,166215,30054,GS
30,,DOUB,C5,C4,yes,N,30,,166215,30054,GS
31,,DOUB,C6,O6,no,N,31,,166215,30054,GS
32,,SING,C6,N1,no,N,32,,166215,30054,GS
33,,SING,N1,C2,no,N,33,,166215,30054,GS
34,,SING,N1,HN1,no,N,34,,166215,30054,GS
35,,SING,C2,N2,no,N,35,,166215,30054,GS
36,,DOUB,C2,N3,no,N,36,,166215,30054,GS
37,,SING,N2,HN21,no,N,37,,166215,30054,GS
38,,SING,N2,HN22,no,N,38,,166215,30054,GS
39,,SING,N3,C4,no,N,39,,166215,30054,GS
1,,DOUB,C,O,no,N,1,,166265,30057,ACE
2,,SING,C,CH3,no,N,2,,166265,30057,ACE
3,,SING,C,H,no,N,3,,166265,30057,ACE
4,,SING,CH3,H1,no,N,4,,166265,30057,ACE
5,,SING,CH3,H2,no,N,5,,166265,30057,ACE
6,,SING,CH3,H3,no,N,6,,166265,30057,ACE
1,,SING,N,HN1,no,N,1,,166266,30057,NH2
2,,SING,N,HN2,no,N,2,,166266,30057,NH2
1,,SING,N,HN1,no,N,1,,166298,30059,NH2
2,,SING,N,HN2,no,N,2,,166298,30059,NH2
1,,SING,N,HN1,no,N,1,,166314,30060,NH2
2,,SING,N,HN2,no,N,2,,166314,30060,NH2
1,,SING,N,CA,no,N,1,,166353,30062,TPO
2,,SING,N,H,no,N,2,,166353,30062,TPO
3,,SING,N,H2,no,N,3,,166353,30062,TPO
4,,SING,CA,CB,no,N,4,,166353,30062,TPO
5,,SING,CA,C,no,N,5,,166353,30062,TPO
6,,SING,CA,HA,no,N,6,,166353,30062,TPO
7,,SING,CB,CG2,no,N,7,,166353,30062,TPO
8,,SING,CB,OG1,no,N,8,,166353,30062,TPO
9,,SING,CB,HB,no,N,9,,166353,30062,TPO
10,,SING,CG2,HG21,no,N,10,,166353,30062,TPO
11,,SING,CG2,HG22,no,N,11,,166353,30062,TPO
12,,SING,CG2,HG23,no,N,12,,166353,30062,TPO
13,,SING,OG1,P,no,N,13,,166353,30062,TPO
14,,DOUB,P,O1P,no,N,14,,166353,30062,TPO
15,,SING,P,O2P,no,N,15,,166353,30062,TPO
16,,SING,P,O3P,no,N,16,,166353,30062,TPO
17,,SING,O2P,HOP2,no,N,17,,166353,30062,TPO
18,,SING,O3P,HOP3,no,N,18,,166353,30062,TPO
19,,DOUB,C,O,no,N,19,,166353,30062,TPO
20,,SING,C,OXT,no,N,20,,166353,30062,TPO
21,,SING,OXT,HXT,no,N,21,,166353,30062,TPO
1,,SING,O23,P24,no,N,1,,166450,30066,PNS
2,,SING,O23,HOP1,no,N,2,,166450,30066,PNS
3,,SING,P24,O25,no,N,3,,166450,30066,PNS
4,,DOUB,P24,O26,no,N,4,,166450,30066,PNS
5,,SING,P24,O27,no,N,5,,166450,30066,PNS
6,,SING,O25,HOP2,no,N,6,,166450,30066,PNS
7,,SING,O27,C28,no,N,7,,166450,30066,PNS
8,,SING,C28,C29,no,N,8,,166450,30066,PNS
9,,SING,C28,H282,no,N,9,,166450,30066,PNS
10,,SING,C28,H281,no,N,10,,166450,30066,PNS
11,,SING,C29,C30,no,N,11,,166450,30066,PNS
12,,SING,C29,C31,no,N,12,,166450,30066,PNS
13,,SING,C29,C32,no,N,13,,166450,30066,PNS
14,,SING,C30,H303,no,N,14,,166450,30066,PNS
15,,SING,C30,H302,no,N,15,,166450,30066,PNS
16,,SING,C30,H301,no,N,16,,166450,30066,PNS
17,,SING,C31,H313,no,N,17,,166450,30066,PNS
18,,SING,C31,H312,no,N,18,,166450,30066,PNS
19,,SING,C31,H311,no,N,19,,166450,30066,PNS
20,,SING,C32,O33,no,N,20,,166450,30066,PNS
21,,SING,C32,C34,no,N,21,,166450,30066,PNS
22,,SING,C32,H32,no,N,22,,166450,30066,PNS
23,,SING,O33,H33,no,N,23,,166450,30066,PNS
24,,DOUB,C34,O35,no,N,24,,166450,30066,PNS
25,,SING,C34,N36,no,N,25,,166450,30066,PNS
26,,SING,N36,C37,no,N,26,,166450,30066,PNS
27,,SING,N36,H36,no,N,27,,166450,30066,PNS
28,,SING,C37,C38,no,N,28,,166450,30066,PNS
29,,SING,C37,H372,no,N,29,,166450,30066,PNS
30,,SING,C37,H371,no,N,30,,166450,30066,PNS
31,,SING,C38,C39,no,N,31,,166450,30066,PNS
32,,SING,C38,H382,no,N,32,,166450,30066,PNS
33,,SING,C38,H381,no,N,33,,166450,30066,PNS
34,,DOUB,C39,O40,no,N,34,,166450,30066,PNS
35,,SING,C39,N41,no,N,35,,166450,30066,PNS
36,,SING,N41,C42,no,N,36,,166450,30066,PNS
37,,SING,N41,H41,no,N,37,,166450,30066,PNS
38,,SING,C42,C43,no,N,38,,166450,30066,PNS
39,,SING,C42,H422,no,N,39,,166450,30066,PNS
40,,SING,C42,H421,no,N,40,,166450,30066,PNS
41,,SING,C43,S44,no,N,41,,166450,30066,PNS
42,,SING,C43,H431,no,N,42,,166450,30066,PNS
43,,SING,C43,H432,no,N,43,,166450,30066,PNS
44,,SING,S44,H44,no,N,44,,166450,30066,PNS
1,,SING,N,HN1,no,N,1,,166641,30076,NH2
2,,SING,N,HN2,no,N,2,,166641,30076,NH2
1,,SING,N,CN,no,N,1,,167249,30106,FME
2,,SING,N,CA,no,N,2,,167249,30106,FME
3,,SING,N,H,no,N,3,,167249,30106,FME
4,,DOUB,CN,O1,no,N,4,,167249,30106,FME
5,,SING,CN,HCN,no,N,5,,167249,30106,FME
6,,SING,CA,CB,no,N,6,,167249,30106,FME
7,,SING,CA,C,no,N,7,,167249,30106,FME
8,,SING,CA,HA,no,N,8,,167249,30106,FME
9,,SING,CB,CG,no,N,9,,167249,30106,FME
10,,SING,CB,HB2,no,N,10,,167249,30106,FME
11,,SING,CB,HB3,no,N,11,,167249,30106,FME
12,,SING,CG,SD,no,N,12,,167249,30106,FME
13,,SING,CG,HG2,no,N,13,,167249,30106,FME
14,,SING,CG,HG3,no,N,14,,167249,30106,FME
15,,SING,SD,CE,no,N,15,,167249,30106,FME
16,,SING,CE,HE1,no,N,16,,167249,30106,FME
17,,SING,CE,HE2,no,N,17,,167249,30106,FME
18,,SING,CE,HE3,no,N,18,,167249,30106,FME
19,,DOUB,C,O,no,N,19,,167249,30106,FME
20,,SING,C,OXT,no,N,20,,167249,30106,FME
21,,SING,OXT,HXT,no,N,21,,167249,30106,FME
1,,SING,N,CN,no,N,1,,167310,30109,FME
2,,SING,N,CA,no,N,2,,167310,30109,FME
3,,SING,N,H,no,N,3,,167310,30109,FME
4,,DOUB,CN,O1,no,N,4,,167310,30109,FME
5,,SING,CN,HCN,no,N,5,,167310,30109,FME
6,,SING,CA,CB,no,N,6,,167310,30109,FME
7,,SING,CA,C,no,N,7,,167310,30109,FME
8,,SING,CA,HA,no,N,8,,167310,30109,FME
9,,SING,CB,CG,no,N,9,,167310,30109,FME
10,,SING,CB,HB2,no,N,10,,167310,30109,FME
11,,SING,CB,HB3,no,N,11,,167310,30109,FME
12,,SING,CG,SD,no,N,12,,167310,30109,FME
13,,SING,CG,HG2,no,N,13,,167310,30109,FME
14,,SING,CG,HG3,no,N,14,,167310,30109,FME
15,,SING,SD,CE,no,N,15,,167310,30109,FME
16,,SING,CE,HE1,no,N,16,,167310,30109,FME
17,,SING,CE,HE2,no,N,17,,167310,30109,FME
18,,SING,CE,HE3,no,N,18,,167310,30109,FME
19,,DOUB,C,O,no,N,19,,167310,30109,FME
20,,SING,C,OXT,no,N,20,,167310,30109,FME
21,,SING,OXT,HXT,no,N,21,,167310,30109,FME
1,,DOUB,C,O,no,N,1,,167517,30119,ACE
2,,SING,C,CH3,no,N,2,,167517,30119,ACE
3,,SING,C,H,no,N,3,,167517,30119,ACE
4,,SING,CH3,H1,no,N,4,,167517,30119,ACE
5,,SING,CH3,H2,no,N,5,,167517,30119,ACE
6,,SING,CH3,H3,no,N,6,,167517,30119,ACE
1,,DOUB,C,O,no,N,1,,167536,30120,ACE
2,,SING,C,CH3,no,N,2,,167536,30120,ACE
3,,SING,C,H,no,N,3,,167536,30120,ACE
4,,SING,CH3,H1,no,N,4,,167536,30120,ACE
5,,SING,CH3,H2,no,N,5,,167536,30120,ACE
6,,SING,CH3,H3,no,N,6,,167536,30120,ACE
1,,DOUB,C,O,no,N,1,,167577,30123,ACE
2,,SING,C,CH3,no,N,2,,167577,30123,ACE
3,,SING,C,H,no,N,3,,167577,30123,ACE
4,,SING,CH3,H1,no,N,4,,167577,30123,ACE
5,,SING,CH3,H2,no,N,5,,167577,30123,ACE
6,,SING,CH3,H3,no,N,6,,167577,30123,ACE
1,,SING,N,CA,no,N,1,,167874,30138,DPR
2,,SING,N,CD,no,N,2,,167874,30138,DPR
3,,SING,N,H,no,N,3,,167874,30138,DPR
4,,SING,CA,CB,no,N,4,,167874,30138,DPR
5,,SING,CA,C,no,N,5,,167874,30138,DPR
6,,SING,CA,HA,no,N,6,,167874,30138,DPR
7,,SING,CB,CG,no,N,7,,167874,30138,DPR
8,,SING,CB,HB2,no,N,8,,167874,30138,DPR
9,,SING,CB,HB3,no,N,9,,167874,30138,DPR
10,,SING,CG,CD,no,N,10,,167874,30138,DPR
11,,SING,CG,HG2,no,N,11,,167874,30138,DPR
12,,SING,CG,HG3,no,N,12,,167874,30138,DPR
13,,SING,CD,HD2,no,N,13,,167874,30138,DPR
14,,SING,CD,HD3,no,N,14,,167874,30138,DPR
15,,DOUB,C,O,no,N,15,,167874,30138,DPR
16,,SING,C,OXT,no,N,16,,167874,30138,DPR
17,,SING,OXT,HXT,no,N,17,,167874,30138,DPR
1,,SING,N,CA,no,N,1,,167921,30140,DAR
2,,SING,N,H,no,N,2,,167921,30140,DAR
3,,SING,N,H2,no,N,3,,167921,30140,DAR
4,,SING,CA,CB,no,N,4,,167921,30140,DAR
5,,SING,CA,C,no,N,5,,167921,30140,DAR
6,,SING,CA,HA,no,N,6,,167921,30140,DAR
7,,SING,CB,CG,no,N,7,,167921,30140,DAR
8,,SING,CB,HB2,no,N,8,,167921,30140,DAR
9,,SING,CB,HB3,no,N,9,,167921,30140,DAR
10,,SING,CG,CD,no,N,10,,167921,30140,DAR
11,,SING,CG,HG2,no,N,11,,167921,30140,DAR
12,,SING,CG,HG3,no,N,12,,167921,30140,DAR
13,,SING,CD,NE,no,N,13,,167921,30140,DAR
14,,SING,CD,HD2,no,N,14,,167921,30140,DAR
15,,SING,CD,HD3,no,N,15,,167921,30140,DAR
16,,SING,NE,CZ,no,N,16,,167921,30140,DAR
17,,SING,NE,HE,no,N,17,,167921,30140,DAR
18,,SING,CZ,NH1,no,N,18,,167921,30140,DAR
19,,DOUB,CZ,NH2,no,N,19,,167921,30140,DAR
20,,SING,NH1,HH11,no,N,20,,167921,30140,DAR
21,,SING,NH1,HH12,no,N,21,,167921,30140,DAR
22,,SING,NH2,HH21,no,N,22,,167921,30140,DAR
23,,SING,NH2,HH22,no,N,23,,167921,30140,DAR
24,,DOUB,C,O,no,N,24,,167921,30140,DAR
25,,SING,C,OXT,no,N,25,,167921,30140,DAR
26,,SING,OXT,HXT,no,N,26,,167921,30140,DAR
1,,SING,N,CA,no,N,1,,167922,30140,DSG
2,,SING,N,H,no,N,2,,167922,30140,DSG
3,,SING,N,H2,no,N,3,,167922,30140,DSG
4,,SING,CA,C,no,N,4,,167922,30140,DSG
5,,SING,CA,CB,no,N,5,,167922,30140,DSG
6,,SING,CA,HA,no,N,6,,167922,30140,DSG
7,,DOUB,C,O,no,N,7,,167922,30140,DSG
8,,SING,C,OXT,no,N,8,,167922,30140,DSG
9,,SING,CB,CG,no,N,9,,167922,30140,DSG
10,,SING,CB,HB2,no,N,10,,167922,30140,DSG
11,,SING,CB,HB3,no,N,11,,167922,30140,DSG
12,,DOUB,CG,OD1,no,N,12,,167922,30140,DSG
13,,SING,CG,ND2,no,N,13,,167922,30140,DSG
14,,SING,ND2,HD21,no,N,14,,167922,30140,DSG
15,,SING,ND2,HD22,no,N,15,,167922,30140,DSG
16,,SING,OXT,HXT,no,N,16,,167922,30140,DSG
1,,SING,N,CA,no,N,1,,167941,30141,DAL
2,,SING,N,H,no,N,2,,167941,30141,DAL
3,,SING,N,H2,no,N,3,,167941,30141,DAL
4,,SING,CA,CB,no,N,4,,167941,30141,DAL
5,,SING,CA,C,no,N,5,,167941,30141,DAL
6,,SING,CA,HA,no,N,6,,167941,30141,DAL
7,,SING,CB,HB1,no,N,7,,167941,30141,DAL
8,,SING,CB,HB2,no,N,8,,167941,30141,DAL
9,,SING,CB,HB3,no,N,9,,167941,30141,DAL
10,,DOUB,C,O,no,N,10,,167941,30141,DAL
11,,SING,C,OXT,no,N,11,,167941,30141,DAL
12,,SING,OXT,HXT,no,N,12,,167941,30141,DAL
1,,SING,N,CA,no,N,1,,167942,30141,DPR
2,,SING,N,CD,no,N,2,,167942,30141,DPR
3,,SING,N,H,no,N,3,,167942,30141,DPR
4,,SING,CA,CB,no,N,4,,167942,30141,DPR
5,,SING,CA,C,no,N,5,,167942,30141,DPR
6,,SING,CA,HA,no,N,6,,167942,30141,DPR
7,,SING,CB,CG,no,N,7,,167942,30141,DPR
8,,SING,CB,HB2,no,N,8,,167942,30141,DPR
9,,SING,CB,HB3,no,N,9,,167942,30141,DPR
10,,SING,CG,CD,no,N,10,,167942,30141,DPR
11,,SING,CG,HG2,no,N,11,,167942,30141,DPR
12,,SING,CG,HG3,no,N,12,,167942,30141,DPR
13,,SING,CD,HD2,no,N,13,,167942,30141,DPR
14,,SING,CD,HD3,no,N,14,,167942,30141,DPR
15,,DOUB,C,O,no,N,15,,167942,30141,DPR
16,,SING,C,OXT,no,N,16,,167942,30141,DPR
17,,SING,OXT,HXT,no,N,17,,167942,30141,DPR
1,,SING,N,HN1,no,N,1,,167943,30141,NH2
2,,SING,N,HN2,no,N,2,,167943,30141,NH2
1,,SING,N,CA,no,N,1,,167962,30142,DPR
2,,SING,N,CD,no,N,2,,167962,30142,DPR
3,,SING,N,H,no,N,3,,167962,30142,DPR
4,,SING,CA,CB,no,N,4,,167962,30142,DPR
5,,SING,CA,C,no,N,5,,167962,30142,DPR
6,,SING,CA,HA,no,N,6,,167962,30142,DPR
7,,SING,CB,CG,no,N,7,,167962,30142,DPR
8,,SING,CB,HB2,no,N,8,,167962,30142,DPR
9,,SING,CB,HB3,no,N,9,,167962,30142,DPR
10,,SING,CG,CD,no,N,10,,167962,30142,DPR
11,,SING,CG,HG2,no,N,11,,167962,30142,DPR
12,,SING,CG,HG3,no,N,12,,167962,30142,DPR
13,,SING,CD,HD2,no,N,13,,167962,30142,DPR
14,,SING,CD,HD3,no,N,14,,167962,30142,DPR
15,,DOUB,C,O,no,N,15,,167962,30142,DPR
16,,SING,C,OXT,no,N,16,,167962,30142,DPR
17,,SING,OXT,HXT,no,N,17,,167962,30142,DPR
1,,SING,N,CA,no,N,1,,167999,30144,DAL
2,,SING,N,H,no,N,2,,167999,30144,DAL
3,,SING,N,H2,no,N,3,,167999,30144,DAL
4,,SING,CA,CB,no,N,4,,167999,30144,DAL
5,,SING,CA,C,no,N,5,,167999,30144,DAL
6,,SING,CA,HA,no,N,6,,167999,30144,DAL
7,,SING,CB,HB1,no,N,7,,167999,30144,DAL
8,,SING,CB,HB2,no,N,8,,167999,30144,DAL
9,,SING,CB,HB3,no,N,9,,167999,30144,DAL
10,,DOUB,C,O,no,N,10,,167999,30144,DAL
11,,SING,C,OXT,no,N,11,,167999,30144,DAL
12,,SING,OXT,HXT,no,N,12,,167999,30144,DAL
1,,SING,N,CA,no,N,1,,168000,30144,DAR
2,,SING,N,H,no,N,2,,168000,30144,DAR
3,,SING,N,H2,no,N,3,,168000,30144,DAR
4,,SING,CA,CB,no,N,4,,168000,30144,DAR
5,,SING,CA,C,no,N,5,,168000,30144,DAR
6,,SING,CA,HA,no,N,6,,168000,30144,DAR
7,,SING,CB,CG,no,N,7,,168000,30144,DAR
8,,SING,CB,HB2,no,N,8,,168000,30144,DAR
9,,SING,CB,HB3,no,N,9,,168000,30144,DAR
10,,SING,CG,CD,no,N,10,,168000,30144,DAR
11,,SING,CG,HG2,no,N,11,,168000,30144,DAR
12,,SING,CG,HG3,no,N,12,,168000,30144,DAR
13,,SING,CD,NE,no,N,13,,168000,30144,DAR
14,,SING,CD,HD2,no,N,14,,168000,30144,DAR
15,,SING,CD,HD3,no,N,15,,168000,30144,DAR
16,,SING,NE,CZ,no,N,16,,168000,30144,DAR
17,,SING,NE,HE,no,N,17,,168000,30144,DAR
18,,SING,CZ,NH1,no,N,18,,168000,30144,DAR
19,,DOUB,CZ,NH2,no,N,19,,168000,30144,DAR
20,,SING,NH1,HH11,no,N,20,,168000,30144,DAR
21,,SING,NH1,HH12,no,N,21,,168000,30144,DAR
22,,SING,NH2,HH21,no,N,22,,168000,30144,DAR
23,,SING,NH2,HH22,no,N,23,,168000,30144,DAR
24,,DOUB,C,O,no,N,24,,168000,30144,DAR
25,,SING,C,OXT,no,N,25,,168000,30144,DAR
26,,SING,OXT,HXT,no,N,26,,168000,30144,DAR
1,,SING,N,CA,no,N,1,,168001,30144,DAS
2,,SING,N,H,no,N,2,,168001,30144,DAS
3,,SING,N,H2,no,N,3,,168001,30144,DAS
4,,SING,CA,C,no,N,4,,168001,30144,DAS
5,,SING,CA,CB,no,N,5,,168001,30144,DAS
6,,SING,CA,HA,no,N,6,,168001,30144,DAS
7,,DOUB,C,O,no,N,7,,168001,30144,DAS
8,,SING,C,OXT,no,N,8,,168001,30144,DAS
9,,SING,CB,CG,no,N,9,,168001,30144,DAS
10,,SING,CB,HB2,no,N,10,,168001,30144,DAS
11,,SING,CB,HB3,no,N,11,,168001,30144,DAS
12,,DOUB,CG,OD1,no,N,12,,168001,30144,DAS
13,,SING,CG,OD2,no,N,13,,168001,30144,DAS
14,,SING,OD2,HD2,no,N,14,,168001,30144,DAS
15,,SING,OXT,HXT,no,N,15,,168001,30144,DAS
1,,SING,N,CA,no,N,1,,168002,30144,DCY
2,,SING,N,H,no,N,2,,168002,30144,DCY
3,,SING,N,H2,no,N,3,,168002,30144,DCY
4,,SING,CA,C,no,N,4,,168002,30144,DCY
5,,SING,CA,CB,no,N,5,,168002,30144,DCY
6,,SING,CA,HA,no,N,6,,168002,30144,DCY
7,,DOUB,C,O,no,N,7,,168002,30144,DCY
8,,SING,C,OXT,no,N,8,,168002,30144,DCY
9,,SING,CB,SG,no,N,9,,168002,30144,DCY
10,,SING,CB,HB2,no,N,10,,168002,30144,DCY
11,,SING,CB,HB3,no,N,11,,168002,30144,DCY
12,,SING,SG,HG,no,N,12,,168002,30144,DCY
13,,SING,OXT,HXT,no,N,13,,168002,30144,DCY
1,,SING,N,CA,no,N,1,,168003,30144,DGL
2,,SING,N,H,no,N,2,,168003,30144,DGL
3,,SING,N,H2,no,N,3,,168003,30144,DGL
4,,SING,CA,C,no,N,4,,168003,30144,DGL
5,,SING,CA,CB,no,N,5,,168003,30144,DGL
6,,SING,CA,HA,no,N,6,,168003,30144,DGL
7,,DOUB,C,O,no,N,7,,168003,30144,DGL
8,,SING,C,OXT,no,N,8,,168003,30144,DGL
9,,SING,CB,CG,no,N,9,,168003,30144,DGL
10,,SING,CB,HB2,no,N,10,,168003,30144,DGL
11,,SING,CB,HB3,no,N,11,,168003,30144,DGL
12,,SING,CG,CD,no,N,12,,168003,30144,DGL
13,,SING,CG,HG2,no,N,13,,168003,30144,DGL
14,,SING,CG,HG3,no,N,14,,168003,30144,DGL
15,,DOUB,CD,OE1,no,N,15,,168003,30144,DGL
16,,SING,CD,OE2,no,N,16,,168003,30144,DGL
17,,SING,OE2,HE2,no,N,17,,168003,30144,DGL
18,,SING,OXT,HXT,no,N,18,,168003,30144,DGL
1,,SING,N,CA,no,N,1,,168004,30144,DLY
2,,SING,N,H,no,N,2,,168004,30144,DLY
3,,SING,N,H2,no,N,3,,168004,30144,DLY
4,,SING,CA,C,no,N,4,,168004,30144,DLY
5,,SING,CA,CB,no,N,5,,168004,30144,DLY
6,,SING,CA,HA,no,N,6,,168004,30144,DLY
7,,DOUB,C,O,no,N,7,,168004,30144,DLY
8,,SING,C,OXT,no,N,8,,168004,30144,DLY
9,,SING,CB,CG,no,N,9,,168004,30144,DLY
10,,SING,CB,HB2,no,N,10,,168004,30144,DLY
11,,SING,CB,HB3,no,N,11,,168004,30144,DLY
12,,SING,CG,CD,no,N,12,,168004,30144,DLY
13,,SING,CG,HG2,no,N,13,,168004,30144,DLY
14,,SING,CG,HG3,no,N,14,,168004,30144,DLY
15,,SING,CD,CE,no,N,15,,168004,30144,DLY
16,,SING,CD,HD2,no,N,16,,168004,30144,DLY
17,,SING,CD,HD3,no,N,17,,168004,30144,DLY
18,,SING,CE,NZ,no,N,18,,168004,30144,DLY
19,,SING,CE,HE2,no,N,19,,168004,30144,DLY
20,,SING,CE,HE3,no,N,20,,168004,30144,DLY
21,,SING,NZ,HZ1,no,N,21,,168004,30144,DLY
22,,SING,NZ,HZ2,no,N,22,,168004,30144,DLY
23,,SING,OXT,HXT,no,N,23,,168004,30144,DLY
1,,SING,N,CA,no,N,1,,168005,30144,DPR
2,,SING,N,CD,no,N,2,,168005,30144,DPR
3,,SING,N,H,no,N,3,,168005,30144,DPR
4,,SING,CA,CB,no,N,4,,168005,30144,DPR
5,,SING,CA,C,no,N,5,,168005,30144,DPR
6,,SING,CA,HA,no,N,6,,168005,30144,DPR
7,,SING,CB,CG,no,N,7,,168005,30144,DPR
8,,SING,CB,HB2,no,N,8,,168005,30144,DPR
9,,SING,CB,HB3,no,N,9,,168005,30144,DPR
10,,SING,CG,CD,no,N,10,,168005,30144,DPR
11,,SING,CG,HG2,no,N,11,,168005,30144,DPR
12,,SING,CG,HG3,no,N,12,,168005,30144,DPR
13,,SING,CD,HD2,no,N,13,,168005,30144,DPR
14,,SING,CD,HD3,no,N,14,,168005,30144,DPR
15,,DOUB,C,O,no,N,15,,168005,30144,DPR
16,,SING,C,OXT,no,N,16,,168005,30144,DPR
17,,SING,OXT,HXT,no,N,17,,168005,30144,DPR
1,,SING,N,CA,no,N,1,,168042,30146,DPR
2,,SING,N,CD,no,N,2,,168042,30146,DPR
3,,SING,N,H,no,N,3,,168042,30146,DPR
4,,SING,CA,CB,no,N,4,,168042,30146,DPR
5,,SING,CA,C,no,N,5,,168042,30146,DPR
6,,SING,CA,HA,no,N,6,,168042,30146,DPR
7,,SING,CB,CG,no,N,7,,168042,30146,DPR
8,,SING,CB,HB2,no,N,8,,168042,30146,DPR
9,,SING,CB,HB3,no,N,9,,168042,30146,DPR
10,,SING,CG,CD,no,N,10,,168042,30146,DPR
11,,SING,CG,HG2,no,N,11,,168042,30146,DPR
12,,SING,CG,HG3,no,N,12,,168042,30146,DPR
13,,SING,CD,HD2,no,N,13,,168042,30146,DPR
14,,SING,CD,HD3,no,N,14,,168042,30146,DPR
15,,DOUB,C,O,no,N,15,,168042,30146,DPR
16,,SING,C,OXT,no,N,16,,168042,30146,DPR
17,,SING,OXT,HXT,no,N,17,,168042,30146,DPR
1,,SING,N1,C2,no,N,1,,168080,30148,5CM
2,,SING,N1,C6,no,N,2,,168080,30148,5CM
3,,SING,N1,C1',no,N,3,,168080,30148,5CM
4,,SING,C2,N3,no,N,4,,168080,30148,5CM
5,,DOUB,C2,O2,no,N,5,,168080,30148,5CM
6,,DOUB,N3,C4,no,N,6,,168080,30148,5CM
7,,SING,C4,C5,no,N,7,,168080,30148,5CM
8,,SING,C4,N4,no,N,8,,168080,30148,5CM
9,,SING,C5,C5A,no,N,9,,168080,30148,5CM
10,,DOUB,C5,C6,no,N,10,,168080,30148,5CM
11,,SING,C5A,H5A1,no,N,11,,168080,30148,5CM
12,,SING,C5A,H5A2,no,N,12,,168080,30148,5CM
13,,SING,C5A,H5A3,no,N,13,,168080,30148,5CM
14,,SING,C6,H6,no,N,14,,168080,30148,5CM
15,,SING,N4,HN41,no,N,15,,168080,30148,5CM
16,,SING,N4,HN42,no,N,16,,168080,30148,5CM
17,,SING,C1',C2',no,N,17,,168080,30148,5CM
18,,SING,C1',O4',no,N,18,,168080,30148,5CM
19,,SING,C1',H1',no,N,19,,168080,30148,5CM
20,,SING,C2',C3',no,N,20,,168080,30148,5CM
21,,SING,C2',H2',no,N,21,,168080,30148,5CM
22,,SING,C2',H2'',no,N,22,,168080,30148,5CM
23,,SING,C3',C4',no,N,23,,168080,30148,5CM
24,,SING,C3',O3',no,N,24,,168080,30148,5CM
25,,SING,C3',H3',no,N,25,,168080,30148,5CM
26,,SING,C4',O4',no,N,26,,168080,30148,5CM
27,,SING,C4',C5',no,N,27,,168080,30148,5CM
28,,SING,C4',H4',no,N,28,,168080,30148,5CM
29,,SING,O3',HO3',no,N,29,,168080,30148,5CM
30,,SING,C5',O5',no,N,30,,168080,30148,5CM
31,,SING,C5',H5',no,N,31,,168080,30148,5CM
32,,SING,C5',H5'',no,N,32,,168080,30148,5CM
33,,SING,O5',P,no,N,33,,168080,30148,5CM
34,,DOUB,P,OP1,no,N,34,,168080,30148,5CM
35,,SING,P,OP2,no,N,35,,168080,30148,5CM
36,,SING,P,OP3,no,N,36,,168080,30148,5CM
37,,SING,OP2,HOP2,no,N,37,,168080,30148,5CM
38,,SING,OP3,HOP3,no,N,38,,168080,30148,5CM
1,,SING,N1,C2,no,N,1,,168146,30151,5CM
2,,SING,N1,C6,no,N,2,,168146,30151,5CM
3,,SING,N1,C1',no,N,3,,168146,30151,5CM
4,,SING,C2,N3,no,N,4,,168146,30151,5CM
5,,DOUB,C2,O2,no,N,5,,168146,30151,5CM
6,,DOUB,N3,C4,no,N,6,,168146,30151,5CM
7,,SING,C4,C5,no,N,7,,168146,30151,5CM
8,,SING,C4,N4,no,N,8,,168146,30151,5CM
9,,SING,C5,C5A,no,N,9,,168146,30151,5CM
10,,DOUB,C5,C6,no,N,10,,168146,30151,5CM
11,,SING,C5A,H5A1,no,N,11,,168146,30151,5CM
12,,SING,C5A,H5A2,no,N,12,,168146,30151,5CM
13,,SING,C5A,H5A3,no,N,13,,168146,30151,5CM
14,,SING,C6,H6,no,N,14,,168146,30151,5CM
15,,SING,N4,HN41,no,N,15,,168146,30151,5CM
16,,SING,N4,HN42,no,N,16,,168146,30151,5CM
17,,SING,C1',C2',no,N,17,,168146,30151,5CM
18,,SING,C1',O4',no,N,18,,168146,30151,5CM
19,,SING,C1',H1',no,N,19,,168146,30151,5CM
20,,SING,C2',C3',no,N,20,,168146,30151,5CM
21,,SING,C2',H2',no,N,21,,168146,30151,5CM
22,,SING,C2',H2'',no,N,22,,168146,30151,5CM
23,,SING,C3',C4',no,N,23,,168146,30151,5CM
24,,SING,C3',O3',no,N,24,,168146,30151,5CM
25,,SING,C3',H3',no,N,25,,168146,30151,5CM
26,,SING,C4',O4',no,N,26,,168146,30151,5CM
27,,SING,C4',C5',no,N,27,,168146,30151,5CM
28,,SING,C4',H4',no,N,28,,168146,30151,5CM
29,,SING,O3',HO3',no,N,29,,168146,30151,5CM
30,,SING,C5',O5',no,N,30,,168146,30151,5CM
31,,SING,C5',H5',no,N,31,,168146,30151,5CM
32,,SING,C5',H5'',no,N,32,,168146,30151,5CM
33,,SING,O5',P,no,N,33,,168146,30151,5CM
34,,DOUB,P,OP1,no,N,34,,168146,30151,5CM
35,,SING,P,OP2,no,N,35,,168146,30151,5CM
36,,SING,P,OP3,no,N,36,,168146,30151,5CM
37,,SING,OP2,HOP2,no,N,37,,168146,30151,5CM
38,,SING,OP3,HOP3,no,N,38,,168146,30151,5CM
1,,SING,N,CA,no,N,1,,168168,30152,DTR
2,,SING,N,H,no,N,2,,168168,30152,DTR
3,,SING,N,HN2,no,N,3,,168168,30152,DTR
4,,SING,CA,CB,no,N,4,,168168,30152,DTR
5,,SING,CA,C,no,N,5,,168168,30152,DTR
6,,SING,CA,HA,no,N,6,,168168,30152,DTR
7,,SING,CB,CG,no,N,7,,168168,30152,DTR
8,,SING,CB,HB2,no,N,8,,168168,30152,DTR
9,,SING,CB,HB3,no,N,9,,168168,30152,DTR
10,,DOUB,CG,CD1,yes,N,10,,168168,30152,DTR
11,,SING,CG,CD2,yes,N,11,,168168,30152,DTR
12,,SING,CD1,NE1,yes,N,12,,168168,30152,DTR
13,,SING,CD1,HD1,no,N,13,,168168,30152,DTR
14,,SING,NE1,CE2,yes,N,14,,168168,30152,DTR
15,,SING,NE1,HE1,no,N,15,,168168,30152,DTR
16,,DOUB,CE2,CZ2,yes,N,16,,168168,30152,DTR
17,,SING,CE2,CD2,yes,N,17,,168168,30152,DTR
18,,SING,CZ2,CH2,yes,N,18,,168168,30152,DTR
19,,SING,CZ2,HZ2,no,N,19,,168168,30152,DTR
20,,DOUB,CH2,CZ3,yes,N,20,,168168,30152,DTR
21,,SING,CH2,HH2,no,N,21,,168168,30152,DTR
22,,SING,CZ3,CE3,yes,N,22,,168168,30152,DTR
23,,SING,CZ3,HZ3,no,N,23,,168168,30152,DTR
24,,DOUB,CE3,CD2,yes,N,24,,168168,30152,DTR
25,,SING,CE3,HE3,no,N,25,,168168,30152,DTR
26,,DOUB,C,O,no,N,26,,168168,30152,DTR
27,,SING,C,OXT,no,N,27,,168168,30152,DTR
28,,SING,OXT,HXT,no,N,28,,168168,30152,DTR
1,,SING,N,HN1,no,N,1,,168169,30152,NH2
2,,SING,N,HN2,no,N,2,,168169,30152,NH2
1,,SING,N,HN1,no,N,1,,168460,30167,NH2
2,,SING,N,HN2,no,N,2,,168460,30167,NH2
1,,SING,N,HN1,no,N,1,,168477,30168,NH2
2,,SING,N,HN2,no,N,2,,168477,30168,NH2
1,,SING,N,CA,no,N,1,,168542,30176,CGU
2,,SING,N,H,no,N,2,,168542,30176,CGU
3,,SING,N,HN2,no,N,3,,168542,30176,CGU
4,,SING,CA,C,no,N,4,,168542,30176,CGU
5,,SING,CA,CB,no,N,5,,168542,30176,CGU
6,,SING,CA,HA,no,N,6,,168542,30176,CGU
7,,DOUB,C,O,no,N,7,,168542,30176,CGU
8,,SING,C,OXT,no,N,8,,168542,30176,CGU
9,,SING,OXT,HXT,no,N,9,,168542,30176,CGU
10,,SING,CB,CG,no,N,10,,168542,30176,CGU
11,,SING,CB,HB2,no,N,11,,168542,30176,CGU
12,,SING,CB,HB3,no,N,12,,168542,30176,CGU
13,,SING,CG,CD1,no,N,13,,168542,30176,CGU
14,,SING,CG,CD2,no,N,14,,168542,30176,CGU
15,,SING,CG,HG,no,N,15,,168542,30176,CGU
16,,DOUB,CD1,OE11,no,N,16,,168542,30176,CGU
17,,SING,CD1,OE12,no,N,17,,168542,30176,CGU
18,,DOUB,CD2,OE21,no,N,18,,168542,30176,CGU
19,,SING,CD2,OE22,no,N,19,,168542,30176,CGU
20,,SING,OE12,HE12,no,N,20,,168542,30176,CGU
21,,SING,OE22,HE22,no,N,21,,168542,30176,CGU
1,,SING,N,HN1,no,N,1,,168543,30176,NH2
2,,SING,N,HN2,no,N,2,,168543,30176,NH2
1,,SING,N,CA,no,N,1,,168563,30177,MLY
2,,SING,N,H,no,N,2,,168563,30177,MLY
3,,SING,N,H2,no,N,3,,168563,30177,MLY
4,,SING,CA,CB,no,N,4,,168563,30177,MLY
5,,SING,CA,C,no,N,5,,168563,30177,MLY
6,,SING,CA,HA,no,N,6,,168563,30177,MLY
7,,SING,CB,CG,no,N,7,,168563,30177,MLY
8,,SING,CB,HB2,no,N,8,,168563,30177,MLY
9,,SING,CB,HB3,no,N,9,,168563,30177,MLY
10,,SING,CG,CD,no,N,10,,168563,30177,MLY
11,,SING,CG,HG2,no,N,11,,168563,30177,MLY
12,,SING,CG,HG3,no,N,12,,168563,30177,MLY
13,,SING,CD,CE,no,N,13,,168563,30177,MLY
14,,SING,CD,HD2,no,N,14,,168563,30177,MLY
15,,SING,CD,HD3,no,N,15,,168563,30177,MLY
16,,SING,CE,NZ,no,N,16,,168563,30177,MLY
17,,SING,CE,HE2,no,N,17,,168563,30177,MLY
18,,SING,CE,HE3,no,N,18,,168563,30177,MLY
19,,SING,NZ,CH1,no,N,19,,168563,30177,MLY
20,,SING,NZ,CH2,no,N,20,,168563,30177,MLY
21,,SING,CH1,HH11,no,N,21,,168563,30177,MLY
22,,SING,CH1,HH12,no,N,22,,168563,30177,MLY
23,,SING,CH1,HH13,no,N,23,,168563,30177,MLY
24,,SING,CH2,HH21,no,N,24,,168563,30177,MLY
25,,SING,CH2,HH22,no,N,25,,168563,30177,MLY
26,,SING,CH2,HH23,no,N,26,,168563,30177,MLY
27,,DOUB,C,O,no,N,27,,168563,30177,MLY
28,,SING,C,OXT,no,N,28,,168563,30177,MLY
29,,SING,OXT,HXT,no,N,29,,168563,30177,MLY
1,,SING,N,HN1,no,N,1,,168564,30177,NH2
2,,SING,N,HN2,no,N,2,,168564,30177,NH2
1,,SING,N,CA,no,N,1,,168588,30178,CGU
2,,SING,N,H,no,N,2,,168588,30178,CGU
3,,SING,N,HN2,no,N,3,,168588,30178,CGU
4,,SING,CA,C,no,N,4,,168588,30178,CGU
5,,SING,CA,CB,no,N,5,,168588,30178,CGU
6,,SING,CA,HA,no,N,6,,168588,30178,CGU
7,,DOUB,C,O,no,N,7,,168588,30178,CGU
8,,SING,C,OXT,no,N,8,,168588,30178,CGU
9,,SING,OXT,HXT,no,N,9,,168588,30178,CGU
10,,SING,CB,CG,no,N,10,,168588,30178,CGU
11,,SING,CB,HB2,no,N,11,,168588,30178,CGU
12,,SING,CB,HB3,no,N,12,,168588,30178,CGU
13,,SING,CG,CD1,no,N,13,,168588,30178,CGU
14,,SING,CG,CD2,no,N,14,,168588,30178,CGU
15,,SING,CG,HG,no,N,15,,168588,30178,CGU
16,,DOUB,CD1,OE11,no,N,16,,168588,30178,CGU
17,,SING,CD1,OE12,no,N,17,,168588,30178,CGU
18,,DOUB,CD2,OE21,no,N,18,,168588,30178,CGU
19,,SING,CD2,OE22,no,N,19,,168588,30178,CGU
20,,SING,OE12,HE12,no,N,20,,168588,30178,CGU
21,,SING,OE22,HE22,no,N,21,,168588,30178,CGU
1,,SING,N,HN1,no,N,1,,168589,30178,NH2
2,,SING,N,HN2,no,N,2,,168589,30178,NH2
1,,SING,N,CA,no,N,1,,168606,30179,CGU
2,,SING,N,H,no,N,2,,168606,30179,CGU
3,,SING,N,HN2,no,N,3,,168606,30179,CGU
4,,SING,CA,C,no,N,4,,168606,30179,CGU
5,,SING,CA,CB,no,N,5,,168606,30179,CGU
6,,SING,CA,HA,no,N,6,,168606,30179,CGU
7,,DOUB,C,O,no,N,7,,168606,30179,CGU
8,,SING,C,OXT,no,N,8,,168606,30179,CGU
9,,SING,OXT,HXT,no,N,9,,168606,30179,CGU
10,,SING,CB,CG,no,N,10,,168606,30179,CGU
11,,SING,CB,HB2,no,N,11,,168606,30179,CGU
12,,SING,CB,HB3,no,N,12,,168606,30179,CGU
13,,SING,CG,CD1,no,N,13,,168606,30179,CGU
14,,SING,CG,CD2,no,N,14,,168606,30179,CGU
15,,SING,CG,HG,no,N,15,,168606,30179,CGU
16,,DOUB,CD1,OE11,no,N,16,,168606,30179,CGU
17,,SING,CD1,OE12,no,N,17,,168606,30179,CGU
18,,DOUB,CD2,OE21,no,N,18,,168606,30179,CGU
19,,SING,CD2,OE22,no,N,19,,168606,30179,CGU
20,,SING,OE12,HE12,no,N,20,,168606,30179,CGU
21,,SING,OE22,HE22,no,N,21,,168606,30179,CGU
1,,SING,N,HN1,no,N,1,,168607,30179,NH2
2,,SING,N,HN2,no,N,2,,168607,30179,NH2
1,,SING,N,HN1,no,N,1,,168625,30180,NH2
2,,SING,N,HN2,no,N,2,,168625,30180,NH2
1,,SING,OP3,P,no,N,1,,168661,30184,DT
2,,SING,OP3,HOP3,no,N,2,,168661,30184,DT
3,,DOUB,P,OP1,no,N,3,,168661,30184,DT
4,,SING,P,OP2,no,N,4,,168661,30184,DT
5,,SING,P,O5',no,N,5,,168661,30184,DT
6,,SING,OP2,HOP2,no,N,6,,168661,30184,DT
7,,SING,O5',C5',no,N,7,,168661,30184,DT
8,,SING,C5',C4',no,N,8,,168661,30184,DT
9,,SING,C5',H5',no,N,9,,168661,30184,DT
10,,SING,C5',H5'',no,N,10,,168661,30184,DT
11,,SING,C4',O4',no,N,11,,168661,30184,DT
12,,SING,C4',C3',no,N,12,,168661,30184,DT
13,,SING,C4',H4',no,N,13,,168661,30184,DT
14,,SING,O4',C1',no,N,14,,168661,30184,DT
15,,SING,C3',O3',no,N,15,,168661,30184,DT
16,,SING,C3',C2',no,N,16,,168661,30184,DT
17,,SING,C3',H3',no,N,17,,168661,30184,DT
18,,SING,O3',HO3',no,N,18,,168661,30184,DT
19,,SING,C2',C1',no,N,19,,168661,30184,DT
20,,SING,C2',H2',no,N,20,,168661,30184,DT
21,,SING,C2',H2'',no,N,21,,168661,30184,DT
22,,SING,C1',N1,no,N,22,,168661,30184,DT
23,,SING,C1',H1',no,N,23,,168661,30184,DT
24,,SING,N1,C2,no,N,24,,168661,30184,DT
25,,SING,N1,C6,no,N,25,,168661,30184,DT
26,,DOUB,C2,O2,no,N,26,,168661,30184,DT
27,,SING,C2,N3,no,N,27,,168661,30184,DT
28,,SING,N3,C4,no,N,28,,168661,30184,DT
29,,SING,N3,H3,no,N,29,,168661,30184,DT
30,,DOUB,C4,O4,no,N,30,,168661,30184,DT
31,,SING,C4,C5,no,N,31,,168661,30184,DT
32,,SING,C5,C7,no,N,32,,168661,30184,DT
33,,DOUB,C5,C6,no,N,33,,168661,30184,DT
34,,SING,C7,H71,no,N,34,,168661,30184,DT
35,,SING,C7,H72,no,N,35,,168661,30184,DT
36,,SING,C7,H73,no,N,36,,168661,30184,DT
37,,SING,C6,H6,no,N,37,,168661,30184,DT
1,,DOUB,P,OP1,no,N,1,,168662,30184,A2M
2,,SING,P,OP3,no,N,2,,168662,30184,A2M
3,,SING,P,O5',no,N,3,,168662,30184,A2M
4,,SING,OP3,HOP3,no,N,4,,168662,30184,A2M
5,,SING,O5',C5',no,N,5,,168662,30184,A2M
6,,SING,C5',C4',no,N,6,,168662,30184,A2M
7,,SING,C5',H5',no,N,7,,168662,30184,A2M
8,,SING,C5',H5'',no,N,8,,168662,30184,A2M
9,,SING,C4',O4',no,N,9,,168662,30184,A2M
10,,SING,C4',C3',no,N,10,,168662,30184,A2M
11,,SING,C4',H4',no,N,11,,168662,30184,A2M
12,,SING,O4',C1',no,N,12,,168662,30184,A2M
13,,SING,C3',O3',no,N,13,,168662,30184,A2M
14,,SING,C3',C2',no,N,14,,168662,30184,A2M
15,,SING,C3',H3',no,N,15,,168662,30184,A2M
16,,SING,O3',HO3',no,N,16,,168662,30184,A2M
17,,SING,C2',O2',no,N,17,,168662,30184,A2M
18,,SING,C2',C1',no,N,18,,168662,30184,A2M
19,,SING,C2',H2',no,N,19,,168662,30184,A2M
20,,SING,O2',CM',no,N,20,,168662,30184,A2M
21,,SING,C1',N9,no,N,21,,168662,30184,A2M
22,,SING,C1',H1',no,N,22,,168662,30184,A2M
23,,SING,CM',HM'1,no,N,23,,168662,30184,A2M
24,,SING,CM',HM'2,no,N,24,,168662,30184,A2M
25,,SING,CM',HM'3,no,N,25,,168662,30184,A2M
26,,SING,N9,C8,yes,N,26,,168662,30184,A2M
27,,SING,N9,C4,yes,N,27,,168662,30184,A2M
28,,DOUB,C8,N7,yes,N,28,,168662,30184,A2M
29,,SING,C8,H8,no,N,29,,168662,30184,A2M
30,,SING,N7,C5,yes,N,30,,168662,30184,A2M
31,,SING,C5,C6,yes,N,31,,168662,30184,A2M
32,,DOUB,C5,C4,yes,N,32,,168662,30184,A2M
33,,SING,C6,N6,no,N,33,,168662,30184,A2M
34,,DOUB,C6,N1,yes,N,34,,168662,30184,A2M
35,,SING,N6,H61,no,N,35,,168662,30184,A2M
36,,SING,N6,H62,no,N,36,,168662,30184,A2M
37,,SING,N1,C2,yes,N,37,,168662,30184,A2M
38,,DOUB,C2,N3,yes,N,38,,168662,30184,A2M
39,,SING,C2,H2,no,N,39,,168662,30184,A2M
40,,SING,N3,C4,yes,N,40,,168662,30184,A2M
41,,SING,P,OP2,no,N,41,,168662,30184,A2M
42,,SING,OP2,HOP2,no,N,42,,168662,30184,A2M
1,,SING,OP3,P,no,N,1,,168663,30184,DA
2,,SING,OP3,HOP3,no,N,2,,168663,30184,DA
3,,DOUB,P,OP1,no,N,3,,168663,30184,DA
4,,SING,P,OP2,no,N,4,,168663,30184,DA
5,,SING,P,O5',no,N,5,,168663,30184,DA
6,,SING,OP2,HOP2,no,N,6,,168663,30184,DA
7,,SING,O5',C5',no,N,7,,168663,30184,DA
8,,SING,C5',C4',no,N,8,,168663,30184,DA
9,,SING,C5',H5',no,N,9,,168663,30184,DA
10,,SING,C5',H5'',no,N,10,,168663,30184,DA
11,,SING,C4',O4',no,N,11,,168663,30184,DA
12,,SING,C4',C3',no,N,12,,168663,30184,DA
13,,SING,C4',H4',no,N,13,,168663,30184,DA
14,,SING,O4',C1',no,N,14,,168663,30184,DA
15,,SING,C3',O3',no,N,15,,168663,30184,DA
16,,SING,C3',C2',no,N,16,,168663,30184,DA
17,,SING,C3',H3',no,N,17,,168663,30184,DA
18,,SING,O3',HO3',no,N,18,,168663,30184,DA
19,,SING,C2',C1',no,N,19,,168663,30184,DA
20,,SING,C2',H2',no,N,20,,168663,30184,DA
21,,SING,C2',H2'',no,N,21,,168663,30184,DA
22,,SING,C1',N9,no,N,22,,168663,30184,DA
23,,SING,C1',H1',no,N,23,,168663,30184,DA
24,,SING,N9,C8,yes,N,24,,168663,30184,DA
25,,SING,N9,C4,yes,N,25,,168663,30184,DA
26,,DOUB,C8,N7,yes,N,26,,168663,30184,DA
27,,SING,C8,H8,no,N,27,,168663,30184,DA
28,,SING,N7,C5,yes,N,28,,168663,30184,DA
29,,SING,C5,C6,yes,N,29,,168663,30184,DA
30,,DOUB,C5,C4,yes,N,30,,168663,30184,DA
31,,SING,C6,N6,no,N,31,,168663,30184,DA
32,,DOUB,C6,N1,yes,N,32,,168663,30184,DA
33,,SING,N6,H61,no,N,33,,168663,30184,DA
34,,SING,N6,H62,no,N,34,,168663,30184,DA
35,,SING,N1,C2,yes,N,35,,168663,30184,DA
36,,DOUB,C2,N3,yes,N,36,,168663,30184,DA
37,,SING,C2,H2,no,N,37,,168663,30184,DA
38,,SING,N3,C4,yes,N,38,,168663,30184,DA
1,,SING,F21C,C1FC,no,N,1,,168707,30186,7BU
2,,SING,F23C,C1FC,no,N,2,,168707,30186,7BU
3,,SING,C1FC,F22C,no,N,3,,168707,30186,7BU
4,,SING,C1FC,CHC,no,N,4,,168707,30186,7BU
5,,DOUB,C3B,C2B,no,N,5,,168707,30186,7BU
6,,SING,C3B,C4B,no,N,6,,168707,30186,7BU
7,,SING,C2B,C1B,no,N,7,,168707,30186,7BU
8,,SING,F22B,C1FB,no,N,8,,168707,30186,7BU
9,,DOUB,C4B,CHC,no,N,9,,168707,30186,7BU
10,,SING,C4B,NB2,no,N,10,,168707,30186,7BU
11,,SING,CHC,C1C,no,N,11,,168707,30186,7BU
12,,SING,F21B,C1FB,no,N,12,,168707,30186,7BU
13,,DOUB,C1B,NB2,no,N,13,,168707,30186,7BU
14,,SING,C1B,CHB,no,N,14,,168707,30186,7BU
15,,SING,C1FB,CHB,no,N,15,,168707,30186,7BU
16,,SING,C1FB,F23B,no,N,16,,168707,30186,7BU
17,,SING,NB2,ZN,no,N,17,,168707,30186,7BU
18,,DOUB,C1C,C2C,yes,N,18,,168707,30186,7BU
19,,SING,C1C,NC3,yes,N,19,,168707,30186,7BU
20,,DOUB,CHB,C4A,no,N,20,,168707,30186,7BU
21,,SING,C2C,C3C,yes,N,21,,168707,30186,7BU
22,,SING,C4A,C3A,no,N,22,,168707,30186,7BU
23,,SING,C4A,NA1,no,N,23,,168707,30186,7BU
24,,SING,NC3,ZN,no,N,24,,168707,30186,7BU
25,,SING,NC3,C4C,yes,N,25,,168707,30186,7BU
26,,DOUB,C3C,C4C,yes,N,26,,168707,30186,7BU
27,,DOUB,C3A,C2A,no,N,27,,168707,30186,7BU
28,,SING,ZN,NA1,no,N,28,,168707,30186,7BU
29,,SING,ZN,ND4,no,N,29,,168707,30186,7BU
30,,SING,NA1,C1A,no,N,30,,168707,30186,7BU
31,,SING,C4C,CHD,no,N,31,,168707,30186,7BU
32,,SING,C2A,C1A,no,N,32,,168707,30186,7BU
33,,DOUB,C1A,CHA,no,N,33,,168707,30186,7BU
34,,SING,ND4,C1D,no,N,34,,168707,30186,7BU
35,,DOUB,ND4,C4D,no,N,35,,168707,30186,7BU
36,,DOUB,CHD,C1D,no,N,36,,168707,30186,7BU
37,,SING,CHD,C1FD,no,N,37,,168707,30186,7BU
38,,SING,F22A,C1FA,no,N,38,,168707,30186,7BU
39,,SING,CHA,C4D,no,N,39,,168707,30186,7BU
40,,SING,CHA,C1FA,no,N,40,,168707,30186,7BU
41,,SING,C1D,C2D,no,N,41,,168707,30186,7BU
42,,SING,C4D,C3D,no,N,42,,168707,30186,7BU
43,,SING,F21D,C1FD,no,N,43,,168707,30186,7BU
44,,SING,F23D,C1FD,no,N,44,,168707,30186,7BU
45,,SING,C1FD,F22D,no,N,45,,168707,30186,7BU
46,,SING,C1FA,F23A,no,N,46,,168707,30186,7BU
47,,SING,C1FA,F21A,no,N,47,,168707,30186,7BU
48,,DOUB,C2D,C3D,no,N,48,,168707,30186,7BU
49,,SING,C2A,H2A1,no,N,49,,168707,30186,7BU
50,,SING,C2B,H2B1,no,N,50,,168707,30186,7BU
51,,SING,C2C,H2C1,no,N,51,,168707,30186,7BU
52,,SING,C2D,H2D1,no,N,52,,168707,30186,7BU
53,,SING,C3A,H3A1,no,N,53,,168707,30186,7BU
54,,SING,C3B,H3B1,no,N,54,,168707,30186,7BU
55,,SING,C3C,H3C1,no,N,55,,168707,30186,7BU
56,,SING,C3D,H3D1,no,N,56,,168707,30186,7BU
1,,SING,NAB,NAO,no,N,1,,168746,30189,1YO
2,,SING,NAO,CAG,yes,N,2,,168746,30189,1YO
3,,SING,NAO,CAN,yes,N,3,,168746,30189,1YO
4,,SING,SAK,CAN,no,N,4,,168746,30189,1YO
5,,SING,SAK,CAH,no,N,5,,168746,30189,1YO
6,,DOUB,CAG,NAI,yes,N,6,,168746,30189,1YO
7,,SING,CAA,CAL,no,N,7,,168746,30189,1YO
8,,DOUB,CAN,NAJ,yes,N,8,,168746,30189,1YO
9,,DOUB,CAL,CAE,yes,N,9,,168746,30189,1YO
10,,SING,CAL,CAM,yes,N,10,,168746,30189,1YO
11,,SING,CAE,CAC,yes,N,11,,168746,30189,1YO
12,,SING,CAM,CAH,no,N,12,,168746,30189,1YO
13,,DOUB,CAM,CAF,yes,N,13,,168746,30189,1YO
14,,DOUB,CAC,CAD,yes,N,14,,168746,30189,1YO
15,,SING,NAI,NAJ,yes,N,15,,168746,30189,1YO
16,,SING,CAF,CAD,yes,N,16,,168746,30189,1YO
17,,SING,CAA,HAC,no,N,17,,168746,30189,1YO
18,,SING,CAA,HAA,no,N,18,,168746,30189,1YO
19,,SING,CAA,HAB,no,N,19,,168746,30189,1YO
20,,SING,CAC,HAD,no,N,20,,168746,30189,1YO
21,,SING,CAD,HAE,no,N,21,,168746,30189,1YO
22,,SING,CAE,HAF,no,N,22,,168746,30189,1YO
23,,SING,CAF,HAG,no,N,23,,168746,30189,1YO
24,,SING,CAG,HAH,no,N,24,,168746,30189,1YO
25,,SING,CAH,HAI,no,N,25,,168746,30189,1YO
26,,SING,CAH,HAJ,no,N,26,,168746,30189,1YO
27,,SING,NAB,HAL,no,N,27,,168746,30189,1YO
28,,SING,NAB,HAK,no,N,28,,168746,30189,1YO
1,,SING,N,HN1,no,N,1,,168764,30190,NH2
2,,SING,N,HN2,no,N,2,,168764,30190,NH2
1,,SING,N1,C2,no,N,1,,168788,30191,5CM
2,,SING,N1,C6,no,N,2,,168788,30191,5CM
3,,SING,N1,C1',no,N,3,,168788,30191,5CM
4,,SING,C2,N3,no,N,4,,168788,30191,5CM
5,,DOUB,C2,O2,no,N,5,,168788,30191,5CM
6,,DOUB,N3,C4,no,N,6,,168788,30191,5CM
7,,SING,C4,C5,no,N,7,,168788,30191,5CM
8,,SING,C4,N4,no,N,8,,168788,30191,5CM
9,,SING,C5,C5A,no,N,9,,168788,30191,5CM
10,,DOUB,C5,C6,no,N,10,,168788,30191,5CM
11,,SING,C5A,H5A1,no,N,11,,168788,30191,5CM
12,,SING,C5A,H5A2,no,N,12,,168788,30191,5CM
13,,SING,C5A,H5A3,no,N,13,,168788,30191,5CM
14,,SING,C6,H6,no,N,14,,168788,30191,5CM
15,,SING,N4,HN41,no,N,15,,168788,30191,5CM
16,,SING,N4,HN42,no,N,16,,168788,30191,5CM
17,,SING,C1',C2',no,N,17,,168788,30191,5CM
18,,SING,C1',O4',no,N,18,,168788,30191,5CM
19,,SING,C1',H1',no,N,19,,168788,30191,5CM
20,,SING,C2',C3',no,N,20,,168788,30191,5CM
21,,SING,C2',H2',no,N,21,,168788,30191,5CM
22,,SING,C2',H2'',no,N,22,,168788,30191,5CM
23,,SING,C3',C4',no,N,23,,168788,30191,5CM
24,,SING,C3',O3',no,N,24,,168788,30191,5CM
25,,SING,C3',H3',no,N,25,,168788,30191,5CM
26,,SING,C4',O4',no,N,26,,168788,30191,5CM
27,,SING,C4',C5',no,N,27,,168788,30191,5CM
28,,SING,C4',H4',no,N,28,,168788,30191,5CM
29,,SING,O3',HO3',no,N,29,,168788,30191,5CM
30,,SING,C5',O5',no,N,30,,168788,30191,5CM
31,,SING,C5',H5',no,N,31,,168788,30191,5CM
32,,SING,C5',H5'',no,N,32,,168788,30191,5CM
33,,SING,O5',P,no,N,33,,168788,30191,5CM
34,,DOUB,P,OP1,no,N,34,,168788,30191,5CM
35,,SING,P,OP2,no,N,35,,168788,30191,5CM
36,,SING,P,OP3,no,N,36,,168788,30191,5CM
37,,SING,OP2,HOP2,no,N,37,,168788,30191,5CM
38,,SING,OP3,HOP3,no,N,38,,168788,30191,5CM
1,,SING,N,CA,no,N,1,,168896,30197,SEP
2,,SING,N,H,no,N,2,,168896,30197,SEP
3,,SING,N,H2,no,N,3,,168896,30197,SEP
4,,SING,CA,CB,no,N,4,,168896,30197,SEP
5,,SING,CA,C,no,N,5,,168896,30197,SEP
6,,SING,CA,HA,no,N,6,,168896,30197,SEP
7,,SING,CB,OG,no,N,7,,168896,30197,SEP
8,,SING,CB,HB2,no,N,8,,168896,30197,SEP
9,,SING,CB,HB3,no,N,9,,168896,30197,SEP
10,,SING,OG,P,no,N,10,,168896,30197,SEP
11,,DOUB,C,O,no,N,11,,168896,30197,SEP
12,,SING,C,OXT,no,N,12,,168896,30197,SEP
13,,SING,OXT,HXT,no,N,13,,168896,30197,SEP
14,,DOUB,P,O1P,no,N,14,,168896,30197,SEP
15,,SING,P,O2P,no,N,15,,168896,30197,SEP
16,,SING,P,O3P,no,N,16,,168896,30197,SEP
17,,SING,O2P,HOP2,no,N,17,,168896,30197,SEP
18,,SING,O3P,HOP3,no,N,18,,168896,30197,SEP
1,,SING,N1,C2,no,N,1,,168918,30198,5CM
2,,SING,N1,C6,no,N,2,,168918,30198,5CM
3,,SING,N1,C1',no,N,3,,168918,30198,5CM
4,,SING,C2,N3,no,N,4,,168918,30198,5CM
5,,DOUB,C2,O2,no,N,5,,168918,30198,5CM
6,,DOUB,N3,C4,no,N,6,,168918,30198,5CM
7,,SING,C4,C5,no,N,7,,168918,30198,5CM
8,,SING,C4,N4,no,N,8,,168918,30198,5CM
9,,SING,C5,C5A,no,N,9,,168918,30198,5CM
10,,DOUB,C5,C6,no,N,10,,168918,30198,5CM
11,,SING,C5A,H5A1,no,N,11,,168918,30198,5CM
12,,SING,C5A,H5A2,no,N,12,,168918,30198,5CM
13,,SING,C5A,H5A3,no,N,13,,168918,30198,5CM
14,,SING,C6,H6,no,N,14,,168918,30198,5CM
15,,SING,N4,HN41,no,N,15,,168918,30198,5CM
16,,SING,N4,HN42,no,N,16,,168918,30198,5CM
17,,SING,C1',C2',no,N,17,,168918,30198,5CM
18,,SING,C1',O4',no,N,18,,168918,30198,5CM
19,,SING,C1',H1',no,N,19,,168918,30198,5CM
20,,SING,C2',C3',no,N,20,,168918,30198,5CM
21,,SING,C2',H2',no,N,21,,168918,30198,5CM
22,,SING,C2',H2'',no,N,22,,168918,30198,5CM
23,,SING,C3',C4',no,N,23,,168918,30198,5CM
24,,SING,C3',O3',no,N,24,,168918,30198,5CM
25,,SING,C3',H3',no,N,25,,168918,30198,5CM
26,,SING,C4',O4',no,N,26,,168918,30198,5CM
27,,SING,C4',C5',no,N,27,,168918,30198,5CM
28,,SING,C4',H4',no,N,28,,168918,30198,5CM
29,,SING,O3',HO3',no,N,29,,168918,30198,5CM
30,,SING,C5',O5',no,N,30,,168918,30198,5CM
31,,SING,C5',H5',no,N,31,,168918,30198,5CM
32,,SING,C5',H5'',no,N,32,,168918,30198,5CM
33,,SING,O5',P,no,N,33,,168918,30198,5CM
34,,DOUB,P,OP1,no,N,34,,168918,30198,5CM
35,,SING,P,OP2,no,N,35,,168918,30198,5CM
36,,SING,P,OP3,no,N,36,,168918,30198,5CM
37,,SING,OP2,HOP2,no,N,37,,168918,30198,5CM
38,,SING,OP3,HOP3,no,N,38,,168918,30198,5CM
1,,DOUB,C2,C1,yes,N,1,,168919,30198,80G
2,,SING,C1,C6,yes,N,2,,168919,30198,80G
3,,SING,C1,C7,yes,N,3,,168919,30198,80G
4,,SING,C3,C2,yes,N,4,,168919,30198,80G
5,,SING,C2,H2,no,N,5,,168919,30198,80G
6,,DOUB,C3,C4,yes,N,6,,168919,30198,80G
7,,SING,C3,H3,no,N,7,,168919,30198,80G
8,,SING,C12,C4,no,N,8,,168919,30198,80G
9,,SING,C4,C5,yes,N,9,,168919,30198,80G
10,,DOUB,C5,C6,yes,N,10,,168919,30198,80G
11,,SING,C5,H5,no,N,11,,168919,30198,80G
12,,SING,C6,H6,no,N,12,,168919,30198,80G
13,,SING,C7,S8,yes,N,13,,168919,30198,80G
14,,DOUB,C7,C11,yes,N,14,,168919,30198,80G
15,,SING,S8,C9,yes,N,15,,168919,30198,80G
16,,DOUB,C9,C10,yes,N,16,,168919,30198,80G
17,,SING,C9,H9,no,N,17,,168919,30198,80G
18,,SING,C11,C10,yes,N,18,,168919,30198,80G
19,,SING,C10,H10,no,N,19,,168919,30198,80G
20,,SING,C11,H11,no,N,20,,168919,30198,80G
21,,SING,C12,N13,no,N,21,,168919,30198,80G
22,,SING,C12,H12,no,N,22,,168919,30198,80G
23,,SING,C12,H12A,no,N,23,,168919,30198,80G
24,,SING,N13,HN13,no,N,24,,168919,30198,80G
25,,SING,N13,HN1A,no,N,25,,168919,30198,80G
1,,SING,N,HN1,no,N,1,,168963,302,NH2
2,,SING,N,HN2,no,N,2,,168963,302,NH2
1,,SING,N,HN1,no,N,1,,169017,30202,NH2
2,,SING,N,HN2,no,N,2,,169017,30202,NH2
1,,DOUB,C1',O1',no,N,1,,169018,30202,UN1
2,,SING,C1',O2',no,N,2,,169018,30202,UN1
3,,SING,C1',C1,no,N,3,,169018,30202,UN1
4,,SING,O2',H2',no,N,4,,169018,30202,UN1
5,,DOUB,O58,C3,no,N,5,,169018,30202,UN1
6,,SING,C1,C6,no,N,6,,169018,30202,UN1
7,,SING,C1,H1C1,no,N,7,,169018,30202,UN1
8,,SING,C1,H1C2,no,N,8,,169018,30202,UN1
9,,SING,C3,C4,no,N,9,,169018,30202,UN1
10,,SING,C3,O5',no,N,10,,169018,30202,UN1
11,,SING,C4,C5,no,N,11,,169018,30202,UN1
12,,SING,C4,N4,no,N,12,,169018,30202,UN1
13,,SING,C4,H4,no,N,13,,169018,30202,UN1
14,,SING,C5,C6,no,N,14,,169018,30202,UN1
15,,SING,C5,H5C1,no,N,15,,169018,30202,UN1
16,,SING,C5,H5C2,no,N,16,,169018,30202,UN1
17,,SING,C6,H6C1,no,N,17,,169018,30202,UN1
18,,SING,C6,H6C2,no,N,18,,169018,30202,UN1
19,,SING,N4,H4N1,no,N,19,,169018,30202,UN1
20,,SING,N4,H4N2,no,N,20,,169018,30202,UN1
21,,SING,O5',H5',no,N,21,,169018,30202,UN1
1,,SING,N,HN1,no,N,1,,169035,30203,NH2
2,,SING,N,HN2,no,N,2,,169035,30203,NH2
1,,DOUB,C1',O1',no,N,1,,169036,30203,UN1
2,,SING,C1',O2',no,N,2,,169036,30203,UN1
3,,SING,C1',C1,no,N,3,,169036,30203,UN1
4,,SING,O2',H2',no,N,4,,169036,30203,UN1
5,,DOUB,O58,C3,no,N,5,,169036,30203,UN1
6,,SING,C1,C6,no,N,6,,169036,30203,UN1
7,,SING,C1,H1C1,no,N,7,,169036,30203,UN1
8,,SING,C1,H1C2,no,N,8,,169036,30203,UN1
9,,SING,C3,C4,no,N,9,,169036,30203,UN1
10,,SING,C3,O5',no,N,10,,169036,30203,UN1
11,,SING,C4,C5,no,N,11,,169036,30203,UN1
12,,SING,C4,N4,no,N,12,,169036,30203,UN1
13,,SING,C4,H4,no,N,13,,169036,30203,UN1
14,,SING,C5,C6,no,N,14,,169036,30203,UN1
15,,SING,C5,H5C1,no,N,15,,169036,30203,UN1
16,,SING,C5,H5C2,no,N,16,,169036,30203,UN1
17,,SING,C6,H6C1,no,N,17,,169036,30203,UN1
18,,SING,C6,H6C2,no,N,18,,169036,30203,UN1
19,,SING,N4,H4N1,no,N,19,,169036,30203,UN1
20,,SING,N4,H4N2,no,N,20,,169036,30203,UN1
21,,SING,O5',H5',no,N,21,,169036,30203,UN1
1,,DOUB,OH,CH,no,N,1,,169095,30206,ALY
2,,SING,CH,CH3,no,N,2,,169095,30206,ALY
3,,SING,CH,NZ,no,N,3,,169095,30206,ALY
4,,SING,CH3,HH31,no,N,4,,169095,30206,ALY
5,,SING,CH3,HH32,no,N,5,,169095,30206,ALY
6,,SING,CH3,HH33,no,N,6,,169095,30206,ALY
7,,SING,NZ,CE,no,N,7,,169095,30206,ALY
8,,SING,NZ,HZ,no,N,8,,169095,30206,ALY
9,,SING,CE,CD,no,N,9,,169095,30206,ALY
10,,SING,CE,HE3,no,N,10,,169095,30206,ALY
11,,SING,CE,HE2,no,N,11,,169095,30206,ALY
12,,SING,CD,CG,no,N,12,,169095,30206,ALY
13,,SING,CD,HD3,no,N,13,,169095,30206,ALY
14,,SING,CD,HD2,no,N,14,,169095,30206,ALY
15,,SING,CG,CB,no,N,15,,169095,30206,ALY
16,,SING,CG,HG3,no,N,16,,169095,30206,ALY
17,,SING,CG,HG2,no,N,17,,169095,30206,ALY
18,,SING,CB,CA,no,N,18,,169095,30206,ALY
19,,SING,CB,HB3,no,N,19,,169095,30206,ALY
20,,SING,CB,HB2,no,N,20,,169095,30206,ALY
21,,SING,CA,N,no,N,21,,169095,30206,ALY
22,,SING,CA,C,no,N,22,,169095,30206,ALY
23,,SING,CA,HCA,no,N,23,,169095,30206,ALY
24,,SING,N,H,no,N,24,,169095,30206,ALY
25,,SING,N,H2,no,N,25,,169095,30206,ALY
26,,DOUB,C,O,no,N,26,,169095,30206,ALY
27,,SING,C,OXT,no,N,27,,169095,30206,ALY
28,,SING,OXT,HXT,no,N,28,,169095,30206,ALY
1,,SING,N,HN1,no,N,1,,169207,30211,NH2
2,,SING,N,HN2,no,N,2,,169207,30211,NH2
1,,SING,N,HN1,no,N,1,,169227,30212,NH2
2,,SING,N,HN2,no,N,2,,169227,30212,NH2
1,,SING,N,HN1,no,N,1,,169247,30213,NH2
2,,SING,N,HN2,no,N,2,,169247,30213,NH2
1,,SING,N,HN1,no,N,1,,169267,30214,NH2
2,,SING,N,HN2,no,N,2,,169267,30214,NH2
1,,SING,N,HN1,no,N,1,,169287,30215,NH2
2,,SING,N,HN2,no,N,2,,169287,30215,NH2
1,,SING,N,HN1,no,N,1,,169307,30216,NH2
2,,SING,N,HN2,no,N,2,,169307,30216,NH2
1,,SING,N,HN1,no,N,1,,169327,30217,NH2
2,,SING,N,HN2,no,N,2,,169327,30217,NH2
1,,SING,N,HN1,no,N,1,,169347,30218,NH2
2,,SING,N,HN2,no,N,2,,169347,30218,NH2
1,,SING,N,HN1,no,N,1,,169368,30219,NH2
2,,SING,N,HN2,no,N,2,,169368,30219,NH2
1,,SING,N,CA,no,N,1,,169500,30225,HYP
2,,SING,N,CD,no,N,2,,169500,30225,HYP
3,,SING,N,H,no,N,3,,169500,30225,HYP
4,,SING,CA,C,no,N,4,,169500,30225,HYP
5,,SING,CA,CB,no,N,5,,169500,30225,HYP
6,,SING,CA,HA,no,N,6,,169500,30225,HYP
7,,DOUB,C,O,no,N,7,,169500,30225,HYP
8,,SING,C,OXT,no,N,8,,169500,30225,HYP
9,,SING,CB,CG,no,N,9,,169500,30225,HYP
10,,SING,CB,HB2,no,N,10,,169500,30225,HYP
11,,SING,CB,HB3,no,N,11,,169500,30225,HYP
12,,SING,CG,CD,no,N,12,,169500,30225,HYP
13,,SING,CG,OD1,no,N,13,,169500,30225,HYP
14,,SING,CG,HG,no,N,14,,169500,30225,HYP
15,,SING,CD,HD22,no,N,15,,169500,30225,HYP
16,,SING,CD,HD23,no,N,16,,169500,30225,HYP
17,,SING,OD1,HD1,no,N,17,,169500,30225,HYP
18,,SING,OXT,HXT,no,N,18,,169500,30225,HYP
1,,SING,N,CA,no,N,1,,169525,30226,HYP
2,,SING,N,CD,no,N,2,,169525,30226,HYP
3,,SING,N,H,no,N,3,,169525,30226,HYP
4,,SING,CA,C,no,N,4,,169525,30226,HYP
5,,SING,CA,CB,no,N,5,,169525,30226,HYP
6,,SING,CA,HA,no,N,6,,169525,30226,HYP
7,,DOUB,C,O,no,N,7,,169525,30226,HYP
8,,SING,C,OXT,no,N,8,,169525,30226,HYP
9,,SING,CB,CG,no,N,9,,169525,30226,HYP
10,,SING,CB,HB2,no,N,10,,169525,30226,HYP
11,,SING,CB,HB3,no,N,11,,169525,30226,HYP
12,,SING,CG,CD,no,N,12,,169525,30226,HYP
13,,SING,CG,OD1,no,N,13,,169525,30226,HYP
14,,SING,CG,HG,no,N,14,,169525,30226,HYP
15,,SING,CD,HD22,no,N,15,,169525,30226,HYP
16,,SING,CD,HD23,no,N,16,,169525,30226,HYP
17,,SING,OD1,HD1,no,N,17,,169525,30226,HYP
18,,SING,OXT,HXT,no,N,18,,169525,30226,HYP
1,,SING,FE1,S1,no,N,1,,169602,30231,FES
2,,SING,FE1,S2,no,N,2,,169602,30231,FES
3,,SING,FE2,S1,no,N,3,,169602,30231,FES
4,,SING,FE2,S2,no,N,4,,169602,30231,FES
1,,SING,N,CB,no,N,1,,169837,30244,B3K
2,,SING,N,H,no,N,2,,169837,30244,B3K
3,,SING,N,H2,no,N,3,,169837,30244,B3K
4,,SING,CB,CG,no,N,4,,169837,30244,B3K
5,,SING,CB,CA,no,N,5,,169837,30244,B3K
6,,SING,CB,HB,no,N,6,,169837,30244,B3K
7,,SING,CG,CD,no,N,7,,169837,30244,B3K
8,,SING,CG,HG2,no,N,8,,169837,30244,B3K
9,,SING,CG,HG3,no,N,9,,169837,30244,B3K
10,,SING,CD,CE,no,N,10,,169837,30244,B3K
11,,SING,CD,HD2,no,N,11,,169837,30244,B3K
12,,SING,CD,HD3,no,N,12,,169837,30244,B3K
13,,SING,CE,CF,no,N,13,,169837,30244,B3K
14,,SING,CE,HE2,no,N,14,,169837,30244,B3K
15,,SING,CE,HE3,no,N,15,,169837,30244,B3K
16,,SING,CF,NZ,no,N,16,,169837,30244,B3K
17,,SING,CF,HF1,no,N,17,,169837,30244,B3K
18,,SING,CF,HF2,no,N,18,,169837,30244,B3K
19,,SING,NZ,HNZ1,no,N,19,,169837,30244,B3K
20,,SING,NZ,HNZ2,no,N,20,,169837,30244,B3K
21,,SING,CA,C,no,N,21,,169837,30244,B3K
22,,SING,CA,HA1,no,N,22,,169837,30244,B3K
23,,SING,CA,HA2,no,N,23,,169837,30244,B3K
24,,SING,C,OXT,no,N,24,,169837,30244,B3K
25,,DOUB,C,O,no,N,25,,169837,30244,B3K
26,,SING,OXT,HXT,no,N,26,,169837,30244,B3K
1,,SING,N,HN,no,N,1,,169838,30244,B3Q
2,,SING,N,HNA,no,N,2,,169838,30244,B3Q
3,,SING,CB,N,no,N,3,,169838,30244,B3Q
4,,SING,CB,CG,no,N,4,,169838,30244,B3Q
5,,SING,CG,HG,no,N,5,,169838,30244,B3Q
6,,SING,CG,HGA,no,N,6,,169838,30244,B3Q
7,,SING,CG,CD,no,N,7,,169838,30244,B3Q
8,,SING,CA,CB,no,N,8,,169838,30244,B3Q
9,,SING,CA,HA,no,N,9,,169838,30244,B3Q
10,,SING,C,CA,no,N,10,,169838,30244,B3Q
11,,SING,C,OXT,no,N,11,,169838,30244,B3Q
12,,DOUB,O,C,no,N,12,,169838,30244,B3Q
13,,SING,HB,CB,no,N,13,,169838,30244,B3Q
14,,SING,HAA,CA,no,N,14,,169838,30244,B3Q
15,,SING,CD,CE,no,N,15,,169838,30244,B3Q
16,,SING,CD,H8,no,N,16,,169838,30244,B3Q
17,,SING,CD,H9,no,N,17,,169838,30244,B3Q
18,,SING,OXT,HXT,no,N,18,,169838,30244,B3Q
19,,SING,CE,NF2,no,N,19,,169838,30244,B3Q
20,,DOUB,CE,OF1,no,N,20,,169838,30244,B3Q
21,,SING,NF2,H11,no,N,21,,169838,30244,B3Q
22,,SING,NF2,H12,no,N,22,,169838,30244,B3Q
1,,SING,N,CM,no,N,1,,169839,30244,MAA
2,,SING,N,CA,no,N,2,,169839,30244,MAA
3,,SING,N,H,no,N,3,,169839,30244,MAA
4,,SING,CM,HM1,no,N,4,,169839,30244,MAA
5,,SING,CM,HM2,no,N,5,,169839,30244,MAA
6,,SING,CM,HM3,no,N,6,,169839,30244,MAA
7,,SING,CA,CB,no,N,7,,169839,30244,MAA
8,,SING,CA,C,no,N,8,,169839,30244,MAA
9,,SING,CA,HA,no,N,9,,169839,30244,MAA
10,,SING,CB,HB1,no,N,10,,169839,30244,MAA
11,,SING,CB,HB2,no,N,11,,169839,30244,MAA
12,,SING,CB,HB3,no,N,12,,169839,30244,MAA
13,,DOUB,C,O,no,N,13,,169839,30244,MAA
14,,SING,C,OXT,no,N,14,,169839,30244,MAA
15,,SING,OXT,HXT,no,N,15,,169839,30244,MAA
1,,SING,N,CA,no,N,1,,169840,30244,MMO
2,,SING,N,CN,no,N,2,,169840,30244,MMO
3,,SING,N,H2,no,N,3,,169840,30244,MMO
4,,SING,CA,C,no,N,4,,169840,30244,MMO
5,,SING,CA,CB,no,N,5,,169840,30244,MMO
6,,SING,CA,HA,no,N,6,,169840,30244,MMO
7,,DOUB,C,O,no,N,7,,169840,30244,MMO
8,,SING,CB,CG,no,N,8,,169840,30244,MMO
9,,SING,CB,HCB1,no,N,9,,169840,30244,MMO
10,,SING,CB,HCB2,no,N,10,,169840,30244,MMO
11,,SING,CG,CD,no,N,11,,169840,30244,MMO
12,,SING,CG,HCG1,no,N,12,,169840,30244,MMO
13,,SING,CG,HCG2,no,N,13,,169840,30244,MMO
14,,SING,CD,NE,no,N,14,,169840,30244,MMO
15,,SING,CD,HCD1,no,N,15,,169840,30244,MMO
16,,SING,CD,HCD2,no,N,16,,169840,30244,MMO
17,,SING,NE,CZ,no,N,17,,169840,30244,MMO
18,,SING,CZ,NH2,no,N,18,,169840,30244,MMO
19,,DOUB,CZ,NH1,no,N,19,,169840,30244,MMO
20,,SING,NH2,HH21,no,N,20,,169840,30244,MMO
21,,SING,NH2,HH22,no,N,21,,169840,30244,MMO
22,,SING,NH1,HH11,no,N,22,,169840,30244,MMO
23,,SING,CN,HC1,no,N,23,,169840,30244,MMO
24,,SING,CN,HC2,no,N,24,,169840,30244,MMO
25,,SING,CN,HC3,no,N,25,,169840,30244,MMO
26,,SING,C,OXT,no,N,26,,169840,30244,MMO
27,,SING,OXT,HXT,no,N,27,,169840,30244,MMO
28,,SING,NE,HE,no,N,28,,169840,30244,MMO
1,,SING,N,HN1,no,N,1,,169841,30244,NH2
2,,SING,N,HN2,no,N,2,,169841,30244,NH2
1,,SING,N,CA,no,N,1,,169842,30244,NLE
2,,SING,N,H,no,N,2,,169842,30244,NLE
3,,SING,N,HN2,no,N,3,,169842,30244,NLE
4,,SING,CA,C,no,N,4,,169842,30244,NLE
5,,SING,CA,CB,no,N,5,,169842,30244,NLE
6,,SING,CA,HA,no,N,6,,169842,30244,NLE
7,,DOUB,C,O,no,N,7,,169842,30244,NLE
8,,SING,C,OXT,no,N,8,,169842,30244,NLE
9,,SING,OXT,HXT,no,N,9,,169842,30244,NLE
10,,SING,CB,CG,no,N,10,,169842,30244,NLE
11,,SING,CB,HB2,no,N,11,,169842,30244,NLE
12,,SING,CB,HB3,no,N,12,,169842,30244,NLE
13,,SING,CG,CD,no,N,13,,169842,30244,NLE
14,,SING,CG,HG2,no,N,14,,169842,30244,NLE
15,,SING,CG,HG3,no,N,15,,169842,30244,NLE
16,,SING,CD,CE,no,N,16,,169842,30244,NLE
17,,SING,CD,HD2,no,N,17,,169842,30244,NLE
18,,SING,CD,HD3,no,N,18,,169842,30244,NLE
19,,SING,CE,HE1,no,N,19,,169842,30244,NLE
20,,SING,CE,HE2,no,N,20,,169842,30244,NLE
21,,SING,CE,HE3,no,N,21,,169842,30244,NLE
1,,SING,OE1,CD,no,N,1,,169844,30244,B3D
2,,SING,OE1,HE1,no,N,2,,169844,30244,B3D
3,,DOUB,CD,OE2,no,N,3,,169844,30244,B3D
4,,SING,CD,CG,no,N,4,,169844,30244,B3D
5,,SING,CG,CB,no,N,5,,169844,30244,B3D
6,,SING,CG,HG3,no,N,6,,169844,30244,B3D
7,,SING,CG,HG2,no,N,7,,169844,30244,B3D
8,,SING,CB,N,no,N,8,,169844,30244,B3D
9,,SING,CB,CA,no,N,9,,169844,30244,B3D
10,,SING,CB,HB,no,N,10,,169844,30244,B3D
11,,SING,N,H,no,N,11,,169844,30244,B3D
12,,SING,N,H2,no,N,12,,169844,30244,B3D
13,,SING,CA,C,no,N,13,,169844,30244,B3D
14,,SING,CA,HA1,no,N,14,,169844,30244,B3D
15,,SING,CA,HA2,no,N,15,,169844,30244,B3D
16,,SING,C,OXT,no,N,16,,169844,30244,B3D
17,,DOUB,C,O,no,N,17,,169844,30244,B3D
18,,SING,OXT,HXT,no,N,18,,169844,30244,B3D
1,,SING,N1,C2,no,N,1,,169967,30250,5CM
2,,SING,N1,C6,no,N,2,,169967,30250,5CM
3,,SING,N1,C1',no,N,3,,169967,30250,5CM
4,,SING,C2,N3,no,N,4,,169967,30250,5CM
5,,DOUB,C2,O2,no,N,5,,169967,30250,5CM
6,,DOUB,N3,C4,no,N,6,,169967,30250,5CM
7,,SING,C4,C5,no,N,7,,169967,30250,5CM
8,,SING,C4,N4,no,N,8,,169967,30250,5CM
9,,SING,C5,C5A,no,N,9,,169967,30250,5CM
10,,DOUB,C5,C6,no,N,10,,169967,30250,5CM
11,,SING,C5A,H5A1,no,N,11,,169967,30250,5CM
12,,SING,C5A,H5A2,no,N,12,,169967,30250,5CM
13,,SING,C5A,H5A3,no,N,13,,169967,30250,5CM
14,,SING,C6,H6,no,N,14,,169967,30250,5CM
15,,SING,N4,HN41,no,N,15,,169967,30250,5CM
16,,SING,N4,HN42,no,N,16,,169967,30250,5CM
17,,SING,C1',C2',no,N,17,,169967,30250,5CM
18,,SING,C1',O4',no,N,18,,169967,30250,5CM
19,,SING,C1',H1',no,N,19,,169967,30250,5CM
20,,SING,C2',C3',no,N,20,,169967,30250,5CM
21,,SING,C2',H2',no,N,21,,169967,30250,5CM
22,,SING,C2',H2'',no,N,22,,169967,30250,5CM
23,,SING,C3',C4',no,N,23,,169967,30250,5CM
24,,SING,C3',O3',no,N,24,,169967,30250,5CM
25,,SING,C3',H3',no,N,25,,169967,30250,5CM
26,,SING,C4',O4',no,N,26,,169967,30250,5CM
27,,SING,C4',C5',no,N,27,,169967,30250,5CM
28,,SING,C4',H4',no,N,28,,169967,30250,5CM
29,,SING,O3',HO3',no,N,29,,169967,30250,5CM
30,,SING,C5',O5',no,N,30,,169967,30250,5CM
31,,SING,C5',H5',no,N,31,,169967,30250,5CM
32,,SING,C5',H5'',no,N,32,,169967,30250,5CM
33,,SING,O5',P,no,N,33,,169967,30250,5CM
34,,DOUB,P,OP1,no,N,34,,169967,30250,5CM
35,,SING,P,OP2,no,N,35,,169967,30250,5CM
36,,SING,P,OP3,no,N,36,,169967,30250,5CM
37,,SING,OP2,HOP2,no,N,37,,169967,30250,5CM
38,,SING,OP3,HOP3,no,N,38,,169967,30250,5CM
1,,SING,OP3,P,no,N,1,,169968,30250,8OG
2,,SING,OP3,HOP3,no,N,2,,169968,30250,8OG
3,,DOUB,P,OP1,no,N,3,,169968,30250,8OG
4,,SING,P,OP2,no,N,4,,169968,30250,8OG
5,,SING,P,O5',no,N,5,,169968,30250,8OG
6,,SING,OP2,HOP2,no,N,6,,169968,30250,8OG
7,,SING,O5',C5',no,N,7,,169968,30250,8OG
8,,SING,C5',C4',no,N,8,,169968,30250,8OG
9,,SING,C5',H5',no,N,9,,169968,30250,8OG
10,,SING,C5',H5'',no,N,10,,169968,30250,8OG
11,,SING,C4',O4',no,N,11,,169968,30250,8OG
12,,SING,C4',C3',no,N,12,,169968,30250,8OG
13,,SING,C4',H4',no,N,13,,169968,30250,8OG
14,,SING,O4',C1',no,N,14,,169968,30250,8OG
15,,SING,C3',O3',no,N,15,,169968,30250,8OG
16,,SING,C3',C2',no,N,16,,169968,30250,8OG
17,,SING,C3',H3',no,N,17,,169968,30250,8OG
18,,SING,O3',HO3',no,N,18,,169968,30250,8OG
19,,SING,C2',C1',no,N,19,,169968,30250,8OG
20,,SING,C2',H2',no,N,20,,169968,30250,8OG
21,,SING,C2',H2'',no,N,21,,169968,30250,8OG
22,,SING,C1',N9,no,N,22,,169968,30250,8OG
23,,SING,C1',H1',no,N,23,,169968,30250,8OG
24,,SING,N9,C8,no,N,24,,169968,30250,8OG
25,,SING,N9,C4,no,N,25,,169968,30250,8OG
26,,SING,C8,N7,no,N,26,,169968,30250,8OG
27,,DOUB,C8,O8,no,N,27,,169968,30250,8OG
28,,SING,N7,C5,no,N,28,,169968,30250,8OG
29,,SING,N7,H7,no,N,29,,169968,30250,8OG
30,,SING,C5,C6,no,N,30,,169968,30250,8OG
31,,DOUB,C5,C4,no,N,31,,169968,30250,8OG
32,,DOUB,C6,O6,no,N,32,,169968,30250,8OG
33,,SING,C6,N1,no,N,33,,169968,30250,8OG
34,,SING,N1,C2,no,N,34,,169968,30250,8OG
35,,SING,N1,H1,no,N,35,,169968,30250,8OG
36,,SING,C2,N2,no,N,36,,169968,30250,8OG
37,,DOUB,C2,N3,no,N,37,,169968,30250,8OG
38,,SING,N2,H21,no,N,38,,169968,30250,8OG
39,,SING,N2,H22,no,N,39,,169968,30250,8OG
40,,SING,N3,C4,no,N,40,,169968,30250,8OG
1,,SING,N1,C2,no,N,1,,169989,30251,5CM
2,,SING,N1,C6,no,N,2,,169989,30251,5CM
3,,SING,N1,C1',no,N,3,,169989,30251,5CM
4,,SING,C2,N3,no,N,4,,169989,30251,5CM
5,,DOUB,C2,O2,no,N,5,,169989,30251,5CM
6,,DOUB,N3,C4,no,N,6,,169989,30251,5CM
7,,SING,C4,C5,no,N,7,,169989,30251,5CM
8,,SING,C4,N4,no,N,8,,169989,30251,5CM
9,,SING,C5,C5A,no,N,9,,169989,30251,5CM
10,,DOUB,C5,C6,no,N,10,,169989,30251,5CM
11,,SING,C5A,H5A1,no,N,11,,169989,30251,5CM
12,,SING,C5A,H5A2,no,N,12,,169989,30251,5CM
13,,SING,C5A,H5A3,no,N,13,,169989,30251,5CM
14,,SING,C6,H6,no,N,14,,169989,30251,5CM
15,,SING,N4,HN41,no,N,15,,169989,30251,5CM
16,,SING,N4,HN42,no,N,16,,169989,30251,5CM
17,,SING,C1',C2',no,N,17,,169989,30251,5CM
18,,SING,C1',O4',no,N,18,,169989,30251,5CM
19,,SING,C1',H1',no,N,19,,169989,30251,5CM
20,,SING,C2',C3',no,N,20,,169989,30251,5CM
21,,SING,C2',H2',no,N,21,,169989,30251,5CM
22,,SING,C2',H2'',no,N,22,,169989,30251,5CM
23,,SING,C3',C4',no,N,23,,169989,30251,5CM
24,,SING,C3',O3',no,N,24,,169989,30251,5CM
25,,SING,C3',H3',no,N,25,,169989,30251,5CM
26,,SING,C4',O4',no,N,26,,169989,30251,5CM
27,,SING,C4',C5',no,N,27,,169989,30251,5CM
28,,SING,C4',H4',no,N,28,,169989,30251,5CM
29,,SING,O3',HO3',no,N,29,,169989,30251,5CM
30,,SING,C5',O5',no,N,30,,169989,30251,5CM
31,,SING,C5',H5',no,N,31,,169989,30251,5CM
32,,SING,C5',H5'',no,N,32,,169989,30251,5CM
33,,SING,O5',P,no,N,33,,169989,30251,5CM
34,,DOUB,P,OP1,no,N,34,,169989,30251,5CM
35,,SING,P,OP2,no,N,35,,169989,30251,5CM
36,,SING,P,OP3,no,N,36,,169989,30251,5CM
37,,SING,OP2,HOP2,no,N,37,,169989,30251,5CM
38,,SING,OP3,HOP3,no,N,38,,169989,30251,5CM
1,,SING,OP3,P,no,N,1,,169990,30251,8OG
2,,SING,OP3,HOP3,no,N,2,,169990,30251,8OG
3,,DOUB,P,OP1,no,N,3,,169990,30251,8OG
4,,SING,P,OP2,no,N,4,,169990,30251,8OG
5,,SING,P,O5',no,N,5,,169990,30251,8OG
6,,SING,OP2,HOP2,no,N,6,,169990,30251,8OG
7,,SING,O5',C5',no,N,7,,169990,30251,8OG
8,,SING,C5',C4',no,N,8,,169990,30251,8OG
9,,SING,C5',H5',no,N,9,,169990,30251,8OG
10,,SING,C5',H5'',no,N,10,,169990,30251,8OG
11,,SING,C4',O4',no,N,11,,169990,30251,8OG
12,,SING,C4',C3',no,N,12,,169990,30251,8OG
13,,SING,C4',H4',no,N,13,,169990,30251,8OG
14,,SING,O4',C1',no,N,14,,169990,30251,8OG
15,,SING,C3',O3',no,N,15,,169990,30251,8OG
16,,SING,C3',C2',no,N,16,,169990,30251,8OG
17,,SING,C3',H3',no,N,17,,169990,30251,8OG
18,,SING,O3',HO3',no,N,18,,169990,30251,8OG
19,,SING,C2',C1',no,N,19,,169990,30251,8OG
20,,SING,C2',H2',no,N,20,,169990,30251,8OG
21,,SING,C2',H2'',no,N,21,,169990,30251,8OG
22,,SING,C1',N9,no,N,22,,169990,30251,8OG
23,,SING,C1',H1',no,N,23,,169990,30251,8OG
24,,SING,N9,C8,no,N,24,,169990,30251,8OG
25,,SING,N9,C4,no,N,25,,169990,30251,8OG
26,,SING,C8,N7,no,N,26,,169990,30251,8OG
27,,DOUB,C8,O8,no,N,27,,169990,30251,8OG
28,,SING,N7,C5,no,N,28,,169990,30251,8OG
29,,SING,N7,H7,no,N,29,,169990,30251,8OG
30,,SING,C5,C6,no,N,30,,169990,30251,8OG
31,,DOUB,C5,C4,no,N,31,,169990,30251,8OG
32,,DOUB,C6,O6,no,N,32,,169990,30251,8OG
33,,SING,C6,N1,no,N,33,,169990,30251,8OG
34,,SING,N1,C2,no,N,34,,169990,30251,8OG
35,,SING,N1,H1,no,N,35,,169990,30251,8OG
36,,SING,C2,N2,no,N,36,,169990,30251,8OG
37,,DOUB,C2,N3,no,N,37,,169990,30251,8OG
38,,SING,N2,H21,no,N,38,,169990,30251,8OG
39,,SING,N2,H22,no,N,39,,169990,30251,8OG
40,,SING,N3,C4,no,N,40,,169990,30251,8OG
1,,SING,N1,C2,no,N,1,,170011,30252,5CM
2,,SING,N1,C6,no,N,2,,170011,30252,5CM
3,,SING,N1,C1',no,N,3,,170011,30252,5CM
4,,SING,C2,N3,no,N,4,,170011,30252,5CM
5,,DOUB,C2,O2,no,N,5,,170011,30252,5CM
6,,DOUB,N3,C4,no,N,6,,170011,30252,5CM
7,,SING,C4,C5,no,N,7,,170011,30252,5CM
8,,SING,C4,N4,no,N,8,,170011,30252,5CM
9,,SING,C5,C5A,no,N,9,,170011,30252,5CM
10,,DOUB,C5,C6,no,N,10,,170011,30252,5CM
11,,SING,C5A,H5A1,no,N,11,,170011,30252,5CM
12,,SING,C5A,H5A2,no,N,12,,170011,30252,5CM
13,,SING,C5A,H5A3,no,N,13,,170011,30252,5CM
14,,SING,C6,H6,no,N,14,,170011,30252,5CM
15,,SING,N4,HN41,no,N,15,,170011,30252,5CM
16,,SING,N4,HN42,no,N,16,,170011,30252,5CM
17,,SING,C1',C2',no,N,17,,170011,30252,5CM
18,,SING,C1',O4',no,N,18,,170011,30252,5CM
19,,SING,C1',H1',no,N,19,,170011,30252,5CM
20,,SING,C2',C3',no,N,20,,170011,30252,5CM
21,,SING,C2',H2',no,N,21,,170011,30252,5CM
22,,SING,C2',H2'',no,N,22,,170011,30252,5CM
23,,SING,C3',C4',no,N,23,,170011,30252,5CM
24,,SING,C3',O3',no,N,24,,170011,30252,5CM
25,,SING,C3',H3',no,N,25,,170011,30252,5CM
26,,SING,C4',O4',no,N,26,,170011,30252,5CM
27,,SING,C4',C5',no,N,27,,170011,30252,5CM
28,,SING,C4',H4',no,N,28,,170011,30252,5CM
29,,SING,O3',HO3',no,N,29,,170011,30252,5CM
30,,SING,C5',O5',no,N,30,,170011,30252,5CM
31,,SING,C5',H5',no,N,31,,170011,30252,5CM
32,,SING,C5',H5'',no,N,32,,170011,30252,5CM
33,,SING,O5',P,no,N,33,,170011,30252,5CM
34,,DOUB,P,OP1,no,N,34,,170011,30252,5CM
35,,SING,P,OP2,no,N,35,,170011,30252,5CM
36,,SING,P,OP3,no,N,36,,170011,30252,5CM
37,,SING,OP2,HOP2,no,N,37,,170011,30252,5CM
38,,SING,OP3,HOP3,no,N,38,,170011,30252,5CM
1,,SING,OP3,P,no,N,1,,170012,30252,8OG
2,,SING,OP3,HOP3,no,N,2,,170012,30252,8OG
3,,DOUB,P,OP1,no,N,3,,170012,30252,8OG
4,,SING,P,OP2,no,N,4,,170012,30252,8OG
5,,SING,P,O5',no,N,5,,170012,30252,8OG
6,,SING,OP2,HOP2,no,N,6,,170012,30252,8OG
7,,SING,O5',C5',no,N,7,,170012,30252,8OG
8,,SING,C5',C4',no,N,8,,170012,30252,8OG
9,,SING,C5',H5',no,N,9,,170012,30252,8OG
10,,SING,C5',H5'',no,N,10,,170012,30252,8OG
11,,SING,C4',O4',no,N,11,,170012,30252,8OG
12,,SING,C4',C3',no,N,12,,170012,30252,8OG
13,,SING,C4',H4',no,N,13,,170012,30252,8OG
14,,SING,O4',C1',no,N,14,,170012,30252,8OG
15,,SING,C3',O3',no,N,15,,170012,30252,8OG
16,,SING,C3',C2',no,N,16,,170012,30252,8OG
17,,SING,C3',H3',no,N,17,,170012,30252,8OG
18,,SING,O3',HO3',no,N,18,,170012,30252,8OG
19,,SING,C2',C1',no,N,19,,170012,30252,8OG
20,,SING,C2',H2',no,N,20,,170012,30252,8OG
21,,SING,C2',H2'',no,N,21,,170012,30252,8OG
22,,SING,C1',N9,no,N,22,,170012,30252,8OG
23,,SING,C1',H1',no,N,23,,170012,30252,8OG
24,,SING,N9,C8,no,N,24,,170012,30252,8OG
25,,SING,N9,C4,no,N,25,,170012,30252,8OG
26,,SING,C8,N7,no,N,26,,170012,30252,8OG
27,,DOUB,C8,O8,no,N,27,,170012,30252,8OG
28,,SING,N7,C5,no,N,28,,170012,30252,8OG
29,,SING,N7,H7,no,N,29,,170012,30252,8OG
30,,SING,C5,C6,no,N,30,,170012,30252,8OG
31,,DOUB,C5,C4,no,N,31,,170012,30252,8OG
32,,DOUB,C6,O6,no,N,32,,170012,30252,8OG
33,,SING,C6,N1,no,N,33,,170012,30252,8OG
34,,SING,N1,C2,no,N,34,,170012,30252,8OG
35,,SING,N1,H1,no,N,35,,170012,30252,8OG
36,,SING,C2,N2,no,N,36,,170012,30252,8OG
37,,DOUB,C2,N3,no,N,37,,170012,30252,8OG
38,,SING,N2,H21,no,N,38,,170012,30252,8OG
39,,SING,N2,H22,no,N,39,,170012,30252,8OG
40,,SING,N3,C4,no,N,40,,170012,30252,8OG
1,,DOUB,C2,N3,yes,N,1,,170080,30255,MA7
2,,SING,C2,N1,yes,N,2,,170080,30255,MA7
3,,SING,C2,H2,no,N,3,,170080,30255,MA7
4,,DOUB,C4,C5,yes,N,4,,170080,30255,MA7
5,,SING,C4,N9,yes,N,5,,170080,30255,MA7
6,,SING,C4,N3,yes,N,6,,170080,30255,MA7
7,,SING,C5,C6,yes,N,7,,170080,30255,MA7
8,,SING,C5,N7,yes,N,8,,170080,30255,MA7
9,,DOUB,C6,N1,yes,N,9,,170080,30255,MA7
10,,SING,C6,N6,no,N,10,,170080,30255,MA7
11,,SING,C8,N9,yes,N,11,,170080,30255,MA7
12,,DOUB,C8,N7,yes,N,12,,170080,30255,MA7
13,,SING,C8,H8,no,N,13,,170080,30255,MA7
14,,DOUB,P,OP1,no,N,14,,170080,30255,MA7
15,,SING,P,OP2,no,N,15,,170080,30255,MA7
16,,SING,P,O5',no,N,16,,170080,30255,MA7
17,,SING,P,OP3,no,N,17,,170080,30255,MA7
18,,SING,OP2,HOP2,no,N,18,,170080,30255,MA7
19,,SING,O5',C5',no,N,19,,170080,30255,MA7
20,,SING,N9,C1',no,N,20,,170080,30255,MA7
21,,SING,N1,CN,no,N,21,,170080,30255,MA7
22,,SING,N6,H61,no,N,22,,170080,30255,MA7
23,,SING,N6,H62,no,N,23,,170080,30255,MA7
24,,SING,CN,HN1,no,N,24,,170080,30255,MA7
25,,SING,CN,HN2,no,N,25,,170080,30255,MA7
26,,SING,CN,HN3,no,N,26,,170080,30255,MA7
27,,SING,C2',C1',no,N,27,,170080,30255,MA7
28,,SING,C2',C3',no,N,28,,170080,30255,MA7
29,,SING,C2',H2',no,N,29,,170080,30255,MA7
30,,SING,C2',H2'',no,N,30,,170080,30255,MA7
31,,SING,C5',C4',no,N,31,,170080,30255,MA7
32,,SING,C5',H5',no,N,32,,170080,30255,MA7
33,,SING,C5',H5'',no,N,33,,170080,30255,MA7
34,,SING,C4',O4',no,N,34,,170080,30255,MA7
35,,SING,C4',C3',no,N,35,,170080,30255,MA7
36,,SING,C4',H4',no,N,36,,170080,30255,MA7
37,,SING,O4',C1',no,N,37,,170080,30255,MA7
38,,SING,C1',H1',no,N,38,,170080,30255,MA7
39,,SING,C3',O3',no,N,39,,170080,30255,MA7
40,,SING,C3',H3',no,N,40,,170080,30255,MA7
41,,SING,O3',HO3',no,N,41,,170080,30255,MA7
42,,SING,OP3,HOP3,no,N,42,,170080,30255,MA7
1,,SING,N,CA,no,N,1,,170142,30258,DPR
2,,SING,N,CD,no,N,2,,170142,30258,DPR
3,,SING,N,H,no,N,3,,170142,30258,DPR
4,,SING,CA,CB,no,N,4,,170142,30258,DPR
5,,SING,CA,C,no,N,5,,170142,30258,DPR
6,,SING,CA,HA,no,N,6,,170142,30258,DPR
7,,SING,CB,CG,no,N,7,,170142,30258,DPR
8,,SING,CB,HB2,no,N,8,,170142,30258,DPR
9,,SING,CB,HB3,no,N,9,,170142,30258,DPR
10,,SING,CG,CD,no,N,10,,170142,30258,DPR
11,,SING,CG,HG2,no,N,11,,170142,30258,DPR
12,,SING,CG,HG3,no,N,12,,170142,30258,DPR
13,,SING,CD,HD2,no,N,13,,170142,30258,DPR
14,,SING,CD,HD3,no,N,14,,170142,30258,DPR
15,,DOUB,C,O,no,N,15,,170142,30258,DPR
16,,SING,C,OXT,no,N,16,,170142,30258,DPR
17,,SING,OXT,HXT,no,N,17,,170142,30258,DPR
1,,SING,N,HN1,no,N,1,,170238,30263,NH2
2,,SING,N,HN2,no,N,2,,170238,30263,NH2
1,,DOUB,C1,C2,yes,N,1,,170278,30267,ZBR
2,,SING,C1,C6,yes,N,2,,170278,30267,ZBR
3,,SING,C1,C7,no,N,3,,170278,30267,ZBR
4,,SING,C2,C3,yes,N,4,,170278,30267,ZBR
5,,DOUB,C3,C4,yes,N,5,,170278,30267,ZBR
6,,SING,C3,C8,no,N,6,,170278,30267,ZBR
7,,SING,C4,C5,yes,N,7,,170278,30267,ZBR
8,,DOUB,C5,C6,yes,N,8,,170278,30267,ZBR
9,,SING,C5,C9,no,N,9,,170278,30267,ZBR
10,,SING,C7,BR2,no,N,10,,170278,30267,ZBR
11,,SING,C8,BR1,no,N,11,,170278,30267,ZBR
12,,SING,C9,BR3,no,N,12,,170278,30267,ZBR
13,,SING,C2,H2,no,N,13,,170278,30267,ZBR
14,,SING,C4,H4,no,N,14,,170278,30267,ZBR
15,,SING,C6,H6,no,N,15,,170278,30267,ZBR
16,,SING,C7,H7,no,N,16,,170278,30267,ZBR
17,,SING,C7,H7A,no,N,17,,170278,30267,ZBR
18,,SING,C8,H8,no,N,18,,170278,30267,ZBR
19,,SING,C8,H8A,no,N,19,,170278,30267,ZBR
20,,SING,C9,H9,no,N,20,,170278,30267,ZBR
21,,SING,C9,H9A,no,N,21,,170278,30267,ZBR
1,,SING,C1,O1,no,N,1,,170523,30285,4N1
2,,DOUB,C1,N2,yes,N,2,,170523,30285,4N1
3,,SING,C1,C6,yes,N,3,,170523,30285,4N1
4,,SING,O1,C10,no,N,4,,170523,30285,4N1
5,,SING,N2,C3,yes,N,5,,170523,30285,4N1
6,,DOUB,C3,C4,yes,N,6,,170523,30285,4N1
7,,SING,C3,N7,yes,N,7,,170523,30285,4N1
8,,SING,C4,C5,yes,N,8,,170523,30285,4N1
9,,SING,C4,N9,yes,N,9,,170523,30285,4N1
10,,DOUB,C5,C6,yes,N,10,,170523,30285,4N1
11,,SING,N7,C8,yes,N,11,,170523,30285,4N1
12,,DOUB,C8,N9,yes,N,12,,170523,30285,4N1
13,,SING,C8,N11,no,N,13,,170523,30285,4N1
14,,DOUB,N11,C12,yes,N,14,,170523,30285,4N1
15,,SING,N11,C16,yes,N,15,,170523,30285,4N1
16,,SING,C12,C13,yes,N,16,,170523,30285,4N1
17,,SING,C12,C17,no,N,17,,170523,30285,4N1
18,,DOUB,C13,C14,yes,N,18,,170523,30285,4N1
19,,SING,C13,C18,no,N,19,,170523,30285,4N1
20,,SING,C14,O14,no,N,20,,170523,30285,4N1
21,,SING,C14,C15,yes,N,21,,170523,30285,4N1
22,,SING,O14,C21,no,N,22,,170523,30285,4N1
23,,DOUB,C15,C16,yes,N,23,,170523,30285,4N1
24,,SING,C15,C19,no,N,24,,170523,30285,4N1
25,,SING,C17,S20,no,N,25,,170523,30285,4N1
26,,SING,C5,H5,no,N,26,,170523,30285,4N1
27,,SING,C6,H6,no,N,27,,170523,30285,4N1
28,,SING,N7,H7,no,N,28,,170523,30285,4N1
29,,SING,C10,H101,no,N,29,,170523,30285,4N1
30,,SING,C10,H102,no,N,30,,170523,30285,4N1
31,,SING,C10,H103,no,N,31,,170523,30285,4N1
32,,SING,C16,H16,no,N,32,,170523,30285,4N1
33,,SING,C17,H171,no,N,33,,170523,30285,4N1
34,,SING,C18,H181,no,N,34,,170523,30285,4N1
35,,SING,C18,H182,no,N,35,,170523,30285,4N1
36,,SING,C18,H183,no,N,36,,170523,30285,4N1
37,,SING,C19,H191,no,N,37,,170523,30285,4N1
38,,SING,C19,H192,no,N,38,,170523,30285,4N1
39,,SING,C19,H193,no,N,39,,170523,30285,4N1
40,,SING,C21,H211,no,N,40,,170523,30285,4N1
41,,SING,C21,H212,no,N,41,,170523,30285,4N1
42,,SING,C21,H213,no,N,42,,170523,30285,4N1
43,,SING,C17,H172,no,N,43,,170523,30285,4N1
44,,SING,S20,H1,no,N,44,,170523,30285,4N1
1,,SING,N,CA,no,N,1,,170651,30291,HYP
2,,SING,N,CD,no,N,2,,170651,30291,HYP
3,,SING,N,H,no,N,3,,170651,30291,HYP
4,,SING,CA,C,no,N,4,,170651,30291,HYP
5,,SING,CA,CB,no,N,5,,170651,30291,HYP
6,,SING,CA,HA,no,N,6,,170651,30291,HYP
7,,DOUB,C,O,no,N,7,,170651,30291,HYP
8,,SING,C,OXT,no,N,8,,170651,30291,HYP
9,,SING,CB,CG,no,N,9,,170651,30291,HYP
10,,SING,CB,HB2,no,N,10,,170651,30291,HYP
11,,SING,CB,HB3,no,N,11,,170651,30291,HYP
12,,SING,CG,CD,no,N,12,,170651,30291,HYP
13,,SING,CG,OD1,no,N,13,,170651,30291,HYP
14,,SING,CG,HG,no,N,14,,170651,30291,HYP
15,,SING,CD,HD22,no,N,15,,170651,30291,HYP
16,,SING,CD,HD23,no,N,16,,170651,30291,HYP
17,,SING,OD1,HD1,no,N,17,,170651,30291,HYP
18,,SING,OXT,HXT,no,N,18,,170651,30291,HYP
1,,SING,N,HN1,no,N,1,,170652,30291,NH2
2,,SING,N,HN2,no,N,2,,170652,30291,NH2
1,,DOUB,C,O,no,N,1,,170884,30305,ACE
2,,SING,C,CH3,no,N,2,,170884,30305,ACE
3,,SING,C,H,no,N,3,,170884,30305,ACE
4,,SING,CH3,H1,no,N,4,,170884,30305,ACE
5,,SING,CH3,H2,no,N,5,,170884,30305,ACE
6,,SING,CH3,H3,no,N,6,,170884,30305,ACE
1,,SING,N,HN1,no,N,1,,170886,30305,NH2
2,,SING,N,HN2,no,N,2,,170886,30305,NH2
1,,SING,N,CA,no,N,1,,170887,30305,SEP
2,,SING,N,H,no,N,2,,170887,30305,SEP
3,,SING,N,H2,no,N,3,,170887,30305,SEP
4,,SING,CA,CB,no,N,4,,170887,30305,SEP
5,,SING,CA,C,no,N,5,,170887,30305,SEP
6,,SING,CA,HA,no,N,6,,170887,30305,SEP
7,,SING,CB,OG,no,N,7,,170887,30305,SEP
8,,SING,CB,HB2,no,N,8,,170887,30305,SEP
9,,SING,CB,HB3,no,N,9,,170887,30305,SEP
10,,SING,OG,P,no,N,10,,170887,30305,SEP
11,,DOUB,C,O,no,N,11,,170887,30305,SEP
12,,SING,C,OXT,no,N,12,,170887,30305,SEP
13,,SING,OXT,HXT,no,N,13,,170887,30305,SEP
14,,DOUB,P,O1P,no,N,14,,170887,30305,SEP
15,,SING,P,O2P,no,N,15,,170887,30305,SEP
16,,SING,P,O3P,no,N,16,,170887,30305,SEP
17,,SING,O2P,HOP2,no,N,17,,170887,30305,SEP
18,,SING,O3P,HOP3,no,N,18,,170887,30305,SEP
1,,SING,N,CA,no,N,1,,170929,30307,AZH
2,,SING,CA,CB,no,N,2,,170929,30307,AZH
3,,SING,CA,C,no,N,3,,170929,30307,AZH
4,,SING,CB,CG,no,N,4,,170929,30307,AZH
5,,SING,CG,ND,no,N,5,,170929,30307,AZH
6,,DOUB,ND,NE,no,N,6,,170929,30307,AZH
7,,DOUB,NE,NZ,no,N,7,,170929,30307,AZH
8,,DOUB,C,O,no,N,8,,170929,30307,AZH
9,,SING,C,OX0,no,N,9,,170929,30307,AZH
10,,SING,N,HN1,no,N,10,,170929,30307,AZH
11,,SING,N,HN2,no,N,11,,170929,30307,AZH
12,,SING,CA,HA,no,N,12,,170929,30307,AZH
13,,SING,CB,HB1C,no,N,13,,170929,30307,AZH
14,,SING,CB,HB2C,no,N,14,,170929,30307,AZH
15,,SING,CG,HG1C,no,N,15,,170929,30307,AZH
16,,SING,CG,HG2C,no,N,16,,170929,30307,AZH
17,,SING,NZ,HZ,no,N,17,,170929,30307,AZH
18,,SING,OX0,HX0,no,N,18,,170929,30307,AZH
1,,DOUB,CAB,CAC,yes,N,1,,170950,30308,9XG
2,,SING,CAB,CAD,yes,N,2,,170950,30308,9XG
3,,SING,CAC,CAG,yes,N,3,,170950,30308,9XG
4,,DOUB,CAD,CAH,yes,N,4,,170950,30308,9XG
5,,DOUB,CAG,CAM,yes,N,5,,170950,30308,9XG
6,,SING,CAH,CAM,yes,N,6,,170950,30308,9XG
7,,SING,CAM,NAK,no,N,7,,170950,30308,9XG
8,,SING,NAK,CAN,no,N,8,,170950,30308,9XG
9,,DOUB,CAN,CAJ,yes,N,9,,170950,30308,9XG
10,,SING,CAN,CAI,yes,N,10,,170950,30308,9XG
11,,SING,CAJ,CAL,yes,N,11,,170950,30308,9XG
12,,DOUB,CAI,CAE,yes,N,12,,170950,30308,9XG
13,,SING,CAL,CAA,no,N,13,,170950,30308,9XG
14,,DOUB,CAL,CAF,yes,N,14,,170950,30308,9XG
15,,SING,CAE,CAF,yes,N,15,,170950,30308,9XG
16,,SING,CAA,HAB,no,N,16,,170950,30308,9XG
17,,SING,CAA,HAC,no,N,17,,170950,30308,9XG
18,,SING,CAA,HAA,no,N,18,,170950,30308,9XG
19,,SING,CAB,HAD,no,N,19,,170950,30308,9XG
20,,SING,CAC,HAE,no,N,20,,170950,30308,9XG
21,,SING,CAD,HAF,no,N,21,,170950,30308,9XG
22,,SING,CAE,HAG,no,N,22,,170950,30308,9XG
23,,SING,CAF,HAH,no,N,23,,170950,30308,9XG
24,,SING,CAG,HAI,no,N,24,,170950,30308,9XG
25,,SING,CAH,HAJ,no,N,25,,170950,30308,9XG
26,,SING,CAI,HAK,no,N,26,,170950,30308,9XG
27,,SING,CAJ,HAL,no,N,27,,170950,30308,9XG
28,,SING,NAK,HAM,no,N,28,,170950,30308,9XG
1,,SING,N,HN1,no,N,1,,171155,30318,NH2
2,,SING,N,HN2,no,N,2,,171155,30318,NH2
1,,DOUB,CE2,CZ,yes,N,1,,171174,30319,B74
2,,SING,CE2,CD2,yes,N,2,,171174,30319,B74
3,,SING,CZ,CE1,yes,N,3,,171174,30319,B74
4,,SING,CB2,CD2,no,N,4,,171174,30319,B74
5,,DOUB,CD2,CG,yes,N,5,,171174,30319,B74
6,,DOUB,CE1,CD1,yes,N,6,,171174,30319,B74
7,,SING,CG,CD1,yes,N,7,,171174,30319,B74
8,,SING,CD1,CB1,no,N,8,,171174,30319,B74
9,,SING,CB1,O1,no,N,9,,171174,30319,B74
10,,SING,CB1,HB11,no,N,10,,171174,30319,B74
11,,SING,CB1,HB12,no,N,11,,171174,30319,B74
12,,SING,CG,HG,no,N,12,,171174,30319,B74
13,,SING,CE1,HE1,no,N,13,,171174,30319,B74
14,,SING,CE2,HE2,no,N,14,,171174,30319,B74
15,,SING,CZ,HZ,no,N,15,,171174,30319,B74
16,,SING,CB2,HB21,no,N,16,,171174,30319,B74
17,,SING,CB2,HB22,no,N,17,,171174,30319,B74
18,,SING,CB2,H1,no,N,18,,171174,30319,B74
19,,SING,O1,H2,no,N,19,,171174,30319,B74
1,,SING,N1,C2,no,N,1,,171348,30328,5CM
2,,SING,N1,C6,no,N,2,,171348,30328,5CM
3,,SING,N1,C1',no,N,3,,171348,30328,5CM
4,,SING,C2,N3,no,N,4,,171348,30328,5CM
5,,DOUB,C2,O2,no,N,5,,171348,30328,5CM
6,,DOUB,N3,C4,no,N,6,,171348,30328,5CM
7,,SING,C4,C5,no,N,7,,171348,30328,5CM
8,,SING,C4,N4,no,N,8,,171348,30328,5CM
9,,SING,C5,C5A,no,N,9,,171348,30328,5CM
10,,DOUB,C5,C6,no,N,10,,171348,30328,5CM
11,,SING,C5A,H5A1,no,N,11,,171348,30328,5CM
12,,SING,C5A,H5A2,no,N,12,,171348,30328,5CM
13,,SING,C5A,H5A3,no,N,13,,171348,30328,5CM
14,,SING,C6,H6,no,N,14,,171348,30328,5CM
15,,SING,N4,HN41,no,N,15,,171348,30328,5CM
16,,SING,N4,HN42,no,N,16,,171348,30328,5CM
17,,SING,C1',C2',no,N,17,,171348,30328,5CM
18,,SING,C1',O4',no,N,18,,171348,30328,5CM
19,,SING,C1',H1',no,N,19,,171348,30328,5CM
20,,SING,C2',C3',no,N,20,,171348,30328,5CM
21,,SING,C2',H2',no,N,21,,171348,30328,5CM
22,,SING,C2',H2'',no,N,22,,171348,30328,5CM
23,,SING,C3',C4',no,N,23,,171348,30328,5CM
24,,SING,C3',O3',no,N,24,,171348,30328,5CM
25,,SING,C3',H3',no,N,25,,171348,30328,5CM
26,,SING,C4',O4',no,N,26,,171348,30328,5CM
27,,SING,C4',C5',no,N,27,,171348,30328,5CM
28,,SING,C4',H4',no,N,28,,171348,30328,5CM
29,,SING,O3',HO3',no,N,29,,171348,30328,5CM
30,,SING,C5',O5',no,N,30,,171348,30328,5CM
31,,SING,C5',H5',no,N,31,,171348,30328,5CM
32,,SING,C5',H5'',no,N,32,,171348,30328,5CM
33,,SING,O5',P,no,N,33,,171348,30328,5CM
34,,DOUB,P,OP1,no,N,34,,171348,30328,5CM
35,,SING,P,OP2,no,N,35,,171348,30328,5CM
36,,SING,P,OP3,no,N,36,,171348,30328,5CM
37,,SING,OP2,HOP2,no,N,37,,171348,30328,5CM
38,,SING,OP3,HOP3,no,N,38,,171348,30328,5CM
1,,SING,OP3,P,no,N,1,,171349,30328,8OG
2,,SING,OP3,HOP3,no,N,2,,171349,30328,8OG
3,,DOUB,P,OP1,no,N,3,,171349,30328,8OG
4,,SING,P,OP2,no,N,4,,171349,30328,8OG
5,,SING,P,O5',no,N,5,,171349,30328,8OG
6,,SING,OP2,HOP2,no,N,6,,171349,30328,8OG
7,,SING,O5',C5',no,N,7,,171349,30328,8OG
8,,SING,C5',C4',no,N,8,,171349,30328,8OG
9,,SING,C5',H5',no,N,9,,171349,30328,8OG
10,,SING,C5',H5'',no,N,10,,171349,30328,8OG
11,,SING,C4',O4',no,N,11,,171349,30328,8OG
12,,SING,C4',C3',no,N,12,,171349,30328,8OG
13,,SING,C4',H4',no,N,13,,171349,30328,8OG
14,,SING,O4',C1',no,N,14,,171349,30328,8OG
15,,SING,C3',O3',no,N,15,,171349,30328,8OG
16,,SING,C3',C2',no,N,16,,171349,30328,8OG
17,,SING,C3',H3',no,N,17,,171349,30328,8OG
18,,SING,O3',HO3',no,N,18,,171349,30328,8OG
19,,SING,C2',C1',no,N,19,,171349,30328,8OG
20,,SING,C2',H2',no,N,20,,171349,30328,8OG
21,,SING,C2',H2'',no,N,21,,171349,30328,8OG
22,,SING,C1',N9,no,N,22,,171349,30328,8OG
23,,SING,C1',H1',no,N,23,,171349,30328,8OG
24,,SING,N9,C8,no,N,24,,171349,30328,8OG
25,,SING,N9,C4,no,N,25,,171349,30328,8OG
26,,SING,C8,N7,no,N,26,,171349,30328,8OG
27,,DOUB,C8,O8,no,N,27,,171349,30328,8OG
28,,SING,N7,C5,no,N,28,,171349,30328,8OG
29,,SING,N7,H7,no,N,29,,171349,30328,8OG
30,,SING,C5,C6,no,N,30,,171349,30328,8OG
31,,DOUB,C5,C4,no,N,31,,171349,30328,8OG
32,,DOUB,C6,O6,no,N,32,,171349,30328,8OG
33,,SING,C6,N1,no,N,33,,171349,30328,8OG
34,,SING,N1,C2,no,N,34,,171349,30328,8OG
35,,SING,N1,H1,no,N,35,,171349,30328,8OG
36,,SING,C2,N2,no,N,36,,171349,30328,8OG
37,,DOUB,C2,N3,no,N,37,,171349,30328,8OG
38,,SING,N2,H21,no,N,38,,171349,30328,8OG
39,,SING,N2,H22,no,N,39,,171349,30328,8OG
40,,SING,N3,C4,no,N,40,,171349,30328,8OG
1,,SING,N1,C2,no,N,1,,171350,30328,DCZ
2,,SING,N1,C6,no,N,2,,171350,30328,DCZ
3,,SING,N1,C1',no,N,3,,171350,30328,DCZ
4,,SING,C2,N3,no,N,4,,171350,30328,DCZ
5,,DOUB,C2,O2,no,N,5,,171350,30328,DCZ
6,,DOUB,N3,C4,no,N,6,,171350,30328,DCZ
7,,SING,C4,C5,no,N,7,,171350,30328,DCZ
8,,SING,C4,N4,no,N,8,,171350,30328,DCZ
9,,DOUB,C5,C6,no,N,9,,171350,30328,DCZ
10,,SING,C5,H5,no,N,10,,171350,30328,DCZ
11,,SING,C6,H6,no,N,11,,171350,30328,DCZ
12,,SING,N4,HN41,no,N,12,,171350,30328,DCZ
13,,SING,N4,HN42,no,N,13,,171350,30328,DCZ
14,,SING,C1',C2',no,N,14,,171350,30328,DCZ
15,,SING,C1',O4',no,N,15,,171350,30328,DCZ
16,,SING,C1',H1',no,N,16,,171350,30328,DCZ
17,,SING,C2',C3',no,N,17,,171350,30328,DCZ
18,,SING,C2',H2'1,no,N,18,,171350,30328,DCZ
19,,SING,C2',H2'2,no,N,19,,171350,30328,DCZ
20,,SING,C3',C4',no,N,20,,171350,30328,DCZ
21,,SING,C3',O3',no,N,21,,171350,30328,DCZ
22,,SING,C3',H3',no,N,22,,171350,30328,DCZ
23,,SING,C4',O4',no,N,23,,171350,30328,DCZ
24,,SING,C4',C5',no,N,24,,171350,30328,DCZ
25,,SING,C4',H4',no,N,25,,171350,30328,DCZ
26,,SING,O3',HO3',no,N,26,,171350,30328,DCZ
27,,SING,C5',O5',no,N,27,,171350,30328,DCZ
28,,SING,C5',H5'1,no,N,28,,171350,30328,DCZ
29,,SING,C5',H5'2,no,N,29,,171350,30328,DCZ
30,,SING,O5',HO51,no,N,30,,171350,30328,DCZ
1,,SING,N1,C2,no,N,1,,171371,30329,5CM
2,,SING,N1,C6,no,N,2,,171371,30329,5CM
3,,SING,N1,C1',no,N,3,,171371,30329,5CM
4,,SING,C2,N3,no,N,4,,171371,30329,5CM
5,,DOUB,C2,O2,no,N,5,,171371,30329,5CM
6,,DOUB,N3,C4,no,N,6,,171371,30329,5CM
7,,SING,C4,C5,no,N,7,,171371,30329,5CM
8,,SING,C4,N4,no,N,8,,171371,30329,5CM
9,,SING,C5,C5A,no,N,9,,171371,30329,5CM
10,,DOUB,C5,C6,no,N,10,,171371,30329,5CM
11,,SING,C5A,H5A1,no,N,11,,171371,30329,5CM
12,,SING,C5A,H5A2,no,N,12,,171371,30329,5CM
13,,SING,C5A,H5A3,no,N,13,,171371,30329,5CM
14,,SING,C6,H6,no,N,14,,171371,30329,5CM
15,,SING,N4,HN41,no,N,15,,171371,30329,5CM
16,,SING,N4,HN42,no,N,16,,171371,30329,5CM
17,,SING,C1',C2',no,N,17,,171371,30329,5CM
18,,SING,C1',O4',no,N,18,,171371,30329,5CM
19,,SING,C1',H1',no,N,19,,171371,30329,5CM
20,,SING,C2',C3',no,N,20,,171371,30329,5CM
21,,SING,C2',H2',no,N,21,,171371,30329,5CM
22,,SING,C2',H2'',no,N,22,,171371,30329,5CM
23,,SING,C3',C4',no,N,23,,171371,30329,5CM
24,,SING,C3',O3',no,N,24,,171371,30329,5CM
25,,SING,C3',H3',no,N,25,,171371,30329,5CM
26,,SING,C4',O4',no,N,26,,171371,30329,5CM
27,,SING,C4',C5',no,N,27,,171371,30329,5CM
28,,SING,C4',H4',no,N,28,,171371,30329,5CM
29,,SING,O3',HO3',no,N,29,,171371,30329,5CM
30,,SING,C5',O5',no,N,30,,171371,30329,5CM
31,,SING,C5',H5',no,N,31,,171371,30329,5CM
32,,SING,C5',H5'',no,N,32,,171371,30329,5CM
33,,SING,O5',P,no,N,33,,171371,30329,5CM
34,,DOUB,P,OP1,no,N,34,,171371,30329,5CM
35,,SING,P,OP2,no,N,35,,171371,30329,5CM
36,,SING,P,OP3,no,N,36,,171371,30329,5CM
37,,SING,OP2,HOP2,no,N,37,,171371,30329,5CM
38,,SING,OP3,HOP3,no,N,38,,171371,30329,5CM
1,,SING,OP3,P,no,N,1,,171372,30329,8OG
2,,SING,OP3,HOP3,no,N,2,,171372,30329,8OG
3,,DOUB,P,OP1,no,N,3,,171372,30329,8OG
4,,SING,P,OP2,no,N,4,,171372,30329,8OG
5,,SING,P,O5',no,N,5,,171372,30329,8OG
6,,SING,OP2,HOP2,no,N,6,,171372,30329,8OG
7,,SING,O5',C5',no,N,7,,171372,30329,8OG
8,,SING,C5',C4',no,N,8,,171372,30329,8OG
9,,SING,C5',H5',no,N,9,,171372,30329,8OG
10,,SING,C5',H5'',no,N,10,,171372,30329,8OG
11,,SING,C4',O4',no,N,11,,171372,30329,8OG
12,,SING,C4',C3',no,N,12,,171372,30329,8OG
13,,SING,C4',H4',no,N,13,,171372,30329,8OG
14,,SING,O4',C1',no,N,14,,171372,30329,8OG
15,,SING,C3',O3',no,N,15,,171372,30329,8OG
16,,SING,C3',C2',no,N,16,,171372,30329,8OG
17,,SING,C3',H3',no,N,17,,171372,30329,8OG
18,,SING,O3',HO3',no,N,18,,171372,30329,8OG
19,,SING,C2',C1',no,N,19,,171372,30329,8OG
20,,SING,C2',H2',no,N,20,,171372,30329,8OG
21,,SING,C2',H2'',no,N,21,,171372,30329,8OG
22,,SING,C1',N9,no,N,22,,171372,30329,8OG
23,,SING,C1',H1',no,N,23,,171372,30329,8OG
24,,SING,N9,C8,no,N,24,,171372,30329,8OG
25,,SING,N9,C4,no,N,25,,171372,30329,8OG
26,,SING,C8,N7,no,N,26,,171372,30329,8OG
27,,DOUB,C8,O8,no,N,27,,171372,30329,8OG
28,,SING,N7,C5,no,N,28,,171372,30329,8OG
29,,SING,N7,H7,no,N,29,,171372,30329,8OG
30,,SING,C5,C6,no,N,30,,171372,30329,8OG
31,,DOUB,C5,C4,no,N,31,,171372,30329,8OG
32,,DOUB,C6,O6,no,N,32,,171372,30329,8OG
33,,SING,C6,N1,no,N,33,,171372,30329,8OG
34,,SING,N1,C2,no,N,34,,171372,30329,8OG
35,,SING,N1,H1,no,N,35,,171372,30329,8OG
36,,SING,C2,N2,no,N,36,,171372,30329,8OG
37,,DOUB,C2,N3,no,N,37,,171372,30329,8OG
38,,SING,N2,H21,no,N,38,,171372,30329,8OG
39,,SING,N2,H22,no,N,39,,171372,30329,8OG
40,,SING,N3,C4,no,N,40,,171372,30329,8OG
1,,SING,N1,C2,no,N,1,,171373,30329,DCZ
2,,SING,N1,C6,no,N,2,,171373,30329,DCZ
3,,SING,N1,C1',no,N,3,,171373,30329,DCZ
4,,SING,C2,N3,no,N,4,,171373,30329,DCZ
5,,DOUB,C2,O2,no,N,5,,171373,30329,DCZ
6,,DOUB,N3,C4,no,N,6,,171373,30329,DCZ
7,,SING,C4,C5,no,N,7,,171373,30329,DCZ
8,,SING,C4,N4,no,N,8,,171373,30329,DCZ
9,,DOUB,C5,C6,no,N,9,,171373,30329,DCZ
10,,SING,C5,H5,no,N,10,,171373,30329,DCZ
11,,SING,C6,H6,no,N,11,,171373,30329,DCZ
12,,SING,N4,HN41,no,N,12,,171373,30329,DCZ
13,,SING,N4,HN42,no,N,13,,171373,30329,DCZ
14,,SING,C1',C2',no,N,14,,171373,30329,DCZ
15,,SING,C1',O4',no,N,15,,171373,30329,DCZ
16,,SING,C1',H1',no,N,16,,171373,30329,DCZ
17,,SING,C2',C3',no,N,17,,171373,30329,DCZ
18,,SING,C2',H2'1,no,N,18,,171373,30329,DCZ
19,,SING,C2',H2'2,no,N,19,,171373,30329,DCZ
20,,SING,C3',C4',no,N,20,,171373,30329,DCZ
21,,SING,C3',O3',no,N,21,,171373,30329,DCZ
22,,SING,C3',H3',no,N,22,,171373,30329,DCZ
23,,SING,C4',O4',no,N,23,,171373,30329,DCZ
24,,SING,C4',C5',no,N,24,,171373,30329,DCZ
25,,SING,C4',H4',no,N,25,,171373,30329,DCZ
26,,SING,O3',HO3',no,N,26,,171373,30329,DCZ
27,,SING,C5',O5',no,N,27,,171373,30329,DCZ
28,,SING,C5',H5'1,no,N,28,,171373,30329,DCZ
29,,SING,C5',H5'2,no,N,29,,171373,30329,DCZ
30,,SING,O5',HO51,no,N,30,,171373,30329,DCZ
1,,SING,CA,C,no,N,1,,171456,30333,H00
2,,SING,CA,CB,no,N,2,,171456,30333,H00
3,,DOUB,C,O,no,N,3,,171456,30333,H00
4,,SING,CB,CG,no,N,4,,171456,30333,H00
5,,SING,CG,SD,no,N,5,,171456,30333,H00
6,,SING,CA,HA1,no,N,6,,171456,30333,H00
7,,SING,CA,HA2,no,N,7,,171456,30333,H00
8,,SING,CB,HB1,no,N,8,,171456,30333,H00
9,,SING,CB,HB2,no,N,9,,171456,30333,H00
10,,SING,CG,HG1,no,N,10,,171456,30333,H00
11,,SING,CG,HG2,no,N,11,,171456,30333,H00
12,,SING,SD,H1,no,N,12,,171456,30333,H00
13,,SING,C,OXT,no,N,13,,171456,30333,H00
14,,SING,OXT,H2,no,N,14,,171456,30333,H00
1,,SING,N,HN1,no,N,1,,171457,30333,NH2
2,,SING,N,HN2,no,N,2,,171457,30333,NH2
1,,DOUB,CE2,CZ1,yes,N,1,,171458,30333,B0I
2,,SING,CE2,CD2,yes,N,2,,171458,30333,B0I
3,,SING,CZ1,CE1,yes,N,3,,171458,30333,B0I
4,,DOUB,CZ2,CE4,yes,N,4,,171458,30333,B0I
5,,SING,CZ2,CE3,yes,N,5,,171458,30333,B0I
6,,SING,CE4,CD4,yes,N,6,,171458,30333,B0I
7,,DOUB,CD2,CG1,yes,N,7,,171458,30333,B0I
8,,SING,CE1,CE3,no,N,8,,171458,30333,B0I
9,,DOUB,CE1,CD1,yes,N,9,,171458,30333,B0I
10,,DOUB,CE3,CD3,yes,N,10,,171458,30333,B0I
11,,DOUB,CD4,CG2,yes,N,11,,171458,30333,B0I
12,,SING,CD3,CG2,yes,N,12,,171458,30333,B0I
13,,SING,CG2,CB2,no,N,13,,171458,30333,B0I
14,,SING,CG1,CD1,yes,N,14,,171458,30333,B0I
15,,SING,CG1,CB1,no,N,15,,171458,30333,B0I
16,,SING,CB1,HB11,no,N,16,,171458,30333,B0I
17,,SING,CB1,HB12,no,N,17,,171458,30333,B0I
18,,SING,CB1,H1,no,N,18,,171458,30333,B0I
19,,SING,CD1,HD1,no,N,19,,171458,30333,B0I
20,,SING,CD2,HD2,no,N,20,,171458,30333,B0I
21,,SING,CE2,HE2,no,N,21,,171458,30333,B0I
22,,SING,CZ1,HZ1,no,N,22,,171458,30333,B0I
23,,SING,CB2,HB22,no,N,23,,171458,30333,B0I
24,,SING,CB2,H2,no,N,24,,171458,30333,B0I
25,,SING,CB2,HB21,no,N,25,,171458,30333,B0I
26,,SING,CD3,HD3,no,N,26,,171458,30333,B0I
27,,SING,CD4,HD4,no,N,27,,171458,30333,B0I
28,,SING,CE4,HE4,no,N,28,,171458,30333,B0I
29,,SING,CZ2,HZ2,no,N,29,,171458,30333,B0I
1,,SING,N,CA,no,N,1,,171459,30333,DAL
2,,SING,N,H,no,N,2,,171459,30333,DAL
3,,SING,N,H2,no,N,3,,171459,30333,DAL
4,,SING,CA,CB,no,N,4,,171459,30333,DAL
5,,SING,CA,C,no,N,5,,171459,30333,DAL
6,,SING,CA,HA,no,N,6,,171459,30333,DAL
7,,SING,CB,HB1,no,N,7,,171459,30333,DAL
8,,SING,CB,HB2,no,N,8,,171459,30333,DAL
9,,SING,CB,HB3,no,N,9,,171459,30333,DAL
10,,DOUB,C,O,no,N,10,,171459,30333,DAL
11,,SING,C,OXT,no,N,11,,171459,30333,DAL
12,,SING,OXT,HXT,no,N,12,,171459,30333,DAL
1,,DOUB,N6,C21,no,N,1,,171512,30336,BVV
2,,SING,N7,C21,no,N,2,,171512,30336,BVV
3,,SING,C21,C20,no,N,3,,171512,30336,BVV
4,,DOUB,C20,C19,yes,N,4,,171512,30336,BVV
5,,SING,C20,C18,yes,N,5,,171512,30336,BVV
6,,SING,C19,C17,yes,N,6,,171512,30336,BVV
7,,DOUB,C18,C16,yes,N,7,,171512,30336,BVV
8,,DOUB,C17,C15,yes,N,8,,171512,30336,BVV
9,,SING,C16,C15,yes,N,9,,171512,30336,BVV
10,,SING,C15,C14,no,N,10,,171512,30336,BVV
11,,SING,C14,N5,yes,N,11,,171512,30336,BVV
12,,DOUB,C14,N4,yes,N,12,,171512,30336,BVV
13,,SING,N5,C12,yes,N,13,,171512,30336,BVV
14,,SING,N4,C13,yes,N,14,,171512,30336,BVV
15,,DOUB,C12,C13,yes,N,15,,171512,30336,BVV
16,,SING,C12,N3,yes,N,16,,171512,30336,BVV
17,,SING,C13,C11,yes,N,17,,171512,30336,BVV
18,,DOUB,N3,C9,yes,N,18,,171512,30336,BVV
19,,DOUB,C11,C10,yes,N,19,,171512,30336,BVV
20,,SING,C9,C10,yes,N,20,,171512,30336,BVV
21,,SING,C9,O1,no,N,21,,171512,30336,BVV
22,,SING,C8,O1,no,N,22,,171512,30336,BVV
23,,SING,C8,C7,no,N,23,,171512,30336,BVV
24,,DOUB,C3,C7,yes,N,24,,171512,30336,BVV
25,,SING,C3,C4,yes,N,25,,171512,30336,BVV
26,,SING,C7,C2,yes,N,26,,171512,30336,BVV
27,,DOUB,C4,C5,yes,N,27,,171512,30336,BVV
28,,DOUB,C2,C1,yes,N,28,,171512,30336,BVV
29,,DOUB,N2,C6,no,N,29,,171512,30336,BVV
30,,SING,C5,C1,yes,N,30,,171512,30336,BVV
31,,SING,C5,C6,no,N,31,,171512,30336,BVV
32,,SING,C6,N1,no,N,32,,171512,30336,BVV
33,,SING,C1,H1,no,N,33,,171512,30336,BVV
34,,SING,C2,H2,no,N,34,,171512,30336,BVV
35,,SING,C3,H3,no,N,35,,171512,30336,BVV
36,,SING,C4,H4,no,N,36,,171512,30336,BVV
37,,SING,N1,H6,no,N,37,,171512,30336,BVV
38,,SING,N1,H5,no,N,38,,171512,30336,BVV
39,,SING,N2,H8,no,N,39,,171512,30336,BVV
40,,SING,C8,H10,no,N,40,,171512,30336,BVV
41,,SING,C8,H9,no,N,41,,171512,30336,BVV
42,,SING,C10,H11,no,N,42,,171512,30336,BVV
43,,SING,C11,H12,no,N,43,,171512,30336,BVV
44,,SING,N5,H13,no,N,44,,171512,30336,BVV
45,,SING,C16,H14,no,N,45,,171512,30336,BVV
46,,SING,C18,H16,no,N,46,,171512,30336,BVV
47,,SING,C19,H17,no,N,47,,171512,30336,BVV
48,,SING,C17,H15,no,N,48,,171512,30336,BVV
49,,SING,N6,H18,no,N,49,,171512,30336,BVV
50,,SING,N7,H21,no,N,50,,171512,30336,BVV
51,,SING,N7,H20,no,N,51,,171512,30336,BVV
52,,SING,N2,H7,no,N,52,,171512,30336,BVV
53,,SING,N6,H19,no,N,53,,171512,30336,BVV
1,,DOUB,C,O1,no,N,1,,171701,30346,BE2
2,,SING,C,O2,no,N,2,,171701,30346,BE2
3,,SING,C,C1,no,N,3,,171701,30346,BE2
4,,SING,O2,HO2,no,N,4,,171701,30346,BE2
5,,DOUB,C1,C2,yes,N,5,,171701,30346,BE2
6,,SING,C1,C6,yes,N,6,,171701,30346,BE2
7,,SING,C2,C3,yes,N,7,,171701,30346,BE2
8,,SING,C2,N2,no,N,8,,171701,30346,BE2
9,,DOUB,C3,C4,yes,N,9,,171701,30346,BE2
10,,SING,C3,H3,no,N,10,,171701,30346,BE2
11,,SING,N2,HN21,no,N,11,,171701,30346,BE2
12,,SING,N2,HN22,no,N,12,,171701,30346,BE2
13,,SING,C4,C5,yes,N,13,,171701,30346,BE2
14,,SING,C4,H4,no,N,14,,171701,30346,BE2
15,,DOUB,C5,C6,yes,N,15,,171701,30346,BE2
16,,SING,C5,H5,no,N,16,,171701,30346,BE2
17,,SING,C6,H6,no,N,17,,171701,30346,BE2
1,,SING,N,CA,no,N,1,,171702,30346,DPN
2,,SING,N,H,no,N,2,,171702,30346,DPN
3,,SING,N,H2,no,N,3,,171702,30346,DPN
4,,SING,CA,C,no,N,4,,171702,30346,DPN
5,,SING,CA,CB,no,N,5,,171702,30346,DPN
6,,SING,CA,HA,no,N,6,,171702,30346,DPN
7,,DOUB,C,O,no,N,7,,171702,30346,DPN
8,,SING,C,OXT,no,N,8,,171702,30346,DPN
9,,SING,OXT,HXT,no,N,9,,171702,30346,DPN
10,,SING,CB,CG,no,N,10,,171702,30346,DPN
11,,SING,CB,HB2,no,N,11,,171702,30346,DPN
12,,SING,CB,HB3,no,N,12,,171702,30346,DPN
13,,DOUB,CG,CD1,yes,N,13,,171702,30346,DPN
14,,SING,CG,CD2,yes,N,14,,171702,30346,DPN
15,,SING,CD1,CE1,yes,N,15,,171702,30346,DPN
16,,SING,CD1,HD1,no,N,16,,171702,30346,DPN
17,,DOUB,CD2,CE2,yes,N,17,,171702,30346,DPN
18,,SING,CD2,HD2,no,N,18,,171702,30346,DPN
19,,DOUB,CE1,CZ,yes,N,19,,171702,30346,DPN
20,,SING,CE1,HE1,no,N,20,,171702,30346,DPN
21,,SING,CE2,CZ,yes,N,21,,171702,30346,DPN
22,,SING,CE2,HE2,no,N,22,,171702,30346,DPN
23,,SING,CZ,HZ,no,N,23,,171702,30346,DPN
1,,SING,N,CA,no,N,1,,171703,30346,ORN
2,,SING,N,H,no,N,2,,171703,30346,ORN
3,,SING,N,H2,no,N,3,,171703,30346,ORN
4,,SING,CA,CB,no,N,4,,171703,30346,ORN
5,,SING,CA,C,no,N,5,,171703,30346,ORN
6,,SING,CA,HA,no,N,6,,171703,30346,ORN
7,,SING,CB,CG,no,N,7,,171703,30346,ORN
8,,SING,CB,HB2,no,N,8,,171703,30346,ORN
9,,SING,CB,HB3,no,N,9,,171703,30346,ORN
10,,SING,CG,CD,no,N,10,,171703,30346,ORN
11,,SING,CG,HG2,no,N,11,,171703,30346,ORN
12,,SING,CG,HG3,no,N,12,,171703,30346,ORN
13,,SING,CD,NE,no,N,13,,171703,30346,ORN
14,,SING,CD,HD2,no,N,14,,171703,30346,ORN
15,,SING,CD,HD3,no,N,15,,171703,30346,ORN
16,,SING,NE,HE1,no,N,16,,171703,30346,ORN
17,,SING,NE,HE2,no,N,17,,171703,30346,ORN
18,,DOUB,C,O,no,N,18,,171703,30346,ORN
19,,SING,C,OXT,no,N,19,,171703,30346,ORN
20,,SING,OXT,HXT,no,N,20,,171703,30346,ORN
1,,DOUB,C,O1,no,N,1,,171719,30347,BE2
2,,SING,C,O2,no,N,2,,171719,30347,BE2
3,,SING,C,C1,no,N,3,,171719,30347,BE2
4,,SING,O2,HO2,no,N,4,,171719,30347,BE2
5,,DOUB,C1,C2,yes,N,5,,171719,30347,BE2
6,,SING,C1,C6,yes,N,6,,171719,30347,BE2
7,,SING,C2,C3,yes,N,7,,171719,30347,BE2
8,,SING,C2,N2,no,N,8,,171719,30347,BE2
9,,DOUB,C3,C4,yes,N,9,,171719,30347,BE2
10,,SING,C3,H3,no,N,10,,171719,30347,BE2
11,,SING,N2,HN21,no,N,11,,171719,30347,BE2
12,,SING,N2,HN22,no,N,12,,171719,30347,BE2
13,,SING,C4,C5,yes,N,13,,171719,30347,BE2
14,,SING,C4,H4,no,N,14,,171719,30347,BE2
15,,DOUB,C5,C6,yes,N,15,,171719,30347,BE2
16,,SING,C5,H5,no,N,16,,171719,30347,BE2
17,,SING,C6,H6,no,N,17,,171719,30347,BE2
1,,SING,N,CA,no,N,1,,171720,30347,DPN
2,,SING,N,H,no,N,2,,171720,30347,DPN
3,,SING,N,H2,no,N,3,,171720,30347,DPN
4,,SING,CA,C,no,N,4,,171720,30347,DPN
5,,SING,CA,CB,no,N,5,,171720,30347,DPN
6,,SING,CA,HA,no,N,6,,171720,30347,DPN
7,,DOUB,C,O,no,N,7,,171720,30347,DPN
8,,SING,C,OXT,no,N,8,,171720,30347,DPN
9,,SING,OXT,HXT,no,N,9,,171720,30347,DPN
10,,SING,CB,CG,no,N,10,,171720,30347,DPN
11,,SING,CB,HB2,no,N,11,,171720,30347,DPN
12,,SING,CB,HB3,no,N,12,,171720,30347,DPN
13,,DOUB,CG,CD1,yes,N,13,,171720,30347,DPN
14,,SING,CG,CD2,yes,N,14,,171720,30347,DPN
15,,SING,CD1,CE1,yes,N,15,,171720,30347,DPN
16,,SING,CD1,HD1,no,N,16,,171720,30347,DPN
17,,DOUB,CD2,CE2,yes,N,17,,171720,30347,DPN
18,,SING,CD2,HD2,no,N,18,,171720,30347,DPN
19,,DOUB,CE1,CZ,yes,N,19,,171720,30347,DPN
20,,SING,CE1,HE1,no,N,20,,171720,30347,DPN
21,,SING,CE2,CZ,yes,N,21,,171720,30347,DPN
22,,SING,CE2,HE2,no,N,22,,171720,30347,DPN
23,,SING,CZ,HZ,no,N,23,,171720,30347,DPN
1,,SING,N,CA,no,N,1,,171721,30347,ORN
2,,SING,N,H,no,N,2,,171721,30347,ORN
3,,SING,N,H2,no,N,3,,171721,30347,ORN
4,,SING,CA,CB,no,N,4,,171721,30347,ORN
5,,SING,CA,C,no,N,5,,171721,30347,ORN
6,,SING,CA,HA,no,N,6,,171721,30347,ORN
7,,SING,CB,CG,no,N,7,,171721,30347,ORN
8,,SING,CB,HB2,no,N,8,,171721,30347,ORN
9,,SING,CB,HB3,no,N,9,,171721,30347,ORN
10,,SING,CG,CD,no,N,10,,171721,30347,ORN
11,,SING,CG,HG2,no,N,11,,171721,30347,ORN
12,,SING,CG,HG3,no,N,12,,171721,30347,ORN
13,,SING,CD,NE,no,N,13,,171721,30347,ORN
14,,SING,CD,HD2,no,N,14,,171721,30347,ORN
15,,SING,CD,HD3,no,N,15,,171721,30347,ORN
16,,SING,NE,HE1,no,N,16,,171721,30347,ORN
17,,SING,NE,HE2,no,N,17,,171721,30347,ORN
18,,DOUB,C,O,no,N,18,,171721,30347,ORN
19,,SING,C,OXT,no,N,19,,171721,30347,ORN
20,,SING,OXT,HXT,no,N,20,,171721,30347,ORN
1,,SING,N,CA,no,N,1,,171886,30355,DGN
2,,SING,N,H,no,N,2,,171886,30355,DGN
3,,SING,N,H2,no,N,3,,171886,30355,DGN
4,,SING,CA,C,no,N,4,,171886,30355,DGN
5,,SING,CA,CB,no,N,5,,171886,30355,DGN
6,,SING,CA,HA,no,N,6,,171886,30355,DGN
7,,DOUB,C,O,no,N,7,,171886,30355,DGN
8,,SING,C,OXT,no,N,8,,171886,30355,DGN
9,,SING,OXT,HXT,no,N,9,,171886,30355,DGN
10,,SING,CB,CG,no,N,10,,171886,30355,DGN
11,,SING,CB,HB2,no,N,11,,171886,30355,DGN
12,,SING,CB,HB3,no,N,12,,171886,30355,DGN
13,,SING,CG,CD,no,N,13,,171886,30355,DGN
14,,SING,CG,HG2,no,N,14,,171886,30355,DGN
15,,SING,CG,HG3,no,N,15,,171886,30355,DGN
16,,DOUB,CD,OE1,no,N,16,,171886,30355,DGN
17,,SING,CD,NE2,no,N,17,,171886,30355,DGN
18,,SING,NE2,HE21,no,N,18,,171886,30355,DGN
19,,SING,NE2,HE22,no,N,19,,171886,30355,DGN
1,,SING,N,CA,no,N,1,,171887,30355,DPR
2,,SING,N,CD,no,N,2,,171887,30355,DPR
3,,SING,N,H,no,N,3,,171887,30355,DPR
4,,SING,CA,CB,no,N,4,,171887,30355,DPR
5,,SING,CA,C,no,N,5,,171887,30355,DPR
6,,SING,CA,HA,no,N,6,,171887,30355,DPR
7,,SING,CB,CG,no,N,7,,171887,30355,DPR
8,,SING,CB,HB2,no,N,8,,171887,30355,DPR
9,,SING,CB,HB3,no,N,9,,171887,30355,DPR
10,,SING,CG,CD,no,N,10,,171887,30355,DPR
11,,SING,CG,HG2,no,N,11,,171887,30355,DPR
12,,SING,CG,HG3,no,N,12,,171887,30355,DPR
13,,SING,CD,HD2,no,N,13,,171887,30355,DPR
14,,SING,CD,HD3,no,N,14,,171887,30355,DPR
15,,DOUB,C,O,no,N,15,,171887,30355,DPR
16,,SING,C,OXT,no,N,16,,171887,30355,DPR
17,,SING,OXT,HXT,no,N,17,,171887,30355,DPR
1,,SING,N,CA,no,N,1,,171888,30355,DAR
2,,SING,N,H,no,N,2,,171888,30355,DAR
3,,SING,N,H2,no,N,3,,171888,30355,DAR
4,,SING,CA,CB,no,N,4,,171888,30355,DAR
5,,SING,CA,C,no,N,5,,171888,30355,DAR
6,,SING,CA,HA,no,N,6,,171888,30355,DAR
7,,SING,CB,CG,no,N,7,,171888,30355,DAR
8,,SING,CB,HB2,no,N,8,,171888,30355,DAR
9,,SING,CB,HB3,no,N,9,,171888,30355,DAR
10,,SING,CG,CD,no,N,10,,171888,30355,DAR
11,,SING,CG,HG2,no,N,11,,171888,30355,DAR
12,,SING,CG,HG3,no,N,12,,171888,30355,DAR
13,,SING,CD,NE,no,N,13,,171888,30355,DAR
14,,SING,CD,HD2,no,N,14,,171888,30355,DAR
15,,SING,CD,HD3,no,N,15,,171888,30355,DAR
16,,SING,NE,CZ,no,N,16,,171888,30355,DAR
17,,SING,NE,HE,no,N,17,,171888,30355,DAR
18,,SING,CZ,NH1,no,N,18,,171888,30355,DAR
19,,DOUB,CZ,NH2,no,N,19,,171888,30355,DAR
20,,SING,NH1,HH11,no,N,20,,171888,30355,DAR
21,,SING,NH1,HH12,no,N,21,,171888,30355,DAR
22,,SING,NH2,HH21,no,N,22,,171888,30355,DAR
23,,SING,NH2,HH22,no,N,23,,171888,30355,DAR
24,,DOUB,C,O,no,N,24,,171888,30355,DAR
25,,SING,C,OXT,no,N,25,,171888,30355,DAR
26,,SING,OXT,HXT,no,N,26,,171888,30355,DAR
1,,SING,N,CA,no,N,1,,171905,30356,DPR
2,,SING,N,CD,no,N,2,,171905,30356,DPR
3,,SING,N,H,no,N,3,,171905,30356,DPR
4,,SING,CA,CB,no,N,4,,171905,30356,DPR
5,,SING,CA,C,no,N,5,,171905,30356,DPR
6,,SING,CA,HA,no,N,6,,171905,30356,DPR
7,,SING,CB,CG,no,N,7,,171905,30356,DPR
8,,SING,CB,HB2,no,N,8,,171905,30356,DPR
9,,SING,CB,HB3,no,N,9,,171905,30356,DPR
10,,SING,CG,CD,no,N,10,,171905,30356,DPR
11,,SING,CG,HG2,no,N,11,,171905,30356,DPR
12,,SING,CG,HG3,no,N,12,,171905,30356,DPR
13,,SING,CD,HD2,no,N,13,,171905,30356,DPR
14,,SING,CD,HD3,no,N,14,,171905,30356,DPR
15,,DOUB,C,O,no,N,15,,171905,30356,DPR
16,,SING,C,OXT,no,N,16,,171905,30356,DPR
17,,SING,OXT,HXT,no,N,17,,171905,30356,DPR
1,,SING,N,CA,no,N,1,,171906,30356,DSG
2,,SING,N,H,no,N,2,,171906,30356,DSG
3,,SING,N,H2,no,N,3,,171906,30356,DSG
4,,SING,CA,C,no,N,4,,171906,30356,DSG
5,,SING,CA,CB,no,N,5,,171906,30356,DSG
6,,SING,CA,HA,no,N,6,,171906,30356,DSG
7,,DOUB,C,O,no,N,7,,171906,30356,DSG
8,,SING,C,OXT,no,N,8,,171906,30356,DSG
9,,SING,CB,CG,no,N,9,,171906,30356,DSG
10,,SING,CB,HB2,no,N,10,,171906,30356,DSG
11,,SING,CB,HB3,no,N,11,,171906,30356,DSG
12,,DOUB,CG,OD1,no,N,12,,171906,30356,DSG
13,,SING,CG,ND2,no,N,13,,171906,30356,DSG
14,,SING,ND2,HD21,no,N,14,,171906,30356,DSG
15,,SING,ND2,HD22,no,N,15,,171906,30356,DSG
16,,SING,OXT,HXT,no,N,16,,171906,30356,DSG
1,,SING,N,CA,no,N,1,,171907,30356,DLY
2,,SING,N,H,no,N,2,,171907,30356,DLY
3,,SING,N,H2,no,N,3,,171907,30356,DLY
4,,SING,CA,C,no,N,4,,171907,30356,DLY
5,,SING,CA,CB,no,N,5,,171907,30356,DLY
6,,SING,CA,HA,no,N,6,,171907,30356,DLY
7,,DOUB,C,O,no,N,7,,171907,30356,DLY
8,,SING,C,OXT,no,N,8,,171907,30356,DLY
9,,SING,CB,CG,no,N,9,,171907,30356,DLY
10,,SING,CB,HB2,no,N,10,,171907,30356,DLY
11,,SING,CB,HB3,no,N,11,,171907,30356,DLY
12,,SING,CG,CD,no,N,12,,171907,30356,DLY
13,,SING,CG,HG2,no,N,13,,171907,30356,DLY
14,,SING,CG,HG3,no,N,14,,171907,30356,DLY
15,,SING,CD,CE,no,N,15,,171907,30356,DLY
16,,SING,CD,HD2,no,N,16,,171907,30356,DLY
17,,SING,CD,HD3,no,N,17,,171907,30356,DLY
18,,SING,CE,NZ,no,N,18,,171907,30356,DLY
19,,SING,CE,HE2,no,N,19,,171907,30356,DLY
20,,SING,CE,HE3,no,N,20,,171907,30356,DLY
21,,SING,NZ,HZ1,no,N,21,,171907,30356,DLY
22,,SING,NZ,HZ2,no,N,22,,171907,30356,DLY
23,,SING,OXT,HXT,no,N,23,,171907,30356,DLY
1,,SING,N,CA,no,N,1,,171924,30357,DAR
2,,SING,N,H,no,N,2,,171924,30357,DAR
3,,SING,N,H2,no,N,3,,171924,30357,DAR
4,,SING,CA,CB,no,N,4,,171924,30357,DAR
5,,SING,CA,C,no,N,5,,171924,30357,DAR
6,,SING,CA,HA,no,N,6,,171924,30357,DAR
7,,SING,CB,CG,no,N,7,,171924,30357,DAR
8,,SING,CB,HB2,no,N,8,,171924,30357,DAR
9,,SING,CB,HB3,no,N,9,,171924,30357,DAR
10,,SING,CG,CD,no,N,10,,171924,30357,DAR
11,,SING,CG,HG2,no,N,11,,171924,30357,DAR
12,,SING,CG,HG3,no,N,12,,171924,30357,DAR
13,,SING,CD,NE,no,N,13,,171924,30357,DAR
14,,SING,CD,HD2,no,N,14,,171924,30357,DAR
15,,SING,CD,HD3,no,N,15,,171924,30357,DAR
16,,SING,NE,CZ,no,N,16,,171924,30357,DAR
17,,SING,NE,HE,no,N,17,,171924,30357,DAR
18,,SING,CZ,NH1,no,N,18,,171924,30357,DAR
19,,DOUB,CZ,NH2,no,N,19,,171924,30357,DAR
20,,SING,NH1,HH11,no,N,20,,171924,30357,DAR
21,,SING,NH1,HH12,no,N,21,,171924,30357,DAR
22,,SING,NH2,HH21,no,N,22,,171924,30357,DAR
23,,SING,NH2,HH22,no,N,23,,171924,30357,DAR
24,,DOUB,C,O,no,N,24,,171924,30357,DAR
25,,SING,C,OXT,no,N,25,,171924,30357,DAR
26,,SING,OXT,HXT,no,N,26,,171924,30357,DAR
1,,SING,N,CA,no,N,1,,171925,30357,DPR
2,,SING,N,CD,no,N,2,,171925,30357,DPR
3,,SING,N,H,no,N,3,,171925,30357,DPR
4,,SING,CA,CB,no,N,4,,171925,30357,DPR
5,,SING,CA,C,no,N,5,,171925,30357,DPR
6,,SING,CA,HA,no,N,6,,171925,30357,DPR
7,,SING,CB,CG,no,N,7,,171925,30357,DPR
8,,SING,CB,HB2,no,N,8,,171925,30357,DPR
9,,SING,CB,HB3,no,N,9,,171925,30357,DPR
10,,SING,CG,CD,no,N,10,,171925,30357,DPR
11,,SING,CG,HG2,no,N,11,,171925,30357,DPR
12,,SING,CG,HG3,no,N,12,,171925,30357,DPR
13,,SING,CD,HD2,no,N,13,,171925,30357,DPR
14,,SING,CD,HD3,no,N,14,,171925,30357,DPR
15,,DOUB,C,O,no,N,15,,171925,30357,DPR
16,,SING,C,OXT,no,N,16,,171925,30357,DPR
17,,SING,OXT,HXT,no,N,17,,171925,30357,DPR
1,,SING,N,CA,no,N,1,,171926,30357,DGL
2,,SING,N,H,no,N,2,,171926,30357,DGL
3,,SING,N,H2,no,N,3,,171926,30357,DGL
4,,SING,CA,C,no,N,4,,171926,30357,DGL
5,,SING,CA,CB,no,N,5,,171926,30357,DGL
6,,SING,CA,HA,no,N,6,,171926,30357,DGL
7,,DOUB,C,O,no,N,7,,171926,30357,DGL
8,,SING,C,OXT,no,N,8,,171926,30357,DGL
9,,SING,CB,CG,no,N,9,,171926,30357,DGL
10,,SING,CB,HB2,no,N,10,,171926,30357,DGL
11,,SING,CB,HB3,no,N,11,,171926,30357,DGL
12,,SING,CG,CD,no,N,12,,171926,30357,DGL
13,,SING,CG,HG2,no,N,13,,171926,30357,DGL
14,,SING,CG,HG3,no,N,14,,171926,30357,DGL
15,,DOUB,CD,OE1,no,N,15,,171926,30357,DGL
16,,SING,CD,OE2,no,N,16,,171926,30357,DGL
17,,SING,OE2,HE2,no,N,17,,171926,30357,DGL
18,,SING,OXT,HXT,no,N,18,,171926,30357,DGL
1,,SING,N,CA,no,N,1,,171927,30357,DGN
2,,SING,N,H,no,N,2,,171927,30357,DGN
3,,SING,N,H2,no,N,3,,171927,30357,DGN
4,,SING,CA,C,no,N,4,,171927,30357,DGN
5,,SING,CA,CB,no,N,5,,171927,30357,DGN
6,,SING,CA,HA,no,N,6,,171927,30357,DGN
7,,DOUB,C,O,no,N,7,,171927,30357,DGN
8,,SING,C,OXT,no,N,8,,171927,30357,DGN
9,,SING,OXT,HXT,no,N,9,,171927,30357,DGN
10,,SING,CB,CG,no,N,10,,171927,30357,DGN
11,,SING,CB,HB2,no,N,11,,171927,30357,DGN
12,,SING,CB,HB3,no,N,12,,171927,30357,DGN
13,,SING,CG,CD,no,N,13,,171927,30357,DGN
14,,SING,CG,HG2,no,N,14,,171927,30357,DGN
15,,SING,CG,HG3,no,N,15,,171927,30357,DGN
16,,DOUB,CD,OE1,no,N,16,,171927,30357,DGN
17,,SING,CD,NE2,no,N,17,,171927,30357,DGN
18,,SING,NE2,HE21,no,N,18,,171927,30357,DGN
19,,SING,NE2,HE22,no,N,19,,171927,30357,DGN
1,,SING,N,CA,no,N,1,,171944,30358,DPR
2,,SING,N,CD,no,N,2,,171944,30358,DPR
3,,SING,N,H,no,N,3,,171944,30358,DPR
4,,SING,CA,CB,no,N,4,,171944,30358,DPR
5,,SING,CA,C,no,N,5,,171944,30358,DPR
6,,SING,CA,HA,no,N,6,,171944,30358,DPR
7,,SING,CB,CG,no,N,7,,171944,30358,DPR
8,,SING,CB,HB2,no,N,8,,171944,30358,DPR
9,,SING,CB,HB3,no,N,9,,171944,30358,DPR
10,,SING,CG,CD,no,N,10,,171944,30358,DPR
11,,SING,CG,HG2,no,N,11,,171944,30358,DPR
12,,SING,CG,HG3,no,N,12,,171944,30358,DPR
13,,SING,CD,HD2,no,N,13,,171944,30358,DPR
14,,SING,CD,HD3,no,N,14,,171944,30358,DPR
15,,DOUB,C,O,no,N,15,,171944,30358,DPR
16,,SING,C,OXT,no,N,16,,171944,30358,DPR
17,,SING,OXT,HXT,no,N,17,,171944,30358,DPR
1,,SING,N,CA,no,N,1,,171945,30358,DGN
2,,SING,N,H,no,N,2,,171945,30358,DGN
3,,SING,N,H2,no,N,3,,171945,30358,DGN
4,,SING,CA,C,no,N,4,,171945,30358,DGN
5,,SING,CA,CB,no,N,5,,171945,30358,DGN
6,,SING,CA,HA,no,N,6,,171945,30358,DGN
7,,DOUB,C,O,no,N,7,,171945,30358,DGN
8,,SING,C,OXT,no,N,8,,171945,30358,DGN
9,,SING,OXT,HXT,no,N,9,,171945,30358,DGN
10,,SING,CB,CG,no,N,10,,171945,30358,DGN
11,,SING,CB,HB2,no,N,11,,171945,30358,DGN
12,,SING,CB,HB3,no,N,12,,171945,30358,DGN
13,,SING,CG,CD,no,N,13,,171945,30358,DGN
14,,SING,CG,HG2,no,N,14,,171945,30358,DGN
15,,SING,CG,HG3,no,N,15,,171945,30358,DGN
16,,DOUB,CD,OE1,no,N,16,,171945,30358,DGN
17,,SING,CD,NE2,no,N,17,,171945,30358,DGN
18,,SING,NE2,HE21,no,N,18,,171945,30358,DGN
19,,SING,NE2,HE22,no,N,19,,171945,30358,DGN
1,,SING,N,CA,no,N,1,,171946,30358,DHI
2,,SING,N,H,no,N,2,,171946,30358,DHI
3,,SING,N,H2,no,N,3,,171946,30358,DHI
4,,SING,CA,C,no,N,4,,171946,30358,DHI
5,,SING,CA,CB,no,N,5,,171946,30358,DHI
6,,SING,CA,HA,no,N,6,,171946,30358,DHI
7,,DOUB,C,O,no,N,7,,171946,30358,DHI
8,,SING,C,OXT,no,N,8,,171946,30358,DHI
9,,SING,CB,CG,no,N,9,,171946,30358,DHI
10,,SING,CB,HB2,no,N,10,,171946,30358,DHI
11,,SING,CB,HB3,no,N,11,,171946,30358,DHI
12,,SING,CG,ND1,yes,N,12,,171946,30358,DHI
13,,DOUB,CG,CD2,yes,N,13,,171946,30358,DHI
14,,DOUB,ND1,CE1,yes,N,14,,171946,30358,DHI
15,,SING,ND1,HD1,no,N,15,,171946,30358,DHI
16,,SING,CD2,NE2,yes,N,16,,171946,30358,DHI
17,,SING,CD2,HD2,no,N,17,,171946,30358,DHI
18,,SING,CE1,NE2,yes,N,18,,171946,30358,DHI
19,,SING,CE1,HE1,no,N,19,,171946,30358,DHI
20,,SING,NE2,HE2,no,N,20,,171946,30358,DHI
21,,SING,OXT,HXT,no,N,21,,171946,30358,DHI
1,,SING,N,CA,no,N,1,,171963,30359,DLE
2,,SING,N,H,no,N,2,,171963,30359,DLE
3,,SING,N,H2,no,N,3,,171963,30359,DLE
4,,SING,CA,CB,no,N,4,,171963,30359,DLE
5,,SING,CA,C,no,N,5,,171963,30359,DLE
6,,SING,CA,HA,no,N,6,,171963,30359,DLE
7,,SING,CB,CG,no,N,7,,171963,30359,DLE
8,,SING,CB,HB2,no,N,8,,171963,30359,DLE
9,,SING,CB,HB3,no,N,9,,171963,30359,DLE
10,,SING,CG,CD1,no,N,10,,171963,30359,DLE
11,,SING,CG,CD2,no,N,11,,171963,30359,DLE
12,,SING,CG,HG,no,N,12,,171963,30359,DLE
13,,SING,CD1,HD11,no,N,13,,171963,30359,DLE
14,,SING,CD1,HD12,no,N,14,,171963,30359,DLE
15,,SING,CD1,HD13,no,N,15,,171963,30359,DLE
16,,SING,CD2,HD21,no,N,16,,171963,30359,DLE
17,,SING,CD2,HD22,no,N,17,,171963,30359,DLE
18,,SING,CD2,HD23,no,N,18,,171963,30359,DLE
19,,DOUB,C,O,no,N,19,,171963,30359,DLE
20,,SING,C,OXT,no,N,20,,171963,30359,DLE
21,,SING,OXT,HXT,no,N,21,,171963,30359,DLE
1,,SING,N,CA,no,N,1,,171964,30359,DPR
2,,SING,N,CD,no,N,2,,171964,30359,DPR
3,,SING,N,H,no,N,3,,171964,30359,DPR
4,,SING,CA,CB,no,N,4,,171964,30359,DPR
5,,SING,CA,C,no,N,5,,171964,30359,DPR
6,,SING,CA,HA,no,N,6,,171964,30359,DPR
7,,SING,CB,CG,no,N,7,,171964,30359,DPR
8,,SING,CB,HB2,no,N,8,,171964,30359,DPR
9,,SING,CB,HB3,no,N,9,,171964,30359,DPR
10,,SING,CG,CD,no,N,10,,171964,30359,DPR
11,,SING,CG,HG2,no,N,11,,171964,30359,DPR
12,,SING,CG,HG3,no,N,12,,171964,30359,DPR
13,,SING,CD,HD2,no,N,13,,171964,30359,DPR
14,,SING,CD,HD3,no,N,14,,171964,30359,DPR
15,,DOUB,C,O,no,N,15,,171964,30359,DPR
16,,SING,C,OXT,no,N,16,,171964,30359,DPR
17,,SING,OXT,HXT,no,N,17,,171964,30359,DPR
1,,SING,N,CA,no,N,1,,171965,30359,DTH
2,,SING,N,H,no,N,2,,171965,30359,DTH
3,,SING,N,HN2,no,N,3,,171965,30359,DTH
4,,SING,CA,CB,no,N,4,,171965,30359,DTH
5,,SING,CA,C,no,N,5,,171965,30359,DTH
6,,SING,CA,HA,no,N,6,,171965,30359,DTH
7,,SING,CB,CG2,no,N,7,,171965,30359,DTH
8,,SING,CB,OG1,no,N,8,,171965,30359,DTH
9,,SING,CB,HB,no,N,9,,171965,30359,DTH
10,,SING,CG2,HG21,no,N,10,,171965,30359,DTH
11,,SING,CG2,HG22,no,N,11,,171965,30359,DTH
12,,SING,CG2,HG23,no,N,12,,171965,30359,DTH
13,,SING,OG1,HG1,no,N,13,,171965,30359,DTH
14,,DOUB,C,O,no,N,14,,171965,30359,DTH
15,,SING,C,OXT,no,N,15,,171965,30359,DTH
16,,SING,OXT,HXT,no,N,16,,171965,30359,DTH
1,,SING,N,CA,no,N,1,,171966,30359,DVA
2,,SING,N,H,no,N,2,,171966,30359,DVA
3,,SING,N,H2,no,N,3,,171966,30359,DVA
4,,SING,CA,CB,no,N,4,,171966,30359,DVA
5,,SING,CA,C,no,N,5,,171966,30359,DVA
6,,SING,CA,HA,no,N,6,,171966,30359,DVA
7,,SING,CB,CG1,no,N,7,,171966,30359,DVA
8,,SING,CB,CG2,no,N,8,,171966,30359,DVA
9,,SING,CB,HB,no,N,9,,171966,30359,DVA
10,,SING,CG1,HG11,no,N,10,,171966,30359,DVA
11,,SING,CG1,HG12,no,N,11,,171966,30359,DVA
12,,SING,CG1,HG13,no,N,12,,171966,30359,DVA
13,,SING,CG2,HG21,no,N,13,,171966,30359,DVA
14,,SING,CG2,HG22,no,N,14,,171966,30359,DVA
15,,SING,CG2,HG23,no,N,15,,171966,30359,DVA
16,,DOUB,C,O,no,N,16,,171966,30359,DVA
17,,SING,C,OXT,no,N,17,,171966,30359,DVA
18,,SING,OXT,HXT,no,N,18,,171966,30359,DVA
1,,SING,N,CA,no,N,1,,171996,30360,DVA
2,,SING,N,H,no,N,2,,171996,30360,DVA
3,,SING,N,H2,no,N,3,,171996,30360,DVA
4,,SING,CA,CB,no,N,4,,171996,30360,DVA
5,,SING,CA,C,no,N,5,,171996,30360,DVA
6,,SING,CA,HA,no,N,6,,171996,30360,DVA
7,,SING,CB,CG1,no,N,7,,171996,30360,DVA
8,,SING,CB,CG2,no,N,8,,171996,30360,DVA
9,,SING,CB,HB,no,N,9,,171996,30360,DVA
10,,SING,CG1,HG11,no,N,10,,171996,30360,DVA
11,,SING,CG1,HG12,no,N,11,,171996,30360,DVA
12,,SING,CG1,HG13,no,N,12,,171996,30360,DVA
13,,SING,CG2,HG21,no,N,13,,171996,30360,DVA
14,,SING,CG2,HG22,no,N,14,,171996,30360,DVA
15,,SING,CG2,HG23,no,N,15,,171996,30360,DVA
16,,DOUB,C,O,no,N,16,,171996,30360,DVA
17,,SING,C,OXT,no,N,17,,171996,30360,DVA
18,,SING,OXT,HXT,no,N,18,,171996,30360,DVA
1,,SING,N,CA,no,N,1,,171997,30360,DAL
2,,SING,N,H,no,N,2,,171997,30360,DAL
3,,SING,N,H2,no,N,3,,171997,30360,DAL
4,,SING,CA,CB,no,N,4,,171997,30360,DAL
5,,SING,CA,C,no,N,5,,171997,30360,DAL
6,,SING,CA,HA,no,N,6,,171997,30360,DAL
7,,SING,CB,HB1,no,N,7,,171997,30360,DAL
8,,SING,CB,HB2,no,N,8,,171997,30360,DAL
9,,SING,CB,HB3,no,N,9,,171997,30360,DAL
10,,DOUB,C,O,no,N,10,,171997,30360,DAL
11,,SING,C,OXT,no,N,11,,171997,30360,DAL
12,,SING,OXT,HXT,no,N,12,,171997,30360,DAL
1,,SING,N,CA,no,N,1,,171998,30360,DPR
2,,SING,N,CD,no,N,2,,171998,30360,DPR
3,,SING,N,H,no,N,3,,171998,30360,DPR
4,,SING,CA,CB,no,N,4,,171998,30360,DPR
5,,SING,CA,C,no,N,5,,171998,30360,DPR
6,,SING,CA,HA,no,N,6,,171998,30360,DPR
7,,SING,CB,CG,no,N,7,,171998,30360,DPR
8,,SING,CB,HB2,no,N,8,,171998,30360,DPR
9,,SING,CB,HB3,no,N,9,,171998,30360,DPR
10,,SING,CG,CD,no,N,10,,171998,30360,DPR
11,,SING,CG,HG2,no,N,11,,171998,30360,DPR
12,,SING,CG,HG3,no,N,12,,171998,30360,DPR
13,,SING,CD,HD2,no,N,13,,171998,30360,DPR
14,,SING,CD,HD3,no,N,14,,171998,30360,DPR
15,,DOUB,C,O,no,N,15,,171998,30360,DPR
16,,SING,C,OXT,no,N,16,,171998,30360,DPR
17,,SING,OXT,HXT,no,N,17,,171998,30360,DPR
1,,SING,N,CA,no,N,1,,171999,30360,DGL
2,,SING,N,H,no,N,2,,171999,30360,DGL
3,,SING,N,H2,no,N,3,,171999,30360,DGL
4,,SING,CA,C,no,N,4,,171999,30360,DGL
5,,SING,CA,CB,no,N,5,,171999,30360,DGL
6,,SING,CA,HA,no,N,6,,171999,30360,DGL
7,,DOUB,C,O,no,N,7,,171999,30360,DGL
8,,SING,C,OXT,no,N,8,,171999,30360,DGL
9,,SING,CB,CG,no,N,9,,171999,30360,DGL
10,,SING,CB,HB2,no,N,10,,171999,30360,DGL
11,,SING,CB,HB3,no,N,11,,171999,30360,DGL
12,,SING,CG,CD,no,N,12,,171999,30360,DGL
13,,SING,CG,HG2,no,N,13,,171999,30360,DGL
14,,SING,CG,HG3,no,N,14,,171999,30360,DGL
15,,DOUB,CD,OE1,no,N,15,,171999,30360,DGL
16,,SING,CD,OE2,no,N,16,,171999,30360,DGL
17,,SING,OE2,HE2,no,N,17,,171999,30360,DGL
18,,SING,OXT,HXT,no,N,18,,171999,30360,DGL
1,,SING,N,CA,no,N,1,,172000,30360,DHI
2,,SING,N,H,no,N,2,,172000,30360,DHI
3,,SING,N,H2,no,N,3,,172000,30360,DHI
4,,SING,CA,C,no,N,4,,172000,30360,DHI
5,,SING,CA,CB,no,N,5,,172000,30360,DHI
6,,SING,CA,HA,no,N,6,,172000,30360,DHI
7,,DOUB,C,O,no,N,7,,172000,30360,DHI
8,,SING,C,OXT,no,N,8,,172000,30360,DHI
9,,SING,CB,CG,no,N,9,,172000,30360,DHI
10,,SING,CB,HB2,no,N,10,,172000,30360,DHI
11,,SING,CB,HB3,no,N,11,,172000,30360,DHI
12,,SING,CG,ND1,yes,N,12,,172000,30360,DHI
13,,DOUB,CG,CD2,yes,N,13,,172000,30360,DHI
14,,DOUB,ND1,CE1,yes,N,14,,172000,30360,DHI
15,,SING,ND1,HD1,no,N,15,,172000,30360,DHI
16,,SING,CD2,NE2,yes,N,16,,172000,30360,DHI
17,,SING,CD2,HD2,no,N,17,,172000,30360,DHI
18,,SING,CE1,NE2,yes,N,18,,172000,30360,DHI
19,,SING,CE1,HE1,no,N,19,,172000,30360,DHI
20,,SING,NE2,HE2,no,N,20,,172000,30360,DHI
21,,SING,OXT,HXT,no,N,21,,172000,30360,DHI
1,,SING,N,CA,no,N,1,,172018,30361,DSN
2,,SING,N,H,no,N,2,,172018,30361,DSN
3,,SING,N,H2,no,N,3,,172018,30361,DSN
4,,SING,CA,C,no,N,4,,172018,30361,DSN
5,,SING,CA,CB,no,N,5,,172018,30361,DSN
6,,SING,CA,HA,no,N,6,,172018,30361,DSN
7,,DOUB,C,O,no,N,7,,172018,30361,DSN
8,,SING,C,OXT,no,N,8,,172018,30361,DSN
9,,SING,OXT,HXT,no,N,9,,172018,30361,DSN
10,,SING,CB,OG,no,N,10,,172018,30361,DSN
11,,SING,CB,HB2,no,N,11,,172018,30361,DSN
12,,SING,CB,HB3,no,N,12,,172018,30361,DSN
13,,SING,OG,HG,no,N,13,,172018,30361,DSN
1,,SING,N,CA,no,N,1,,172019,30361,DTY
2,,SING,N,H,no,N,2,,172019,30361,DTY
3,,SING,N,H2,no,N,3,,172019,30361,DTY
4,,SING,CA,C,no,N,4,,172019,30361,DTY
5,,SING,CA,CB,no,N,5,,172019,30361,DTY
6,,SING,CA,HA,no,N,6,,172019,30361,DTY
7,,DOUB,C,O,no,N,7,,172019,30361,DTY
8,,SING,C,OXT,no,N,8,,172019,30361,DTY
9,,SING,CB,CG,no,N,9,,172019,30361,DTY
10,,SING,CB,HB2,no,N,10,,172019,30361,DTY
11,,SING,CB,HB3,no,N,11,,172019,30361,DTY
12,,DOUB,CG,CD1,yes,N,12,,172019,30361,DTY
13,,SING,CG,CD2,yes,N,13,,172019,30361,DTY
14,,SING,CD1,CE1,yes,N,14,,172019,30361,DTY
15,,SING,CD1,HD1,no,N,15,,172019,30361,DTY
16,,DOUB,CD2,CE2,yes,N,16,,172019,30361,DTY
17,,SING,CD2,HD2,no,N,17,,172019,30361,DTY
18,,DOUB,CE1,CZ,yes,N,18,,172019,30361,DTY
19,,SING,CE1,HE1,no,N,19,,172019,30361,DTY
20,,SING,CE2,CZ,yes,N,20,,172019,30361,DTY
21,,SING,CE2,HE2,no,N,21,,172019,30361,DTY
22,,SING,CZ,OH,no,N,22,,172019,30361,DTY
23,,SING,OH,HH,no,N,23,,172019,30361,DTY
24,,SING,OXT,HXT,no,N,24,,172019,30361,DTY
1,,SING,N,CA,no,N,1,,172020,30361,DAL
2,,SING,N,H,no,N,2,,172020,30361,DAL
3,,SING,N,H2,no,N,3,,172020,30361,DAL
4,,SING,CA,CB,no,N,4,,172020,30361,DAL
5,,SING,CA,C,no,N,5,,172020,30361,DAL
6,,SING,CA,HA,no,N,6,,172020,30361,DAL
7,,SING,CB,HB1,no,N,7,,172020,30361,DAL
8,,SING,CB,HB2,no,N,8,,172020,30361,DAL
9,,SING,CB,HB3,no,N,9,,172020,30361,DAL
10,,DOUB,C,O,no,N,10,,172020,30361,DAL
11,,SING,C,OXT,no,N,11,,172020,30361,DAL
12,,SING,OXT,HXT,no,N,12,,172020,30361,DAL
1,,SING,N,CA,no,N,1,,172021,30361,DCY
2,,SING,N,H,no,N,2,,172021,30361,DCY
3,,SING,N,H2,no,N,3,,172021,30361,DCY
4,,SING,CA,C,no,N,4,,172021,30361,DCY
5,,SING,CA,CB,no,N,5,,172021,30361,DCY
6,,SING,CA,HA,no,N,6,,172021,30361,DCY
7,,DOUB,C,O,no,N,7,,172021,30361,DCY
8,,SING,C,OXT,no,N,8,,172021,30361,DCY
9,,SING,CB,SG,no,N,9,,172021,30361,DCY
10,,SING,CB,HB2,no,N,10,,172021,30361,DCY
11,,SING,CB,HB3,no,N,11,,172021,30361,DCY
12,,SING,SG,HG,no,N,12,,172021,30361,DCY
13,,SING,OXT,HXT,no,N,13,,172021,30361,DCY
1,,SING,N,CA,no,N,1,,172022,30361,DLY
2,,SING,N,H,no,N,2,,172022,30361,DLY
3,,SING,N,H2,no,N,3,,172022,30361,DLY
4,,SING,CA,C,no,N,4,,172022,30361,DLY
5,,SING,CA,CB,no,N,5,,172022,30361,DLY
6,,SING,CA,HA,no,N,6,,172022,30361,DLY
7,,DOUB,C,O,no,N,7,,172022,30361,DLY
8,,SING,C,OXT,no,N,8,,172022,30361,DLY
9,,SING,CB,CG,no,N,9,,172022,30361,DLY
10,,SING,CB,HB2,no,N,10,,172022,30361,DLY
11,,SING,CB,HB3,no,N,11,,172022,30361,DLY
12,,SING,CG,CD,no,N,12,,172022,30361,DLY
13,,SING,CG,HG2,no,N,13,,172022,30361,DLY
14,,SING,CG,HG3,no,N,14,,172022,30361,DLY
15,,SING,CD,CE,no,N,15,,172022,30361,DLY
16,,SING,CD,HD2,no,N,16,,172022,30361,DLY
17,,SING,CD,HD3,no,N,17,,172022,30361,DLY
18,,SING,CE,NZ,no,N,18,,172022,30361,DLY
19,,SING,CE,HE2,no,N,19,,172022,30361,DLY
20,,SING,CE,HE3,no,N,20,,172022,30361,DLY
21,,SING,NZ,HZ1,no,N,21,,172022,30361,DLY
22,,SING,NZ,HZ2,no,N,22,,172022,30361,DLY
23,,SING,OXT,HXT,no,N,23,,172022,30361,DLY
1,,SING,N,CA,no,N,1,,172023,30361,DPR
2,,SING,N,CD,no,N,2,,172023,30361,DPR
3,,SING,N,H,no,N,3,,172023,30361,DPR
4,,SING,CA,CB,no,N,4,,172023,30361,DPR
5,,SING,CA,C,no,N,5,,172023,30361,DPR
6,,SING,CA,HA,no,N,6,,172023,30361,DPR
7,,SING,CB,CG,no,N,7,,172023,30361,DPR
8,,SING,CB,HB2,no,N,8,,172023,30361,DPR
9,,SING,CB,HB3,no,N,9,,172023,30361,DPR
10,,SING,CG,CD,no,N,10,,172023,30361,DPR
11,,SING,CG,HG2,no,N,11,,172023,30361,DPR
12,,SING,CG,HG3,no,N,12,,172023,30361,DPR
13,,SING,CD,HD2,no,N,13,,172023,30361,DPR
14,,SING,CD,HD3,no,N,14,,172023,30361,DPR
15,,DOUB,C,O,no,N,15,,172023,30361,DPR
16,,SING,C,OXT,no,N,16,,172023,30361,DPR
17,,SING,OXT,HXT,no,N,17,,172023,30361,DPR
1,,SING,N,CA,no,N,1,,172041,30362,DGL
2,,SING,N,H,no,N,2,,172041,30362,DGL
3,,SING,N,H2,no,N,3,,172041,30362,DGL
4,,SING,CA,C,no,N,4,,172041,30362,DGL
5,,SING,CA,CB,no,N,5,,172041,30362,DGL
6,,SING,CA,HA,no,N,6,,172041,30362,DGL
7,,DOUB,C,O,no,N,7,,172041,30362,DGL
8,,SING,C,OXT,no,N,8,,172041,30362,DGL
9,,SING,CB,CG,no,N,9,,172041,30362,DGL
10,,SING,CB,HB2,no,N,10,,172041,30362,DGL
11,,SING,CB,HB3,no,N,11,,172041,30362,DGL
12,,SING,CG,CD,no,N,12,,172041,30362,DGL
13,,SING,CG,HG2,no,N,13,,172041,30362,DGL
14,,SING,CG,HG3,no,N,14,,172041,30362,DGL
15,,DOUB,CD,OE1,no,N,15,,172041,30362,DGL
16,,SING,CD,OE2,no,N,16,,172041,30362,DGL
17,,SING,OE2,HE2,no,N,17,,172041,30362,DGL
18,,SING,OXT,HXT,no,N,18,,172041,30362,DGL
1,,SING,N,CA,no,N,1,,172042,30362,DLY
2,,SING,N,H,no,N,2,,172042,30362,DLY
3,,SING,N,H2,no,N,3,,172042,30362,DLY
4,,SING,CA,C,no,N,4,,172042,30362,DLY
5,,SING,CA,CB,no,N,5,,172042,30362,DLY
6,,SING,CA,HA,no,N,6,,172042,30362,DLY
7,,DOUB,C,O,no,N,7,,172042,30362,DLY
8,,SING,C,OXT,no,N,8,,172042,30362,DLY
9,,SING,CB,CG,no,N,9,,172042,30362,DLY
10,,SING,CB,HB2,no,N,10,,172042,30362,DLY
11,,SING,CB,HB3,no,N,11,,172042,30362,DLY
12,,SING,CG,CD,no,N,12,,172042,30362,DLY
13,,SING,CG,HG2,no,N,13,,172042,30362,DLY
14,,SING,CG,HG3,no,N,14,,172042,30362,DLY
15,,SING,CD,CE,no,N,15,,172042,30362,DLY
16,,SING,CD,HD2,no,N,16,,172042,30362,DLY
17,,SING,CD,HD3,no,N,17,,172042,30362,DLY
18,,SING,CE,NZ,no,N,18,,172042,30362,DLY
19,,SING,CE,HE2,no,N,19,,172042,30362,DLY
20,,SING,CE,HE3,no,N,20,,172042,30362,DLY
21,,SING,NZ,HZ1,no,N,21,,172042,30362,DLY
22,,SING,NZ,HZ2,no,N,22,,172042,30362,DLY
23,,SING,OXT,HXT,no,N,23,,172042,30362,DLY
1,,SING,N,CA,no,N,1,,172043,30362,DPR
2,,SING,N,CD,no,N,2,,172043,30362,DPR
3,,SING,N,H,no,N,3,,172043,30362,DPR
4,,SING,CA,CB,no,N,4,,172043,30362,DPR
5,,SING,CA,C,no,N,5,,172043,30362,DPR
6,,SING,CA,HA,no,N,6,,172043,30362,DPR
7,,SING,CB,CG,no,N,7,,172043,30362,DPR
8,,SING,CB,HB2,no,N,8,,172043,30362,DPR
9,,SING,CB,HB3,no,N,9,,172043,30362,DPR
10,,SING,CG,CD,no,N,10,,172043,30362,DPR
11,,SING,CG,HG2,no,N,11,,172043,30362,DPR
12,,SING,CG,HG3,no,N,12,,172043,30362,DPR
13,,SING,CD,HD2,no,N,13,,172043,30362,DPR
14,,SING,CD,HD3,no,N,14,,172043,30362,DPR
15,,DOUB,C,O,no,N,15,,172043,30362,DPR
16,,SING,C,OXT,no,N,16,,172043,30362,DPR
17,,SING,OXT,HXT,no,N,17,,172043,30362,DPR
1,,SING,N,CA,no,N,1,,172044,30362,DVA
2,,SING,N,H,no,N,2,,172044,30362,DVA
3,,SING,N,H2,no,N,3,,172044,30362,DVA
4,,SING,CA,CB,no,N,4,,172044,30362,DVA
5,,SING,CA,C,no,N,5,,172044,30362,DVA
6,,SING,CA,HA,no,N,6,,172044,30362,DVA
7,,SING,CB,CG1,no,N,7,,172044,30362,DVA
8,,SING,CB,CG2,no,N,8,,172044,30362,DVA
9,,SING,CB,HB,no,N,9,,172044,30362,DVA
10,,SING,CG1,HG11,no,N,10,,172044,30362,DVA
11,,SING,CG1,HG12,no,N,11,,172044,30362,DVA
12,,SING,CG1,HG13,no,N,12,,172044,30362,DVA
13,,SING,CG2,HG21,no,N,13,,172044,30362,DVA
14,,SING,CG2,HG22,no,N,14,,172044,30362,DVA
15,,SING,CG2,HG23,no,N,15,,172044,30362,DVA
16,,DOUB,C,O,no,N,16,,172044,30362,DVA
17,,SING,C,OXT,no,N,17,,172044,30362,DVA
18,,SING,OXT,HXT,no,N,18,,172044,30362,DVA
1,,SING,N,CA,no,N,1,,172062,30363,DSG
2,,SING,N,H,no,N,2,,172062,30363,DSG
3,,SING,N,H2,no,N,3,,172062,30363,DSG
4,,SING,CA,C,no,N,4,,172062,30363,DSG
5,,SING,CA,CB,no,N,5,,172062,30363,DSG
6,,SING,CA,HA,no,N,6,,172062,30363,DSG
7,,DOUB,C,O,no,N,7,,172062,30363,DSG
8,,SING,C,OXT,no,N,8,,172062,30363,DSG
9,,SING,CB,CG,no,N,9,,172062,30363,DSG
10,,SING,CB,HB2,no,N,10,,172062,30363,DSG
11,,SING,CB,HB3,no,N,11,,172062,30363,DSG
12,,DOUB,CG,OD1,no,N,12,,172062,30363,DSG
13,,SING,CG,ND2,no,N,13,,172062,30363,DSG
14,,SING,ND2,HD21,no,N,14,,172062,30363,DSG
15,,SING,ND2,HD22,no,N,15,,172062,30363,DSG
16,,SING,OXT,HXT,no,N,16,,172062,30363,DSG
1,,SING,N,CA,no,N,1,,172063,30363,DCY
2,,SING,N,H,no,N,2,,172063,30363,DCY
3,,SING,N,H2,no,N,3,,172063,30363,DCY
4,,SING,CA,C,no,N,4,,172063,30363,DCY
5,,SING,CA,CB,no,N,5,,172063,30363,DCY
6,,SING,CA,HA,no,N,6,,172063,30363,DCY
7,,DOUB,C,O,no,N,7,,172063,30363,DCY
8,,SING,C,OXT,no,N,8,,172063,30363,DCY
9,,SING,CB,SG,no,N,9,,172063,30363,DCY
10,,SING,CB,HB2,no,N,10,,172063,30363,DCY
11,,SING,CB,HB3,no,N,11,,172063,30363,DCY
12,,SING,SG,HG,no,N,12,,172063,30363,DCY
13,,SING,OXT,HXT,no,N,13,,172063,30363,DCY
1,,SING,N,CA,no,N,1,,172064,30363,DPR
2,,SING,N,CD,no,N,2,,172064,30363,DPR
3,,SING,N,H,no,N,3,,172064,30363,DPR
4,,SING,CA,CB,no,N,4,,172064,30363,DPR
5,,SING,CA,C,no,N,5,,172064,30363,DPR
6,,SING,CA,HA,no,N,6,,172064,30363,DPR
7,,SING,CB,CG,no,N,7,,172064,30363,DPR
8,,SING,CB,HB2,no,N,8,,172064,30363,DPR
9,,SING,CB,HB3,no,N,9,,172064,30363,DPR
10,,SING,CG,CD,no,N,10,,172064,30363,DPR
11,,SING,CG,HG2,no,N,11,,172064,30363,DPR
12,,SING,CG,HG3,no,N,12,,172064,30363,DPR
13,,SING,CD,HD2,no,N,13,,172064,30363,DPR
14,,SING,CD,HD3,no,N,14,,172064,30363,DPR
15,,DOUB,C,O,no,N,15,,172064,30363,DPR
16,,SING,C,OXT,no,N,16,,172064,30363,DPR
17,,SING,OXT,HXT,no,N,17,,172064,30363,DPR
1,,SING,N,CA,no,N,1,,172065,30363,DVA
2,,SING,N,H,no,N,2,,172065,30363,DVA
3,,SING,N,H2,no,N,3,,172065,30363,DVA
4,,SING,CA,CB,no,N,4,,172065,30363,DVA
5,,SING,CA,C,no,N,5,,172065,30363,DVA
6,,SING,CA,HA,no,N,6,,172065,30363,DVA
7,,SING,CB,CG1,no,N,7,,172065,30363,DVA
8,,SING,CB,CG2,no,N,8,,172065,30363,DVA
9,,SING,CB,HB,no,N,9,,172065,30363,DVA
10,,SING,CG1,HG11,no,N,10,,172065,30363,DVA
11,,SING,CG1,HG12,no,N,11,,172065,30363,DVA
12,,SING,CG1,HG13,no,N,12,,172065,30363,DVA
13,,SING,CG2,HG21,no,N,13,,172065,30363,DVA
14,,SING,CG2,HG22,no,N,14,,172065,30363,DVA
15,,SING,CG2,HG23,no,N,15,,172065,30363,DVA
16,,DOUB,C,O,no,N,16,,172065,30363,DVA
17,,SING,C,OXT,no,N,17,,172065,30363,DVA
18,,SING,OXT,HXT,no,N,18,,172065,30363,DVA
1,,SING,N,CA,no,N,1,,172083,30364,DHI
2,,SING,N,H,no,N,2,,172083,30364,DHI
3,,SING,N,H2,no,N,3,,172083,30364,DHI
4,,SING,CA,C,no,N,4,,172083,30364,DHI
5,,SING,CA,CB,no,N,5,,172083,30364,DHI
6,,SING,CA,HA,no,N,6,,172083,30364,DHI
7,,DOUB,C,O,no,N,7,,172083,30364,DHI
8,,SING,C,OXT,no,N,8,,172083,30364,DHI
9,,SING,CB,CG,no,N,9,,172083,30364,DHI
10,,SING,CB,HB2,no,N,10,,172083,30364,DHI
11,,SING,CB,HB3,no,N,11,,172083,30364,DHI
12,,SING,CG,ND1,yes,N,12,,172083,30364,DHI
13,,DOUB,CG,CD2,yes,N,13,,172083,30364,DHI
14,,DOUB,ND1,CE1,yes,N,14,,172083,30364,DHI
15,,SING,ND1,HD1,no,N,15,,172083,30364,DHI
16,,SING,CD2,NE2,yes,N,16,,172083,30364,DHI
17,,SING,CD2,HD2,no,N,17,,172083,30364,DHI
18,,SING,CE1,NE2,yes,N,18,,172083,30364,DHI
19,,SING,CE1,HE1,no,N,19,,172083,30364,DHI
20,,SING,NE2,HE2,no,N,20,,172083,30364,DHI
21,,SING,OXT,HXT,no,N,21,,172083,30364,DHI
1,,SING,N,CA,no,N,1,,172084,30364,DAS
2,,SING,N,H,no,N,2,,172084,30364,DAS
3,,SING,N,H2,no,N,3,,172084,30364,DAS
4,,SING,CA,C,no,N,4,,172084,30364,DAS
5,,SING,CA,CB,no,N,5,,172084,30364,DAS
6,,SING,CA,HA,no,N,6,,172084,30364,DAS
7,,DOUB,C,O,no,N,7,,172084,30364,DAS
8,,SING,C,OXT,no,N,8,,172084,30364,DAS
9,,SING,CB,CG,no,N,9,,172084,30364,DAS
10,,SING,CB,HB2,no,N,10,,172084,30364,DAS
11,,SING,CB,HB3,no,N,11,,172084,30364,DAS
12,,DOUB,CG,OD1,no,N,12,,172084,30364,DAS
13,,SING,CG,OD2,no,N,13,,172084,30364,DAS
14,,SING,OD2,HD2,no,N,14,,172084,30364,DAS
15,,SING,OXT,HXT,no,N,15,,172084,30364,DAS
1,,SING,N,CA,no,N,1,,172085,30364,DSN
2,,SING,N,H,no,N,2,,172085,30364,DSN
3,,SING,N,H2,no,N,3,,172085,30364,DSN
4,,SING,CA,C,no,N,4,,172085,30364,DSN
5,,SING,CA,CB,no,N,5,,172085,30364,DSN
6,,SING,CA,HA,no,N,6,,172085,30364,DSN
7,,DOUB,C,O,no,N,7,,172085,30364,DSN
8,,SING,C,OXT,no,N,8,,172085,30364,DSN
9,,SING,OXT,HXT,no,N,9,,172085,30364,DSN
10,,SING,CB,OG,no,N,10,,172085,30364,DSN
11,,SING,CB,HB2,no,N,11,,172085,30364,DSN
12,,SING,CB,HB3,no,N,12,,172085,30364,DSN
13,,SING,OG,HG,no,N,13,,172085,30364,DSN
1,,SING,N,CA,no,N,1,,172086,30364,DGL
2,,SING,N,H,no,N,2,,172086,30364,DGL
3,,SING,N,H2,no,N,3,,172086,30364,DGL
4,,SING,CA,C,no,N,4,,172086,30364,DGL
5,,SING,CA,CB,no,N,5,,172086,30364,DGL
6,,SING,CA,HA,no,N,6,,172086,30364,DGL
7,,DOUB,C,O,no,N,7,,172086,30364,DGL
8,,SING,C,OXT,no,N,8,,172086,30364,DGL
9,,SING,CB,CG,no,N,9,,172086,30364,DGL
10,,SING,CB,HB2,no,N,10,,172086,30364,DGL
11,,SING,CB,HB3,no,N,11,,172086,30364,DGL
12,,SING,CG,CD,no,N,12,,172086,30364,DGL
13,,SING,CG,HG2,no,N,13,,172086,30364,DGL
14,,SING,CG,HG3,no,N,14,,172086,30364,DGL
15,,DOUB,CD,OE1,no,N,15,,172086,30364,DGL
16,,SING,CD,OE2,no,N,16,,172086,30364,DGL
17,,SING,OE2,HE2,no,N,17,,172086,30364,DGL
18,,SING,OXT,HXT,no,N,18,,172086,30364,DGL
1,,SING,N,CA,no,N,1,,172087,30364,DGN
2,,SING,N,H,no,N,2,,172087,30364,DGN
3,,SING,N,H2,no,N,3,,172087,30364,DGN
4,,SING,CA,C,no,N,4,,172087,30364,DGN
5,,SING,CA,CB,no,N,5,,172087,30364,DGN
6,,SING,CA,HA,no,N,6,,172087,30364,DGN
7,,DOUB,C,O,no,N,7,,172087,30364,DGN
8,,SING,C,OXT,no,N,8,,172087,30364,DGN
9,,SING,OXT,HXT,no,N,9,,172087,30364,DGN
10,,SING,CB,CG,no,N,10,,172087,30364,DGN
11,,SING,CB,HB2,no,N,11,,172087,30364,DGN
12,,SING,CB,HB3,no,N,12,,172087,30364,DGN
13,,SING,CG,CD,no,N,13,,172087,30364,DGN
14,,SING,CG,HG2,no,N,14,,172087,30364,DGN
15,,SING,CG,HG3,no,N,15,,172087,30364,DGN
16,,DOUB,CD,OE1,no,N,16,,172087,30364,DGN
17,,SING,CD,NE2,no,N,17,,172087,30364,DGN
18,,SING,NE2,HE21,no,N,18,,172087,30364,DGN
19,,SING,NE2,HE22,no,N,19,,172087,30364,DGN
1,,SING,N,CA,no,N,1,,172105,30365,DPR
2,,SING,N,CD,no,N,2,,172105,30365,DPR
3,,SING,N,H,no,N,3,,172105,30365,DPR
4,,SING,CA,CB,no,N,4,,172105,30365,DPR
5,,SING,CA,C,no,N,5,,172105,30365,DPR
6,,SING,CA,HA,no,N,6,,172105,30365,DPR
7,,SING,CB,CG,no,N,7,,172105,30365,DPR
8,,SING,CB,HB2,no,N,8,,172105,30365,DPR
9,,SING,CB,HB3,no,N,9,,172105,30365,DPR
10,,SING,CG,CD,no,N,10,,172105,30365,DPR
11,,SING,CG,HG2,no,N,11,,172105,30365,DPR
12,,SING,CG,HG3,no,N,12,,172105,30365,DPR
13,,SING,CD,HD2,no,N,13,,172105,30365,DPR
14,,SING,CD,HD3,no,N,14,,172105,30365,DPR
15,,DOUB,C,O,no,N,15,,172105,30365,DPR
16,,SING,C,OXT,no,N,16,,172105,30365,DPR
17,,SING,OXT,HXT,no,N,17,,172105,30365,DPR
1,,SING,N,CA,no,N,1,,172106,30365,DTH
2,,SING,N,H,no,N,2,,172106,30365,DTH
3,,SING,N,HN2,no,N,3,,172106,30365,DTH
4,,SING,CA,CB,no,N,4,,172106,30365,DTH
5,,SING,CA,C,no,N,5,,172106,30365,DTH
6,,SING,CA,HA,no,N,6,,172106,30365,DTH
7,,SING,CB,CG2,no,N,7,,172106,30365,DTH
8,,SING,CB,OG1,no,N,8,,172106,30365,DTH
9,,SING,CB,HB,no,N,9,,172106,30365,DTH
10,,SING,CG2,HG21,no,N,10,,172106,30365,DTH
11,,SING,CG2,HG22,no,N,11,,172106,30365,DTH
12,,SING,CG2,HG23,no,N,12,,172106,30365,DTH
13,,SING,OG1,HG1,no,N,13,,172106,30365,DTH
14,,DOUB,C,O,no,N,14,,172106,30365,DTH
15,,SING,C,OXT,no,N,15,,172106,30365,DTH
16,,SING,OXT,HXT,no,N,16,,172106,30365,DTH
1,,SING,N,CA,no,N,1,,172107,30365,DAS
2,,SING,N,H,no,N,2,,172107,30365,DAS
3,,SING,N,H2,no,N,3,,172107,30365,DAS
4,,SING,CA,C,no,N,4,,172107,30365,DAS
5,,SING,CA,CB,no,N,5,,172107,30365,DAS
6,,SING,CA,HA,no,N,6,,172107,30365,DAS
7,,DOUB,C,O,no,N,7,,172107,30365,DAS
8,,SING,C,OXT,no,N,8,,172107,30365,DAS
9,,SING,CB,CG,no,N,9,,172107,30365,DAS
10,,SING,CB,HB2,no,N,10,,172107,30365,DAS
11,,SING,CB,HB3,no,N,11,,172107,30365,DAS
12,,DOUB,CG,OD1,no,N,12,,172107,30365,DAS
13,,SING,CG,OD2,no,N,13,,172107,30365,DAS
14,,SING,OD2,HD2,no,N,14,,172107,30365,DAS
15,,SING,OXT,HXT,no,N,15,,172107,30365,DAS
1,,SING,N,CA,no,N,1,,172124,30366,DPR
2,,SING,N,CD,no,N,2,,172124,30366,DPR
3,,SING,N,H,no,N,3,,172124,30366,DPR
4,,SING,CA,CB,no,N,4,,172124,30366,DPR
5,,SING,CA,C,no,N,5,,172124,30366,DPR
6,,SING,CA,HA,no,N,6,,172124,30366,DPR
7,,SING,CB,CG,no,N,7,,172124,30366,DPR
8,,SING,CB,HB2,no,N,8,,172124,30366,DPR
9,,SING,CB,HB3,no,N,9,,172124,30366,DPR
10,,SING,CG,CD,no,N,10,,172124,30366,DPR
11,,SING,CG,HG2,no,N,11,,172124,30366,DPR
12,,SING,CG,HG3,no,N,12,,172124,30366,DPR
13,,SING,CD,HD2,no,N,13,,172124,30366,DPR
14,,SING,CD,HD3,no,N,14,,172124,30366,DPR
15,,DOUB,C,O,no,N,15,,172124,30366,DPR
16,,SING,C,OXT,no,N,16,,172124,30366,DPR
17,,SING,OXT,HXT,no,N,17,,172124,30366,DPR
1,,SING,N,CA,no,N,1,,172125,30366,DTH
2,,SING,N,H,no,N,2,,172125,30366,DTH
3,,SING,N,HN2,no,N,3,,172125,30366,DTH
4,,SING,CA,CB,no,N,4,,172125,30366,DTH
5,,SING,CA,C,no,N,5,,172125,30366,DTH
6,,SING,CA,HA,no,N,6,,172125,30366,DTH
7,,SING,CB,CG2,no,N,7,,172125,30366,DTH
8,,SING,CB,OG1,no,N,8,,172125,30366,DTH
9,,SING,CB,HB,no,N,9,,172125,30366,DTH
10,,SING,CG2,HG21,no,N,10,,172125,30366,DTH
11,,SING,CG2,HG22,no,N,11,,172125,30366,DTH
12,,SING,CG2,HG23,no,N,12,,172125,30366,DTH
13,,SING,OG1,HG1,no,N,13,,172125,30366,DTH
14,,DOUB,C,O,no,N,14,,172125,30366,DTH
15,,SING,C,OXT,no,N,15,,172125,30366,DTH
16,,SING,OXT,HXT,no,N,16,,172125,30366,DTH
1,,SING,N,CA,no,N,1,,172126,30366,DAS
2,,SING,N,H,no,N,2,,172126,30366,DAS
3,,SING,N,H2,no,N,3,,172126,30366,DAS
4,,SING,CA,C,no,N,4,,172126,30366,DAS
5,,SING,CA,CB,no,N,5,,172126,30366,DAS
6,,SING,CA,HA,no,N,6,,172126,30366,DAS
7,,DOUB,C,O,no,N,7,,172126,30366,DAS
8,,SING,C,OXT,no,N,8,,172126,30366,DAS
9,,SING,CB,CG,no,N,9,,172126,30366,DAS
10,,SING,CB,HB2,no,N,10,,172126,30366,DAS
11,,SING,CB,HB3,no,N,11,,172126,30366,DAS
12,,DOUB,CG,OD1,no,N,12,,172126,30366,DAS
13,,SING,CG,OD2,no,N,13,,172126,30366,DAS
14,,SING,OD2,HD2,no,N,14,,172126,30366,DAS
15,,SING,OXT,HXT,no,N,15,,172126,30366,DAS
1,,SING,N,HN1,no,N,1,,172306,30376,NH2
2,,SING,N,HN2,no,N,2,,172306,30376,NH2
1,,SING,N,HN1,no,N,1,,172325,30377,NH2
2,,SING,N,HN2,no,N,2,,172325,30377,NH2
1,,SING,N,CA,no,N,1,,172384,30380,DPN
2,,SING,N,H,no,N,2,,172384,30380,DPN
3,,SING,N,H2,no,N,3,,172384,30380,DPN
4,,SING,CA,C,no,N,4,,172384,30380,DPN
5,,SING,CA,CB,no,N,5,,172384,30380,DPN
6,,SING,CA,HA,no,N,6,,172384,30380,DPN
7,,DOUB,C,O,no,N,7,,172384,30380,DPN
8,,SING,C,OXT,no,N,8,,172384,30380,DPN
9,,SING,OXT,HXT,no,N,9,,172384,30380,DPN
10,,SING,CB,CG,no,N,10,,172384,30380,DPN
11,,SING,CB,HB2,no,N,11,,172384,30380,DPN
12,,SING,CB,HB3,no,N,12,,172384,30380,DPN
13,,DOUB,CG,CD1,yes,N,13,,172384,30380,DPN
14,,SING,CG,CD2,yes,N,14,,172384,30380,DPN
15,,SING,CD1,CE1,yes,N,15,,172384,30380,DPN
16,,SING,CD1,HD1,no,N,16,,172384,30380,DPN
17,,DOUB,CD2,CE2,yes,N,17,,172384,30380,DPN
18,,SING,CD2,HD2,no,N,18,,172384,30380,DPN
19,,DOUB,CE1,CZ,yes,N,19,,172384,30380,DPN
20,,SING,CE1,HE1,no,N,20,,172384,30380,DPN
21,,SING,CE2,CZ,yes,N,21,,172384,30380,DPN
22,,SING,CE2,HE2,no,N,22,,172384,30380,DPN
23,,SING,CZ,HZ,no,N,23,,172384,30380,DPN
1,,SING,C,CA,no,N,1,,172403,30381,E9M
2,,DOUB,C,O,no,N,2,,172403,30381,E9M
3,,SING,CA,N,no,N,3,,172403,30381,E9M
4,,SING,CA,CB,no,N,4,,172403,30381,E9M
5,,SING,N,CN2,no,N,5,,172403,30381,E9M
6,,DOUB,CE3,CZ3,yes,N,6,,172403,30381,E9M
7,,SING,CE3,CD2,yes,N,7,,172403,30381,E9M
8,,SING,CB,CG,no,N,8,,172403,30381,E9M
9,,SING,CZ3,CH2,yes,N,9,,172403,30381,E9M
10,,SING,CD2,CG,yes,N,10,,172403,30381,E9M
11,,DOUB,CD2,CE2,yes,N,11,,172403,30381,E9M
12,,DOUB,CG,CD1,yes,N,12,,172403,30381,E9M
13,,DOUB,CH2,CZ2,yes,N,13,,172403,30381,E9M
14,,SING,CE2,CZ2,yes,N,14,,172403,30381,E9M
15,,SING,CE2,NE1,yes,N,15,,172403,30381,E9M
16,,SING,CD1,NE1,yes,N,16,,172403,30381,E9M
17,,SING,C,OXT,no,N,17,,172403,30381,E9M
18,,SING,N,H,no,N,18,,172403,30381,E9M
19,,SING,CA,HA,no,N,19,,172403,30381,E9M
20,,SING,CD1,HD1,no,N,20,,172403,30381,E9M
21,,SING,CB,HB3,no,N,21,,172403,30381,E9M
22,,SING,CB,HB2,no,N,22,,172403,30381,E9M
23,,SING,CE3,HE3,no,N,23,,172403,30381,E9M
24,,SING,NE1,HE1,no,N,24,,172403,30381,E9M
25,,SING,CZ3,HZ3,no,N,25,,172403,30381,E9M
26,,SING,CZ2,HZ2,no,N,26,,172403,30381,E9M
27,,SING,CH2,HH2,no,N,27,,172403,30381,E9M
28,,SING,CN2,3HN,no,N,28,,172403,30381,E9M
29,,SING,CN2,H1,no,N,29,,172403,30381,E9M
30,,SING,CN2,2HN,no,N,30,,172403,30381,E9M
31,,SING,OXT,HXT,no,N,31,,172403,30381,E9M
1,,SING,N,CA,no,N,1,,172404,30381,MMO
2,,SING,N,CN,no,N,2,,172404,30381,MMO
3,,SING,N,H2,no,N,3,,172404,30381,MMO
4,,SING,CA,C,no,N,4,,172404,30381,MMO
5,,SING,CA,CB,no,N,5,,172404,30381,MMO
6,,SING,CA,HA,no,N,6,,172404,30381,MMO
7,,DOUB,C,O,no,N,7,,172404,30381,MMO
8,,SING,CB,CG,no,N,8,,172404,30381,MMO
9,,SING,CB,HCB1,no,N,9,,172404,30381,MMO
10,,SING,CB,HCB2,no,N,10,,172404,30381,MMO
11,,SING,CG,CD,no,N,11,,172404,30381,MMO
12,,SING,CG,HCG1,no,N,12,,172404,30381,MMO
13,,SING,CG,HCG2,no,N,13,,172404,30381,MMO
14,,SING,CD,NE,no,N,14,,172404,30381,MMO
15,,SING,CD,HCD1,no,N,15,,172404,30381,MMO
16,,SING,CD,HCD2,no,N,16,,172404,30381,MMO
17,,SING,NE,CZ,no,N,17,,172404,30381,MMO
18,,SING,CZ,NH2,no,N,18,,172404,30381,MMO
19,,DOUB,CZ,NH1,no,N,19,,172404,30381,MMO
20,,SING,NH2,HH21,no,N,20,,172404,30381,MMO
21,,SING,NH2,HH22,no,N,21,,172404,30381,MMO
22,,SING,NH1,HH11,no,N,22,,172404,30381,MMO
23,,SING,CN,HC1,no,N,23,,172404,30381,MMO
24,,SING,CN,HC2,no,N,24,,172404,30381,MMO
25,,SING,CN,HC3,no,N,25,,172404,30381,MMO
26,,SING,C,OXT,no,N,26,,172404,30381,MMO
27,,SING,OXT,HXT,no,N,27,,172404,30381,MMO
28,,SING,NE,HE,no,N,28,,172404,30381,MMO
1,,SING,N,CA,no,N,1,,172405,30381,DPN
2,,SING,N,H,no,N,2,,172405,30381,DPN
3,,SING,N,H2,no,N,3,,172405,30381,DPN
4,,SING,CA,C,no,N,4,,172405,30381,DPN
5,,SING,CA,CB,no,N,5,,172405,30381,DPN
6,,SING,CA,HA,no,N,6,,172405,30381,DPN
7,,DOUB,C,O,no,N,7,,172405,30381,DPN
8,,SING,C,OXT,no,N,8,,172405,30381,DPN
9,,SING,OXT,HXT,no,N,9,,172405,30381,DPN
10,,SING,CB,CG,no,N,10,,172405,30381,DPN
11,,SING,CB,HB2,no,N,11,,172405,30381,DPN
12,,SING,CB,HB3,no,N,12,,172405,30381,DPN
13,,DOUB,CG,CD1,yes,N,13,,172405,30381,DPN
14,,SING,CG,CD2,yes,N,14,,172405,30381,DPN
15,,SING,CD1,CE1,yes,N,15,,172405,30381,DPN
16,,SING,CD1,HD1,no,N,16,,172405,30381,DPN
17,,DOUB,CD2,CE2,yes,N,17,,172405,30381,DPN
18,,SING,CD2,HD2,no,N,18,,172405,30381,DPN
19,,DOUB,CE1,CZ,yes,N,19,,172405,30381,DPN
20,,SING,CE1,HE1,no,N,20,,172405,30381,DPN
21,,SING,CE2,CZ,yes,N,21,,172405,30381,DPN
22,,SING,CE2,HE2,no,N,22,,172405,30381,DPN
23,,SING,CZ,HZ,no,N,23,,172405,30381,DPN
1,,SING,N,CA,no,N,1,,172423,30382,MMO
2,,SING,N,CN,no,N,2,,172423,30382,MMO
3,,SING,N,H2,no,N,3,,172423,30382,MMO
4,,SING,CA,C,no,N,4,,172423,30382,MMO
5,,SING,CA,CB,no,N,5,,172423,30382,MMO
6,,SING,CA,HA,no,N,6,,172423,30382,MMO
7,,DOUB,C,O,no,N,7,,172423,30382,MMO
8,,SING,CB,CG,no,N,8,,172423,30382,MMO
9,,SING,CB,HCB1,no,N,9,,172423,30382,MMO
10,,SING,CB,HCB2,no,N,10,,172423,30382,MMO
11,,SING,CG,CD,no,N,11,,172423,30382,MMO
12,,SING,CG,HCG1,no,N,12,,172423,30382,MMO
13,,SING,CG,HCG2,no,N,13,,172423,30382,MMO
14,,SING,CD,NE,no,N,14,,172423,30382,MMO
15,,SING,CD,HCD1,no,N,15,,172423,30382,MMO
16,,SING,CD,HCD2,no,N,16,,172423,30382,MMO
17,,SING,NE,CZ,no,N,17,,172423,30382,MMO
18,,SING,CZ,NH2,no,N,18,,172423,30382,MMO
19,,DOUB,CZ,NH1,no,N,19,,172423,30382,MMO
20,,SING,NH2,HH21,no,N,20,,172423,30382,MMO
21,,SING,NH2,HH22,no,N,21,,172423,30382,MMO
22,,SING,NH1,HH11,no,N,22,,172423,30382,MMO
23,,SING,CN,HC1,no,N,23,,172423,30382,MMO
24,,SING,CN,HC2,no,N,24,,172423,30382,MMO
25,,SING,CN,HC3,no,N,25,,172423,30382,MMO
26,,SING,C,OXT,no,N,26,,172423,30382,MMO
27,,SING,OXT,HXT,no,N,27,,172423,30382,MMO
28,,SING,NE,HE,no,N,28,,172423,30382,MMO
1,,SING,N,CA,no,N,1,,172424,30382,DPN
2,,SING,N,H,no,N,2,,172424,30382,DPN
3,,SING,N,H2,no,N,3,,172424,30382,DPN
4,,SING,CA,C,no,N,4,,172424,30382,DPN
5,,SING,CA,CB,no,N,5,,172424,30382,DPN
6,,SING,CA,HA,no,N,6,,172424,30382,DPN
7,,DOUB,C,O,no,N,7,,172424,30382,DPN
8,,SING,C,OXT,no,N,8,,172424,30382,DPN
9,,SING,OXT,HXT,no,N,9,,172424,30382,DPN
10,,SING,CB,CG,no,N,10,,172424,30382,DPN
11,,SING,CB,HB2,no,N,11,,172424,30382,DPN
12,,SING,CB,HB3,no,N,12,,172424,30382,DPN
13,,DOUB,CG,CD1,yes,N,13,,172424,30382,DPN
14,,SING,CG,CD2,yes,N,14,,172424,30382,DPN
15,,SING,CD1,CE1,yes,N,15,,172424,30382,DPN
16,,SING,CD1,HD1,no,N,16,,172424,30382,DPN
17,,DOUB,CD2,CE2,yes,N,17,,172424,30382,DPN
18,,SING,CD2,HD2,no,N,18,,172424,30382,DPN
19,,DOUB,CE1,CZ,yes,N,19,,172424,30382,DPN
20,,SING,CE1,HE1,no,N,20,,172424,30382,DPN
21,,SING,CE2,CZ,yes,N,21,,172424,30382,DPN
22,,SING,CE2,HE2,no,N,22,,172424,30382,DPN
23,,SING,CZ,HZ,no,N,23,,172424,30382,DPN
1,,SING,CE1,ND1,yes,N,1,,172442,30383,E9V
2,,DOUB,CE1,NE2,yes,N,2,,172442,30383,E9V
3,,SING,ND1,CG,yes,N,3,,172442,30383,E9V
4,,SING,NE2,CD2,yes,N,4,,172442,30383,E9V
5,,SING,CN2,N,no,N,5,,172442,30383,E9V
6,,DOUB,CG,CD2,yes,N,6,,172442,30383,E9V
7,,SING,CG,CB,no,N,7,,172442,30383,E9V
8,,SING,N,CA,no,N,8,,172442,30383,E9V
9,,SING,CB,CA,no,N,9,,172442,30383,E9V
10,,SING,CA,C,no,N,10,,172442,30383,E9V
11,,DOUB,C,O,no,N,11,,172442,30383,E9V
12,,SING,N,H,no,N,12,,172442,30383,E9V
13,,SING,CA,HA,no,N,13,,172442,30383,E9V
14,,SING,CB,HB2,no,N,14,,172442,30383,E9V
15,,SING,CB,HB3,no,N,15,,172442,30383,E9V
16,,SING,ND1,HD1,no,N,16,,172442,30383,E9V
17,,SING,CD2,HD2,no,N,17,,172442,30383,E9V
18,,SING,CE1,HE1,no,N,18,,172442,30383,E9V
19,,SING,CN2,3HN,no,N,19,,172442,30383,E9V
20,,SING,CN2,H1,no,N,20,,172442,30383,E9V
21,,SING,CN2,2HN,no,N,21,,172442,30383,E9V
22,,SING,C,OXT,no,N,22,,172442,30383,E9V
23,,SING,OXT,HXT,no,N,23,,172442,30383,E9V
1,,SING,N,CA,no,N,1,,172443,30383,MMO
2,,SING,N,CN,no,N,2,,172443,30383,MMO
3,,SING,N,H2,no,N,3,,172443,30383,MMO
4,,SING,CA,C,no,N,4,,172443,30383,MMO
5,,SING,CA,CB,no,N,5,,172443,30383,MMO
6,,SING,CA,HA,no,N,6,,172443,30383,MMO
7,,DOUB,C,O,no,N,7,,172443,30383,MMO
8,,SING,CB,CG,no,N,8,,172443,30383,MMO
9,,SING,CB,HCB1,no,N,9,,172443,30383,MMO
10,,SING,CB,HCB2,no,N,10,,172443,30383,MMO
11,,SING,CG,CD,no,N,11,,172443,30383,MMO
12,,SING,CG,HCG1,no,N,12,,172443,30383,MMO
13,,SING,CG,HCG2,no,N,13,,172443,30383,MMO
14,,SING,CD,NE,no,N,14,,172443,30383,MMO
15,,SING,CD,HCD1,no,N,15,,172443,30383,MMO
16,,SING,CD,HCD2,no,N,16,,172443,30383,MMO
17,,SING,NE,CZ,no,N,17,,172443,30383,MMO
18,,SING,CZ,NH2,no,N,18,,172443,30383,MMO
19,,DOUB,CZ,NH1,no,N,19,,172443,30383,MMO
20,,SING,NH2,HH21,no,N,20,,172443,30383,MMO
21,,SING,NH2,HH22,no,N,21,,172443,30383,MMO
22,,SING,NH1,HH11,no,N,22,,172443,30383,MMO
23,,SING,CN,HC1,no,N,23,,172443,30383,MMO
24,,SING,CN,HC2,no,N,24,,172443,30383,MMO
25,,SING,CN,HC3,no,N,25,,172443,30383,MMO
26,,SING,C,OXT,no,N,26,,172443,30383,MMO
27,,SING,OXT,HXT,no,N,27,,172443,30383,MMO
28,,SING,NE,HE,no,N,28,,172443,30383,MMO
1,,SING,N,CA,no,N,1,,172444,30383,DPN
2,,SING,N,H,no,N,2,,172444,30383,DPN
3,,SING,N,H2,no,N,3,,172444,30383,DPN
4,,SING,CA,C,no,N,4,,172444,30383,DPN
5,,SING,CA,CB,no,N,5,,172444,30383,DPN
6,,SING,CA,HA,no,N,6,,172444,30383,DPN
7,,DOUB,C,O,no,N,7,,172444,30383,DPN
8,,SING,C,OXT,no,N,8,,172444,30383,DPN
9,,SING,OXT,HXT,no,N,9,,172444,30383,DPN
10,,SING,CB,CG,no,N,10,,172444,30383,DPN
11,,SING,CB,HB2,no,N,11,,172444,30383,DPN
12,,SING,CB,HB3,no,N,12,,172444,30383,DPN
13,,DOUB,CG,CD1,yes,N,13,,172444,30383,DPN
14,,SING,CG,CD2,yes,N,14,,172444,30383,DPN
15,,SING,CD1,CE1,yes,N,15,,172444,30383,DPN
16,,SING,CD1,HD1,no,N,16,,172444,30383,DPN
17,,DOUB,CD2,CE2,yes,N,17,,172444,30383,DPN
18,,SING,CD2,HD2,no,N,18,,172444,30383,DPN
19,,DOUB,CE1,CZ,yes,N,19,,172444,30383,DPN
20,,SING,CE1,HE1,no,N,20,,172444,30383,DPN
21,,SING,CE2,CZ,yes,N,21,,172444,30383,DPN
22,,SING,CE2,HE2,no,N,22,,172444,30383,DPN
23,,SING,CZ,HZ,no,N,23,,172444,30383,DPN
1,,SING,N,HN1,no,N,1,,172624,30396,NH2
2,,SING,N,HN2,no,N,2,,172624,30396,NH2
1,,SING,C1,C2,no,N,1,,172711,30400,PCW
2,,SING,C1,O3P,no,N,2,,172711,30400,PCW
3,,SING,C1,H11,no,N,3,,172711,30400,PCW
4,,SING,C1,H12,no,N,4,,172711,30400,PCW
5,,SING,C2,C3,no,N,5,,172711,30400,PCW
6,,SING,C2,O2,no,N,6,,172711,30400,PCW
7,,SING,C2,H2,no,N,7,,172711,30400,PCW
8,,SING,C3,O3,no,N,8,,172711,30400,PCW
9,,SING,C3,H31,no,N,9,,172711,30400,PCW
10,,SING,C3,H32,no,N,10,,172711,30400,PCW
11,,SING,C4,C5,no,N,11,,172711,30400,PCW
12,,SING,C4,O4P,no,N,12,,172711,30400,PCW
13,,SING,C4,H41,no,N,13,,172711,30400,PCW
14,,SING,C4,H42,no,N,14,,172711,30400,PCW
15,,SING,C5,N,no,N,15,,172711,30400,PCW
16,,SING,C5,H51,no,N,16,,172711,30400,PCW
17,,SING,C5,H52,no,N,17,,172711,30400,PCW
18,,SING,C6,N,no,N,18,,172711,30400,PCW
19,,SING,C6,H61,no,N,19,,172711,30400,PCW
20,,SING,C6,H62,no,N,20,,172711,30400,PCW
21,,SING,C6,H63,no,N,21,,172711,30400,PCW
22,,SING,C7,N,no,N,22,,172711,30400,PCW
23,,SING,C7,H71,no,N,23,,172711,30400,PCW
24,,SING,C7,H72,no,N,24,,172711,30400,PCW
25,,SING,C7,H73,no,N,25,,172711,30400,PCW
26,,SING,C8,N,no,N,26,,172711,30400,PCW
27,,SING,C8,H81,no,N,27,,172711,30400,PCW
28,,SING,C8,H82,no,N,28,,172711,30400,PCW
29,,SING,C8,H83,no,N,29,,172711,30400,PCW
30,,SING,C11,C12,no,N,30,,172711,30400,PCW
31,,SING,C11,O3,no,N,31,,172711,30400,PCW
32,,DOUB,C11,O11,no,N,32,,172711,30400,PCW
33,,SING,C12,C13,no,N,33,,172711,30400,PCW
34,,SING,C12,H121,no,N,34,,172711,30400,PCW
35,,SING,C12,H122,no,N,35,,172711,30400,PCW
36,,SING,C13,C14,no,N,36,,172711,30400,PCW
37,,SING,C13,H131,no,N,37,,172711,30400,PCW
38,,SING,C13,H132,no,N,38,,172711,30400,PCW
39,,SING,C14,C15,no,N,39,,172711,30400,PCW
40,,SING,C14,H141,no,N,40,,172711,30400,PCW
41,,SING,C14,H142,no,N,41,,172711,30400,PCW
42,,SING,C15,C16,no,N,42,,172711,30400,PCW
43,,SING,C15,H151,no,N,43,,172711,30400,PCW
44,,SING,C15,H152,no,N,44,,172711,30400,PCW
45,,SING,C16,C17,no,N,45,,172711,30400,PCW
46,,SING,C16,H161,no,N,46,,172711,30400,PCW
47,,SING,C16,H162,no,N,47,,172711,30400,PCW
48,,SING,C17,C18,no,N,48,,172711,30400,PCW
49,,SING,C17,H171,no,N,49,,172711,30400,PCW
50,,SING,C17,H172,no,N,50,,172711,30400,PCW
51,,SING,C18,C19,no,N,51,,172711,30400,PCW
52,,SING,C18,H181,no,N,52,,172711,30400,PCW
53,,SING,C18,H182,no,N,53,,172711,30400,PCW
54,,DOUB,C19,C20,no,Z,54,,172711,30400,PCW
55,,SING,C19,H19,no,N,55,,172711,30400,PCW
56,,SING,C20,C21,no,N,56,,172711,30400,PCW
57,,SING,C20,H20,no,N,57,,172711,30400,PCW
58,,SING,C21,C22,no,N,58,,172711,30400,PCW
59,,SING,C21,H211,no,N,59,,172711,30400,PCW
60,,SING,C21,H212,no,N,60,,172711,30400,PCW
61,,SING,C22,C23,no,N,61,,172711,30400,PCW
62,,SING,C22,H221,no,N,62,,172711,30400,PCW
63,,SING,C22,H222,no,N,63,,172711,30400,PCW
64,,SING,C23,C24,no,N,64,,172711,30400,PCW
65,,SING,C23,H231,no,N,65,,172711,30400,PCW
66,,SING,C23,H232,no,N,66,,172711,30400,PCW
67,,SING,C24,C25,no,N,67,,172711,30400,PCW
68,,SING,C24,H241,no,N,68,,172711,30400,PCW
69,,SING,C24,H242,no,N,69,,172711,30400,PCW
70,,SING,C25,C26,no,N,70,,172711,30400,PCW
71,,SING,C25,H251,no,N,71,,172711,30400,PCW
72,,SING,C25,H252,no,N,72,,172711,30400,PCW
73,,SING,C26,C27,no,N,73,,172711,30400,PCW
74,,SING,C26,H261,no,N,74,,172711,30400,PCW
75,,SING,C26,H262,no,N,75,,172711,30400,PCW
76,,SING,C27,C28,no,N,76,,172711,30400,PCW
77,,SING,C27,H271,no,N,77,,172711,30400,PCW
78,,SING,C27,H272,no,N,78,,172711,30400,PCW
79,,SING,C28,H281,no,N,79,,172711,30400,PCW
80,,SING,C28,H282,no,N,80,,172711,30400,PCW
81,,SING,C28,H283,no,N,81,,172711,30400,PCW
82,,SING,C31,C32,no,N,82,,172711,30400,PCW
83,,SING,C31,O2,no,N,83,,172711,30400,PCW
84,,DOUB,C31,O31,no,N,84,,172711,30400,PCW
85,,SING,C32,C33,no,N,85,,172711,30400,PCW
86,,SING,C32,H321,no,N,86,,172711,30400,PCW
87,,SING,C32,H322,no,N,87,,172711,30400,PCW
88,,SING,C33,C34,no,N,88,,172711,30400,PCW
89,,SING,C33,H331,no,N,89,,172711,30400,PCW
90,,SING,C33,H332,no,N,90,,172711,30400,PCW
91,,SING,C34,C35,no,N,91,,172711,30400,PCW
92,,SING,C34,H341,no,N,92,,172711,30400,PCW
93,,SING,C34,H342,no,N,93,,172711,30400,PCW
94,,SING,C35,C36,no,N,94,,172711,30400,PCW
95,,SING,C35,H351,no,N,95,,172711,30400,PCW
96,,SING,C35,H352,no,N,96,,172711,30400,PCW
97,,SING,C36,C37,no,N,97,,172711,30400,PCW
98,,SING,C36,H361,no,N,98,,172711,30400,PCW
99,,SING,C36,H362,no,N,99,,172711,30400,PCW
100,,SING,C37,C38,no,N,100,,172711,30400,PCW
101,,SING,C37,H371,no,N,101,,172711,30400,PCW
102,,SING,C37,H372,no,N,102,,172711,30400,PCW
103,,SING,C38,C39,no,N,103,,172711,30400,PCW
104,,SING,C38,H381,no,N,104,,172711,30400,PCW
105,,SING,C38,H382,no,N,105,,172711,30400,PCW
106,,DOUB,C39,C40,no,Z,106,,172711,30400,PCW
107,,SING,C39,H39,no,N,107,,172711,30400,PCW
108,,SING,C40,C41,no,N,108,,172711,30400,PCW
109,,SING,C40,H40,no,N,109,,172711,30400,PCW
110,,SING,C41,C42,no,N,110,,172711,30400,PCW
111,,SING,C41,H411,no,N,111,,172711,30400,PCW
112,,SING,C41,H412,no,N,112,,172711,30400,PCW
113,,SING,C42,C43,no,N,113,,172711,30400,PCW
114,,SING,C42,H421,no,N,114,,172711,30400,PCW
115,,SING,C42,H422,no,N,115,,172711,30400,PCW
116,,SING,C43,C44,no,N,116,,172711,30400,PCW
117,,SING,C43,H431,no,N,117,,172711,30400,PCW
118,,SING,C43,H432,no,N,118,,172711,30400,PCW
119,,SING,C44,C45,no,N,119,,172711,30400,PCW
120,,SING,C44,H441,no,N,120,,172711,30400,PCW
121,,SING,C44,H442,no,N,121,,172711,30400,PCW
122,,SING,C45,C46,no,N,122,,172711,30400,PCW
123,,SING,C45,H451,no,N,123,,172711,30400,PCW
124,,SING,C45,H452,no,N,124,,172711,30400,PCW
125,,SING,C46,C47,no,N,125,,172711,30400,PCW
126,,SING,C46,H461,no,N,126,,172711,30400,PCW
127,,SING,C46,H462,no,N,127,,172711,30400,PCW
128,,SING,C47,C48,no,N,128,,172711,30400,PCW
129,,SING,C47,H471,no,N,129,,172711,30400,PCW
130,,SING,C47,H472,no,N,130,,172711,30400,PCW
131,,SING,C48,H481,no,N,131,,172711,30400,PCW
132,,SING,C48,H482,no,N,132,,172711,30400,PCW
133,,SING,C48,H483,no,N,133,,172711,30400,PCW
134,,SING,O1P,P,no,N,134,,172711,30400,PCW
135,,SING,O1P,H1P,no,N,135,,172711,30400,PCW
136,,DOUB,O2P,P,no,N,136,,172711,30400,PCW
137,,SING,O3P,P,no,N,137,,172711,30400,PCW
138,,SING,O4P,P,no,N,138,,172711,30400,PCW
1,,SING,C1,O3,no,N,1,,172712,30400,17F
2,,SING,N1,C2,no,N,2,,172712,30400,17F
3,,DOUB,O1,P1,no,N,3,,172712,30400,17F
4,,SING,P1,O6,no,N,4,,172712,30400,17F
5,,SING,C2,C1,no,N,5,,172712,30400,17F
6,,SING,O2,P1,no,N,6,,172712,30400,17F
7,,SING,C3,C2,no,N,7,,172712,30400,17F
8,,SING,C3,O5,no,N,8,,172712,30400,17F
9,,SING,O3,P1,no,N,9,,172712,30400,17F
10,,SING,C4,C5,no,N,10,,172712,30400,17F
11,,DOUB,O4,C3,no,N,11,,172712,30400,17F
12,,SING,C5,C6,no,N,12,,172712,30400,17F
13,,SING,C5,O9,no,N,13,,172712,30400,17F
14,,SING,C6,O7,no,N,14,,172712,30400,17F
15,,SING,O6,C4,no,N,15,,172712,30400,17F
16,,SING,C7,C8,no,N,16,,172712,30400,17F
17,,SING,O7,C7,no,N,17,,172712,30400,17F
18,,SING,C8,C9,no,N,18,,172712,30400,17F
19,,DOUB,O8,C7,no,N,19,,172712,30400,17F
20,,SING,C9,C10,no,N,20,,172712,30400,17F
21,,SING,O9,C17,no,N,21,,172712,30400,17F
22,,SING,C10,C11,no,N,22,,172712,30400,17F
23,,SING,C11,C12,no,N,23,,172712,30400,17F
24,,SING,C12,C1X,no,N,24,,172712,30400,17F
25,,DOUB,C17,O10,no,N,25,,172712,30400,17F
26,,SING,C17,C18,no,N,26,,172712,30400,17F
27,,SING,C18,C19,no,N,27,,172712,30400,17F
28,,SING,C19,C20,no,N,28,,172712,30400,17F
29,,SING,C20,C1Y,no,N,29,,172712,30400,17F
30,,SING,C1Y,C1Z,no,N,30,,172712,30400,17F
31,,SING,C1X,C2X,no,N,31,,172712,30400,17F
32,,SING,C2X,C21,no,N,32,,172712,30400,17F
33,,DOUB,C21,C22,no,Z,33,,172712,30400,17F
34,,SING,C22,C23,no,N,34,,172712,30400,17F
35,,SING,C23,C24,no,N,35,,172712,30400,17F
36,,SING,C24,C25,no,N,36,,172712,30400,17F
37,,SING,C25,C26,no,N,37,,172712,30400,17F
38,,SING,C26,C27,no,N,38,,172712,30400,17F
39,,SING,C27,C28,no,N,39,,172712,30400,17F
40,,SING,C28,C29,no,N,40,,172712,30400,17F
41,,SING,C29,C30,no,N,41,,172712,30400,17F
42,,SING,C1Z,C31,no,N,42,,172712,30400,17F
43,,SING,C31,C32,no,N,43,,172712,30400,17F
44,,SING,C32,C33,no,N,44,,172712,30400,17F
45,,DOUB,C33,C34,no,Z,45,,172712,30400,17F
46,,SING,C34,C35,no,N,46,,172712,30400,17F
47,,SING,C35,C36,no,N,47,,172712,30400,17F
48,,SING,C36,C37,no,N,48,,172712,30400,17F
49,,SING,C37,C38,no,N,49,,172712,30400,17F
50,,SING,C38,C39,no,N,50,,172712,30400,17F
51,,SING,C39,C40,no,N,51,,172712,30400,17F
52,,SING,C40,C41,no,N,52,,172712,30400,17F
53,,SING,C41,C42,no,N,53,,172712,30400,17F
54,,SING,C1,H1,no,N,54,,172712,30400,17F
55,,SING,C1,H1A,no,N,55,,172712,30400,17F
56,,SING,N1,HN1,no,N,56,,172712,30400,17F
57,,SING,N1,HN1A,no,N,57,,172712,30400,17F
58,,SING,C2,H2,no,N,58,,172712,30400,17F
59,,SING,O2,HO2,no,N,59,,172712,30400,17F
60,,SING,C4,H4,no,N,60,,172712,30400,17F
61,,SING,C4,H4A,no,N,61,,172712,30400,17F
62,,SING,C5,H5,no,N,62,,172712,30400,17F
63,,SING,O5,HO5,no,N,63,,172712,30400,17F
64,,SING,C6,H6,no,N,64,,172712,30400,17F
65,,SING,C6,H6A,no,N,65,,172712,30400,17F
66,,SING,C8,H8,no,N,66,,172712,30400,17F
67,,SING,C8,H8A,no,N,67,,172712,30400,17F
68,,SING,C9,H9,no,N,68,,172712,30400,17F
69,,SING,C9,H9A,no,N,69,,172712,30400,17F
70,,SING,C10,H10,no,N,70,,172712,30400,17F
71,,SING,C10,H10A,no,N,71,,172712,30400,17F
72,,SING,C11,H11,no,N,72,,172712,30400,17F
73,,SING,C11,H11A,no,N,73,,172712,30400,17F
74,,SING,C12,H12,no,N,74,,172712,30400,17F
75,,SING,C12,H12A,no,N,75,,172712,30400,17F
76,,SING,C18,H18,no,N,76,,172712,30400,17F
77,,SING,C18,H18A,no,N,77,,172712,30400,17F
78,,SING,C19,H19,no,N,78,,172712,30400,17F
79,,SING,C19,H19A,no,N,79,,172712,30400,17F
80,,SING,C20,H20,no,N,80,,172712,30400,17F
81,,SING,C20,H20A,no,N,81,,172712,30400,17F
82,,SING,C1X,H29,no,N,82,,172712,30400,17F
83,,SING,C1X,H30,no,N,83,,172712,30400,17F
84,,SING,C1Y,H31,no,N,84,,172712,30400,17F
85,,SING,C1Y,H32,no,N,85,,172712,30400,17F
86,,SING,C1Z,H33,no,N,86,,172712,30400,17F
87,,SING,C1Z,H34,no,N,87,,172712,30400,17F
88,,SING,C2X,H35,no,N,88,,172712,30400,17F
89,,SING,C2X,H36,no,N,89,,172712,30400,17F
90,,SING,C21,H37,no,N,90,,172712,30400,17F
91,,SING,C22,H38,no,N,91,,172712,30400,17F
92,,SING,C23,H39,no,N,92,,172712,30400,17F
93,,SING,C23,H40,no,N,93,,172712,30400,17F
94,,SING,C24,H41,no,N,94,,172712,30400,17F
95,,SING,C24,H42,no,N,95,,172712,30400,17F
96,,SING,C25,H43,no,N,96,,172712,30400,17F
97,,SING,C25,H44,no,N,97,,172712,30400,17F
98,,SING,C26,H45,no,N,98,,172712,30400,17F
99,,SING,C26,H46,no,N,99,,172712,30400,17F
100,,SING,C27,H47,no,N,100,,172712,30400,17F
101,,SING,C27,H48,no,N,101,,172712,30400,17F
102,,SING,C28,H49,no,N,102,,172712,30400,17F
103,,SING,C28,H50,no,N,103,,172712,30400,17F
104,,SING,C29,H51,no,N,104,,172712,30400,17F
105,,SING,C29,H52,no,N,105,,172712,30400,17F
106,,SING,C30,H53,no,N,106,,172712,30400,17F
107,,SING,C30,H54,no,N,107,,172712,30400,17F
108,,SING,C30,H55,no,N,108,,172712,30400,17F
109,,SING,C31,H56,no,N,109,,172712,30400,17F
110,,SING,C31,H57,no,N,110,,172712,30400,17F
111,,SING,C32,H58,no,N,111,,172712,30400,17F
112,,SING,C32,H59,no,N,112,,172712,30400,17F
113,,SING,C33,H60,no,N,113,,172712,30400,17F
114,,SING,C34,H61,no,N,114,,172712,30400,17F
115,,SING,C35,H62,no,N,115,,172712,30400,17F
116,,SING,C35,H63,no,N,116,,172712,30400,17F
117,,SING,C36,H64,no,N,117,,172712,30400,17F
118,,SING,C36,H65,no,N,118,,172712,30400,17F
119,,SING,C37,H66,no,N,119,,172712,30400,17F
120,,SING,C37,H67,no,N,120,,172712,30400,17F
121,,SING,C38,H68,no,N,121,,172712,30400,17F
122,,SING,C38,H69,no,N,122,,172712,30400,17F
123,,SING,C39,H70,no,N,123,,172712,30400,17F
124,,SING,C39,H71,no,N,124,,172712,30400,17F
125,,SING,C40,H72,no,N,125,,172712,30400,17F
126,,SING,C40,H73,no,N,126,,172712,30400,17F
127,,SING,C41,H74,no,N,127,,172712,30400,17F
128,,SING,C41,H75,no,N,128,,172712,30400,17F
129,,SING,C42,H76,no,N,129,,172712,30400,17F
130,,SING,C42,H77,no,N,130,,172712,30400,17F
131,,SING,C42,H78,no,N,131,,172712,30400,17F
1,,DOUB,PG,O1G,no,N,1,,172713,30400,GNP
2,,SING,PG,O2G,no,N,2,,172713,30400,GNP
3,,SING,PG,O3G,no,N,3,,172713,30400,GNP
4,,SING,PG,N3B,no,N,4,,172713,30400,GNP
5,,SING,O2G,HOG2,no,N,5,,172713,30400,GNP
6,,SING,O3G,HOG3,no,N,6,,172713,30400,GNP
7,,SING,N3B,PB,no,N,7,,172713,30400,GNP
8,,SING,N3B,HNB3,no,N,8,,172713,30400,GNP
9,,DOUB,PB,O1B,no,N,9,,172713,30400,GNP
10,,SING,PB,O2B,no,N,10,,172713,30400,GNP
11,,SING,PB,O3A,no,N,11,,172713,30400,GNP
12,,SING,O2B,HOB2,no,N,12,,172713,30400,GNP
13,,SING,O3A,PA,no,N,13,,172713,30400,GNP
14,,DOUB,PA,O1A,no,N,14,,172713,30400,GNP
15,,SING,PA,O2A,no,N,15,,172713,30400,GNP
16,,SING,PA,O5',no,N,16,,172713,30400,GNP
17,,SING,O2A,HOA2,no,N,17,,172713,30400,GNP
18,,SING,O5',C5',no,N,18,,172713,30400,GNP
19,,SING,C5',C4',no,N,19,,172713,30400,GNP
20,,SING,C5',H5'2,no,N,20,,172713,30400,GNP
21,,SING,C5',H5'1,no,N,21,,172713,30400,GNP
22,,SING,C4',O4',no,N,22,,172713,30400,GNP
23,,SING,C4',C3',no,N,23,,172713,30400,GNP
24,,SING,C4',H4',no,N,24,,172713,30400,GNP
25,,SING,O4',C1',no,N,25,,172713,30400,GNP
26,,SING,C3',O3',no,N,26,,172713,30400,GNP
27,,SING,C3',C2',no,N,27,,172713,30400,GNP
28,,SING,C3',H3',no,N,28,,172713,30400,GNP
29,,SING,O3',HO3',no,N,29,,172713,30400,GNP
30,,SING,C2',O2',no,N,30,,172713,30400,GNP
31,,SING,C2',C1',no,N,31,,172713,30400,GNP
32,,SING,C2',H2',no,N,32,,172713,30400,GNP
33,,SING,O2',HO2',no,N,33,,172713,30400,GNP
34,,SING,C1',N9,no,N,34,,172713,30400,GNP
35,,SING,C1',H1',no,N,35,,172713,30400,GNP
36,,SING,N9,C8,yes,N,36,,172713,30400,GNP
37,,SING,N9,C4,yes,N,37,,172713,30400,GNP
38,,DOUB,C8,N7,yes,N,38,,172713,30400,GNP
39,,SING,C8,H8,no,N,39,,172713,30400,GNP
40,,SING,N7,C5,yes,N,40,,172713,30400,GNP
41,,SING,C5,C6,yes,N,41,,172713,30400,GNP
42,,DOUB,C5,C4,yes,N,42,,172713,30400,GNP
43,,DOUB,C6,O6,no,N,43,,172713,30400,GNP
44,,SING,C6,N1,yes,N,44,,172713,30400,GNP
45,,SING,N1,C2,yes,N,45,,172713,30400,GNP
46,,SING,N1,HN1,no,N,46,,172713,30400,GNP
47,,SING,C2,N2,no,N,47,,172713,30400,GNP
48,,DOUB,C2,N3,yes,N,48,,172713,30400,GNP
49,,SING,N2,HN21,no,N,49,,172713,30400,GNP
50,,SING,N2,HN22,no,N,50,,172713,30400,GNP
51,,SING,N3,C4,yes,N,51,,172713,30400,GNP
1,,SING,CLB,CAT,no,N,1,,172715,30400,EWS
2,,DOUB,CAT,CAD,yes,N,2,,172715,30400,EWS
3,,SING,CAT,CAE,yes,N,3,,172715,30400,EWS
4,,SING,CAD,CAF,yes,N,4,,172715,30400,EWS
5,,DOUB,CAE,CAG,yes,N,5,,172715,30400,EWS
6,,DOUB,CAF,CAV,yes,N,6,,172715,30400,EWS
7,,SING,CAG,CAV,yes,N,7,,172715,30400,EWS
8,,SING,CAV,CAN,no,N,8,,172715,30400,EWS
9,,SING,CAN,CBA,no,N,9,,172715,30400,EWS
10,,SING,NAP,CBA,no,N,10,,172715,30400,EWS
11,,SING,NAP,CAL,no,N,11,,172715,30400,EWS
12,,SING,CBA,CAO,no,N,12,,172715,30400,EWS
13,,SING,CAL,CAM,no,N,13,,172715,30400,EWS
14,,SING,CAO,CAZ,no,N,14,,172715,30400,EWS
15,,SING,CAM,CAZ,no,N,15,,172715,30400,EWS
16,,SING,CAZ,NAQ,no,N,16,,172715,30400,EWS
17,,SING,NAQ,CAS,no,N,17,,172715,30400,EWS
18,,SING,BRC,CAU,no,N,18,,172715,30400,EWS
19,,DOUB,CAS,OAA,no,N,19,,172715,30400,EWS
20,,SING,CAS,CAW,no,N,20,,172715,30400,EWS
21,,DOUB,CAK,CAU,yes,N,21,,172715,30400,EWS
22,,SING,CAK,CAY,yes,N,22,,172715,30400,EWS
23,,SING,CAU,CAH,yes,N,23,,172715,30400,EWS
24,,SING,CAW,CAY,yes,N,24,,172715,30400,EWS
25,,DOUB,CAW,CAJ,yes,N,25,,172715,30400,EWS
26,,DOUB,CAY,CAX,yes,N,26,,172715,30400,EWS
27,,DOUB,CAH,CAI,yes,N,27,,172715,30400,EWS
28,,SING,CAJ,NAR,yes,N,28,,172715,30400,EWS
29,,SING,CAX,CAI,yes,N,29,,172715,30400,EWS
30,,SING,CAX,NAR,yes,N,30,,172715,30400,EWS
31,,SING,CAD,HAD,no,N,31,,172715,30400,EWS
32,,SING,CAE,HAE,no,N,32,,172715,30400,EWS
33,,SING,CAF,HAF,no,N,33,,172715,30400,EWS
34,,SING,CAG,HAG,no,N,34,,172715,30400,EWS
35,,SING,CAH,HAH,no,N,35,,172715,30400,EWS
36,,SING,CAI,HAI,no,N,36,,172715,30400,EWS
37,,SING,CAJ,HAJ,no,N,37,,172715,30400,EWS
38,,SING,CAK,HAK,no,N,38,,172715,30400,EWS
39,,SING,CAL,HAL,no,N,39,,172715,30400,EWS
40,,SING,CAL,HAM,no,N,40,,172715,30400,EWS
41,,SING,CAM,HAN,no,N,41,,172715,30400,EWS
42,,SING,CAM,HAO,no,N,42,,172715,30400,EWS
43,,SING,CAN,HAP,no,N,43,,172715,30400,EWS
44,,SING,CAN,HAQ,no,N,44,,172715,30400,EWS
45,,SING,CAO,HAR,no,N,45,,172715,30400,EWS
46,,SING,CAO,HAS,no,N,46,,172715,30400,EWS
47,,SING,CAZ,HAZ,no,N,47,,172715,30400,EWS
48,,SING,NAP,H1,no,N,48,,172715,30400,EWS
49,,SING,NAQ,HBD,no,N,49,,172715,30400,EWS
50,,SING,NAR,HBE,no,N,50,,172715,30400,EWS
51,,SING,CBA,HBA,no,N,51,,172715,30400,EWS
1,,SING,C1,C2,no,N,1,,172737,30401,PCW
2,,SING,C1,O3P,no,N,2,,172737,30401,PCW
3,,SING,C1,H11,no,N,3,,172737,30401,PCW
4,,SING,C1,H12,no,N,4,,172737,30401,PCW
5,,SING,C2,C3,no,N,5,,172737,30401,PCW
6,,SING,C2,O2,no,N,6,,172737,30401,PCW
7,,SING,C2,H2,no,N,7,,172737,30401,PCW
8,,SING,C3,O3,no,N,8,,172737,30401,PCW
9,,SING,C3,H31,no,N,9,,172737,30401,PCW
10,,SING,C3,H32,no,N,10,,172737,30401,PCW
11,,SING,C4,C5,no,N,11,,172737,30401,PCW
12,,SING,C4,O4P,no,N,12,,172737,30401,PCW
13,,SING,C4,H41,no,N,13,,172737,30401,PCW
14,,SING,C4,H42,no,N,14,,172737,30401,PCW
15,,SING,C5,N,no,N,15,,172737,30401,PCW
16,,SING,C5,H51,no,N,16,,172737,30401,PCW
17,,SING,C5,H52,no,N,17,,172737,30401,PCW
18,,SING,C6,N,no,N,18,,172737,30401,PCW
19,,SING,C6,H61,no,N,19,,172737,30401,PCW
20,,SING,C6,H62,no,N,20,,172737,30401,PCW
21,,SING,C6,H63,no,N,21,,172737,30401,PCW
22,,SING,C7,N,no,N,22,,172737,30401,PCW
23,,SING,C7,H71,no,N,23,,172737,30401,PCW
24,,SING,C7,H72,no,N,24,,172737,30401,PCW
25,,SING,C7,H73,no,N,25,,172737,30401,PCW
26,,SING,C8,N,no,N,26,,172737,30401,PCW
27,,SING,C8,H81,no,N,27,,172737,30401,PCW
28,,SING,C8,H82,no,N,28,,172737,30401,PCW
29,,SING,C8,H83,no,N,29,,172737,30401,PCW
30,,SING,C11,C12,no,N,30,,172737,30401,PCW
31,,SING,C11,O3,no,N,31,,172737,30401,PCW
32,,DOUB,C11,O11,no,N,32,,172737,30401,PCW
33,,SING,C12,C13,no,N,33,,172737,30401,PCW
34,,SING,C12,H121,no,N,34,,172737,30401,PCW
35,,SING,C12,H122,no,N,35,,172737,30401,PCW
36,,SING,C13,C14,no,N,36,,172737,30401,PCW
37,,SING,C13,H131,no,N,37,,172737,30401,PCW
38,,SING,C13,H132,no,N,38,,172737,30401,PCW
39,,SING,C14,C15,no,N,39,,172737,30401,PCW
40,,SING,C14,H141,no,N,40,,172737,30401,PCW
41,,SING,C14,H142,no,N,41,,172737,30401,PCW
42,,SING,C15,C16,no,N,42,,172737,30401,PCW
43,,SING,C15,H151,no,N,43,,172737,30401,PCW
44,,SING,C15,H152,no,N,44,,172737,30401,PCW
45,,SING,C16,C17,no,N,45,,172737,30401,PCW
46,,SING,C16,H161,no,N,46,,172737,30401,PCW
47,,SING,C16,H162,no,N,47,,172737,30401,PCW
48,,SING,C17,C18,no,N,48,,172737,30401,PCW
49,,SING,C17,H171,no,N,49,,172737,30401,PCW
50,,SING,C17,H172,no,N,50,,172737,30401,PCW
51,,SING,C18,C19,no,N,51,,172737,30401,PCW
52,,SING,C18,H181,no,N,52,,172737,30401,PCW
53,,SING,C18,H182,no,N,53,,172737,30401,PCW
54,,DOUB,C19,C20,no,Z,54,,172737,30401,PCW
55,,SING,C19,H19,no,N,55,,172737,30401,PCW
56,,SING,C20,C21,no,N,56,,172737,30401,PCW
57,,SING,C20,H20,no,N,57,,172737,30401,PCW
58,,SING,C21,C22,no,N,58,,172737,30401,PCW
59,,SING,C21,H211,no,N,59,,172737,30401,PCW
60,,SING,C21,H212,no,N,60,,172737,30401,PCW
61,,SING,C22,C23,no,N,61,,172737,30401,PCW
62,,SING,C22,H221,no,N,62,,172737,30401,PCW
63,,SING,C22,H222,no,N,63,,172737,30401,PCW
64,,SING,C23,C24,no,N,64,,172737,30401,PCW
65,,SING,C23,H231,no,N,65,,172737,30401,PCW
66,,SING,C23,H232,no,N,66,,172737,30401,PCW
67,,SING,C24,C25,no,N,67,,172737,30401,PCW
68,,SING,C24,H241,no,N,68,,172737,30401,PCW
69,,SING,C24,H242,no,N,69,,172737,30401,PCW
70,,SING,C25,C26,no,N,70,,172737,30401,PCW
71,,SING,C25,H251,no,N,71,,172737,30401,PCW
72,,SING,C25,H252,no,N,72,,172737,30401,PCW
73,,SING,C26,C27,no,N,73,,172737,30401,PCW
74,,SING,C26,H261,no,N,74,,172737,30401,PCW
75,,SING,C26,H262,no,N,75,,172737,30401,PCW
76,,SING,C27,C28,no,N,76,,172737,30401,PCW
77,,SING,C27,H271,no,N,77,,172737,30401,PCW
78,,SING,C27,H272,no,N,78,,172737,30401,PCW
79,,SING,C28,H281,no,N,79,,172737,30401,PCW
80,,SING,C28,H282,no,N,80,,172737,30401,PCW
81,,SING,C28,H283,no,N,81,,172737,30401,PCW
82,,SING,C31,C32,no,N,82,,172737,30401,PCW
83,,SING,C31,O2,no,N,83,,172737,30401,PCW
84,,DOUB,C31,O31,no,N,84,,172737,30401,PCW
85,,SING,C32,C33,no,N,85,,172737,30401,PCW
86,,SING,C32,H321,no,N,86,,172737,30401,PCW
87,,SING,C32,H322,no,N,87,,172737,30401,PCW
88,,SING,C33,C34,no,N,88,,172737,30401,PCW
89,,SING,C33,H331,no,N,89,,172737,30401,PCW
90,,SING,C33,H332,no,N,90,,172737,30401,PCW
91,,SING,C34,C35,no,N,91,,172737,30401,PCW
92,,SING,C34,H341,no,N,92,,172737,30401,PCW
93,,SING,C34,H342,no,N,93,,172737,30401,PCW
94,,SING,C35,C36,no,N,94,,172737,30401,PCW
95,,SING,C35,H351,no,N,95,,172737,30401,PCW
96,,SING,C35,H352,no,N,96,,172737,30401,PCW
97,,SING,C36,C37,no,N,97,,172737,30401,PCW
98,,SING,C36,H361,no,N,98,,172737,30401,PCW
99,,SING,C36,H362,no,N,99,,172737,30401,PCW
100,,SING,C37,C38,no,N,100,,172737,30401,PCW
101,,SING,C37,H371,no,N,101,,172737,30401,PCW
102,,SING,C37,H372,no,N,102,,172737,30401,PCW
103,,SING,C38,C39,no,N,103,,172737,30401,PCW
104,,SING,C38,H381,no,N,104,,172737,30401,PCW
105,,SING,C38,H382,no,N,105,,172737,30401,PCW
106,,DOUB,C39,C40,no,Z,106,,172737,30401,PCW
107,,SING,C39,H39,no,N,107,,172737,30401,PCW
108,,SING,C40,C41,no,N,108,,172737,30401,PCW
109,,SING,C40,H40,no,N,109,,172737,30401,PCW
110,,SING,C41,C42,no,N,110,,172737,30401,PCW
111,,SING,C41,H411,no,N,111,,172737,30401,PCW
112,,SING,C41,H412,no,N,112,,172737,30401,PCW
113,,SING,C42,C43,no,N,113,,172737,30401,PCW
114,,SING,C42,H421,no,N,114,,172737,30401,PCW
115,,SING,C42,H422,no,N,115,,172737,30401,PCW
116,,SING,C43,C44,no,N,116,,172737,30401,PCW
117,,SING,C43,H431,no,N,117,,172737,30401,PCW
118,,SING,C43,H432,no,N,118,,172737,30401,PCW
119,,SING,C44,C45,no,N,119,,172737,30401,PCW
120,,SING,C44,H441,no,N,120,,172737,30401,PCW
121,,SING,C44,H442,no,N,121,,172737,30401,PCW
122,,SING,C45,C46,no,N,122,,172737,30401,PCW
123,,SING,C45,H451,no,N,123,,172737,30401,PCW
124,,SING,C45,H452,no,N,124,,172737,30401,PCW
125,,SING,C46,C47,no,N,125,,172737,30401,PCW
126,,SING,C46,H461,no,N,126,,172737,30401,PCW
127,,SING,C46,H462,no,N,127,,172737,30401,PCW
128,,SING,C47,C48,no,N,128,,172737,30401,PCW
129,,SING,C47,H471,no,N,129,,172737,30401,PCW
130,,SING,C47,H472,no,N,130,,172737,30401,PCW
131,,SING,C48,H481,no,N,131,,172737,30401,PCW
132,,SING,C48,H482,no,N,132,,172737,30401,PCW
133,,SING,C48,H483,no,N,133,,172737,30401,PCW
134,,SING,O1P,P,no,N,134,,172737,30401,PCW
135,,SING,O1P,H1P,no,N,135,,172737,30401,PCW
136,,DOUB,O2P,P,no,N,136,,172737,30401,PCW
137,,SING,O3P,P,no,N,137,,172737,30401,PCW
138,,SING,O4P,P,no,N,138,,172737,30401,PCW
1,,SING,C1,O3,no,N,1,,172738,30401,17F
2,,SING,N1,C2,no,N,2,,172738,30401,17F
3,,DOUB,O1,P1,no,N,3,,172738,30401,17F
4,,SING,P1,O6,no,N,4,,172738,30401,17F
5,,SING,C2,C1,no,N,5,,172738,30401,17F
6,,SING,O2,P1,no,N,6,,172738,30401,17F
7,,SING,C3,C2,no,N,7,,172738,30401,17F
8,,SING,C3,O5,no,N,8,,172738,30401,17F
9,,SING,O3,P1,no,N,9,,172738,30401,17F
10,,SING,C4,C5,no,N,10,,172738,30401,17F
11,,DOUB,O4,C3,no,N,11,,172738,30401,17F
12,,SING,C5,C6,no,N,12,,172738,30401,17F
13,,SING,C5,O9,no,N,13,,172738,30401,17F
14,,SING,C6,O7,no,N,14,,172738,30401,17F
15,,SING,O6,C4,no,N,15,,172738,30401,17F
16,,SING,C7,C8,no,N,16,,172738,30401,17F
17,,SING,O7,C7,no,N,17,,172738,30401,17F
18,,SING,C8,C9,no,N,18,,172738,30401,17F
19,,DOUB,O8,C7,no,N,19,,172738,30401,17F
20,,SING,C9,C10,no,N,20,,172738,30401,17F
21,,SING,O9,C17,no,N,21,,172738,30401,17F
22,,SING,C10,C11,no,N,22,,172738,30401,17F
23,,SING,C11,C12,no,N,23,,172738,30401,17F
24,,SING,C12,C1X,no,N,24,,172738,30401,17F
25,,DOUB,C17,O10,no,N,25,,172738,30401,17F
26,,SING,C17,C18,no,N,26,,172738,30401,17F
27,,SING,C18,C19,no,N,27,,172738,30401,17F
28,,SING,C19,C20,no,N,28,,172738,30401,17F
29,,SING,C20,C1Y,no,N,29,,172738,30401,17F
30,,SING,C1Y,C1Z,no,N,30,,172738,30401,17F
31,,SING,C1X,C2X,no,N,31,,172738,30401,17F
32,,SING,C2X,C21,no,N,32,,172738,30401,17F
33,,DOUB,C21,C22,no,Z,33,,172738,30401,17F
34,,SING,C22,C23,no,N,34,,172738,30401,17F
35,,SING,C23,C24,no,N,35,,172738,30401,17F
36,,SING,C24,C25,no,N,36,,172738,30401,17F
37,,SING,C25,C26,no,N,37,,172738,30401,17F
38,,SING,C26,C27,no,N,38,,172738,30401,17F
39,,SING,C27,C28,no,N,39,,172738,30401,17F
40,,SING,C28,C29,no,N,40,,172738,30401,17F
41,,SING,C29,C30,no,N,41,,172738,30401,17F
42,,SING,C1Z,C31,no,N,42,,172738,30401,17F
43,,SING,C31,C32,no,N,43,,172738,30401,17F
44,,SING,C32,C33,no,N,44,,172738,30401,17F
45,,DOUB,C33,C34,no,Z,45,,172738,30401,17F
46,,SING,C34,C35,no,N,46,,172738,30401,17F
47,,SING,C35,C36,no,N,47,,172738,30401,17F
48,,SING,C36,C37,no,N,48,,172738,30401,17F
49,,SING,C37,C38,no,N,49,,172738,30401,17F
50,,SING,C38,C39,no,N,50,,172738,30401,17F
51,,SING,C39,C40,no,N,51,,172738,30401,17F
52,,SING,C40,C41,no,N,52,,172738,30401,17F
53,,SING,C41,C42,no,N,53,,172738,30401,17F
54,,SING,C1,H1,no,N,54,,172738,30401,17F
55,,SING,C1,H1A,no,N,55,,172738,30401,17F
56,,SING,N1,HN1,no,N,56,,172738,30401,17F
57,,SING,N1,HN1A,no,N,57,,172738,30401,17F
58,,SING,C2,H2,no,N,58,,172738,30401,17F
59,,SING,O2,HO2,no,N,59,,172738,30401,17F
60,,SING,C4,H4,no,N,60,,172738,30401,17F
61,,SING,C4,H4A,no,N,61,,172738,30401,17F
62,,SING,C5,H5,no,N,62,,172738,30401,17F
63,,SING,O5,HO5,no,N,63,,172738,30401,17F
64,,SING,C6,H6,no,N,64,,172738,30401,17F
65,,SING,C6,H6A,no,N,65,,172738,30401,17F
66,,SING,C8,H8,no,N,66,,172738,30401,17F
67,,SING,C8,H8A,no,N,67,,172738,30401,17F
68,,SING,C9,H9,no,N,68,,172738,30401,17F
69,,SING,C9,H9A,no,N,69,,172738,30401,17F
70,,SING,C10,H10,no,N,70,,172738,30401,17F
71,,SING,C10,H10A,no,N,71,,172738,30401,17F
72,,SING,C11,H11,no,N,72,,172738,30401,17F
73,,SING,C11,H11A,no,N,73,,172738,30401,17F
74,,SING,C12,H12,no,N,74,,172738,30401,17F
75,,SING,C12,H12A,no,N,75,,172738,30401,17F
76,,SING,C18,H18,no,N,76,,172738,30401,17F
77,,SING,C18,H18A,no,N,77,,172738,30401,17F
78,,SING,C19,H19,no,N,78,,172738,30401,17F
79,,SING,C19,H19A,no,N,79,,172738,30401,17F
80,,SING,C20,H20,no,N,80,,172738,30401,17F
81,,SING,C20,H20A,no,N,81,,172738,30401,17F
82,,SING,C1X,H29,no,N,82,,172738,30401,17F
83,,SING,C1X,H30,no,N,83,,172738,30401,17F
84,,SING,C1Y,H31,no,N,84,,172738,30401,17F
85,,SING,C1Y,H32,no,N,85,,172738,30401,17F
86,,SING,C1Z,H33,no,N,86,,172738,30401,17F
87,,SING,C1Z,H34,no,N,87,,172738,30401,17F
88,,SING,C2X,H35,no,N,88,,172738,30401,17F
89,,SING,C2X,H36,no,N,89,,172738,30401,17F
90,,SING,C21,H37,no,N,90,,172738,30401,17F
91,,SING,C22,H38,no,N,91,,172738,30401,17F
92,,SING,C23,H39,no,N,92,,172738,30401,17F
93,,SING,C23,H40,no,N,93,,172738,30401,17F
94,,SING,C24,H41,no,N,94,,172738,30401,17F
95,,SING,C24,H42,no,N,95,,172738,30401,17F
96,,SING,C25,H43,no,N,96,,172738,30401,17F
97,,SING,C25,H44,no,N,97,,172738,30401,17F
98,,SING,C26,H45,no,N,98,,172738,30401,17F
99,,SING,C26,H46,no,N,99,,172738,30401,17F
100,,SING,C27,H47,no,N,100,,172738,30401,17F
101,,SING,C27,H48,no,N,101,,172738,30401,17F
102,,SING,C28,H49,no,N,102,,172738,30401,17F
103,,SING,C28,H50,no,N,103,,172738,30401,17F
104,,SING,C29,H51,no,N,104,,172738,30401,17F
105,,SING,C29,H52,no,N,105,,172738,30401,17F
106,,SING,C30,H53,no,N,106,,172738,30401,17F
107,,SING,C30,H54,no,N,107,,172738,30401,17F
108,,SING,C30,H55,no,N,108,,172738,30401,17F
109,,SING,C31,H56,no,N,109,,172738,30401,17F
110,,SING,C31,H57,no,N,110,,172738,30401,17F
111,,SING,C32,H58,no,N,111,,172738,30401,17F
112,,SING,C32,H59,no,N,112,,172738,30401,17F
113,,SING,C33,H60,no,N,113,,172738,30401,17F
114,,SING,C34,H61,no,N,114,,172738,30401,17F
115,,SING,C35,H62,no,N,115,,172738,30401,17F
116,,SING,C35,H63,no,N,116,,172738,30401,17F
117,,SING,C36,H64,no,N,117,,172738,30401,17F
118,,SING,C36,H65,no,N,118,,172738,30401,17F
119,,SING,C37,H66,no,N,119,,172738,30401,17F
120,,SING,C37,H67,no,N,120,,172738,30401,17F
121,,SING,C38,H68,no,N,121,,172738,30401,17F
122,,SING,C38,H69,no,N,122,,172738,30401,17F
123,,SING,C39,H70,no,N,123,,172738,30401,17F
124,,SING,C39,H71,no,N,124,,172738,30401,17F
125,,SING,C40,H72,no,N,125,,172738,30401,17F
126,,SING,C40,H73,no,N,126,,172738,30401,17F
127,,SING,C41,H74,no,N,127,,172738,30401,17F
128,,SING,C41,H75,no,N,128,,172738,30401,17F
129,,SING,C42,H76,no,N,129,,172738,30401,17F
130,,SING,C42,H77,no,N,130,,172738,30401,17F
131,,SING,C42,H78,no,N,131,,172738,30401,17F
1,,DOUB,PG,O1G,no,N,1,,172739,30401,GNP
2,,SING,PG,O2G,no,N,2,,172739,30401,GNP
3,,SING,PG,O3G,no,N,3,,172739,30401,GNP
4,,SING,PG,N3B,no,N,4,,172739,30401,GNP
5,,SING,O2G,HOG2,no,N,5,,172739,30401,GNP
6,,SING,O3G,HOG3,no,N,6,,172739,30401,GNP
7,,SING,N3B,PB,no,N,7,,172739,30401,GNP
8,,SING,N3B,HNB3,no,N,8,,172739,30401,GNP
9,,DOUB,PB,O1B,no,N,9,,172739,30401,GNP
10,,SING,PB,O2B,no,N,10,,172739,30401,GNP
11,,SING,PB,O3A,no,N,11,,172739,30401,GNP
12,,SING,O2B,HOB2,no,N,12,,172739,30401,GNP
13,,SING,O3A,PA,no,N,13,,172739,30401,GNP
14,,DOUB,PA,O1A,no,N,14,,172739,30401,GNP
15,,SING,PA,O2A,no,N,15,,172739,30401,GNP
16,,SING,PA,O5',no,N,16,,172739,30401,GNP
17,,SING,O2A,HOA2,no,N,17,,172739,30401,GNP
18,,SING,O5',C5',no,N,18,,172739,30401,GNP
19,,SING,C5',C4',no,N,19,,172739,30401,GNP
20,,SING,C5',H5'2,no,N,20,,172739,30401,GNP
21,,SING,C5',H5'1,no,N,21,,172739,30401,GNP
22,,SING,C4',O4',no,N,22,,172739,30401,GNP
23,,SING,C4',C3',no,N,23,,172739,30401,GNP
24,,SING,C4',H4',no,N,24,,172739,30401,GNP
25,,SING,O4',C1',no,N,25,,172739,30401,GNP
26,,SING,C3',O3',no,N,26,,172739,30401,GNP
27,,SING,C3',C2',no,N,27,,172739,30401,GNP
28,,SING,C3',H3',no,N,28,,172739,30401,GNP
29,,SING,O3',HO3',no,N,29,,172739,30401,GNP
30,,SING,C2',O2',no,N,30,,172739,30401,GNP
31,,SING,C2',C1',no,N,31,,172739,30401,GNP
32,,SING,C2',H2',no,N,32,,172739,30401,GNP
33,,SING,O2',HO2',no,N,33,,172739,30401,GNP
34,,SING,C1',N9,no,N,34,,172739,30401,GNP
35,,SING,C1',H1',no,N,35,,172739,30401,GNP
36,,SING,N9,C8,yes,N,36,,172739,30401,GNP
37,,SING,N9,C4,yes,N,37,,172739,30401,GNP
38,,DOUB,C8,N7,yes,N,38,,172739,30401,GNP
39,,SING,C8,H8,no,N,39,,172739,30401,GNP
40,,SING,N7,C5,yes,N,40,,172739,30401,GNP
41,,SING,C5,C6,yes,N,41,,172739,30401,GNP
42,,DOUB,C5,C4,yes,N,42,,172739,30401,GNP
43,,DOUB,C6,O6,no,N,43,,172739,30401,GNP
44,,SING,C6,N1,yes,N,44,,172739,30401,GNP
45,,SING,N1,C2,yes,N,45,,172739,30401,GNP
46,,SING,N1,HN1,no,N,46,,172739,30401,GNP
47,,SING,C2,N2,no,N,47,,172739,30401,GNP
48,,DOUB,C2,N3,yes,N,48,,172739,30401,GNP
49,,SING,N2,HN21,no,N,49,,172739,30401,GNP
50,,SING,N2,HN22,no,N,50,,172739,30401,GNP
51,,SING,N3,C4,yes,N,51,,172739,30401,GNP
1,,SING,CA,O1,no,N,1,,172762,30402,EWV
2,,SING,O1,C2,no,N,2,,172762,30402,EWV
3,,DOUB,C12,C11,yes,N,3,,172762,30402,EWV
4,,SING,C12,C18,yes,N,4,,172762,30402,EWV
5,,SING,C11,C10,yes,N,5,,172762,30402,EWV
6,,DOUB,C2,C1,yes,N,6,,172762,30402,EWV
7,,SING,C2,C3,yes,N,7,,172762,30402,EWV
8,,SING,C1,C15,yes,N,8,,172762,30402,EWV
9,,DOUB,C13,C18,yes,N,9,,172762,30402,EWV
10,,SING,C13,C14,yes,N,10,,172762,30402,EWV
11,,SING,C18,C17,yes,N,11,,172762,30402,EWV
12,,SING,C10,O4,no,N,12,,172762,30402,EWV
13,,DOUB,C10,C9,yes,N,13,,172762,30402,EWV
14,,SING,O4,CC,no,N,14,,172762,30402,EWV
15,,SING,O2,C3,no,N,15,,172762,30402,EWV
16,,SING,O2,CB,no,N,16,,172762,30402,EWV
17,,DOUB,C3,C4,yes,N,17,,172762,30402,EWV
18,,SING,C15,C14,no,N,18,,172762,30402,EWV
19,,DOUB,C15,C16,yes,N,19,,172762,30402,EWV
20,,DOUB,C14,N7,yes,N,20,,172762,30402,EWV
21,,SING,C17,C9,yes,N,21,,172762,30402,EWV
22,,DOUB,C17,C8,yes,N,22,,172762,30402,EWV
23,,SING,C9,O3,no,N,23,,172762,30402,EWV
24,,SING,CC,O3,no,N,24,,172762,30402,EWV
25,,SING,C4,C16,yes,N,25,,172762,30402,EWV
26,,SING,C16,C5,no,N,26,,172762,30402,EWV
27,,SING,N7,C8,yes,N,27,,172762,30402,EWV
28,,SING,N7,C6,no,N,28,,172762,30402,EWV
29,,SING,C5,C6,no,N,29,,172762,30402,EWV
30,,SING,C13,3H1,no,N,30,,172762,30402,EWV
31,,SING,C12,2H1,no,N,31,,172762,30402,EWV
32,,SING,C5,H71,no,N,32,,172762,30402,EWV
33,,SING,C5,H72,no,N,33,,172762,30402,EWV
34,,SING,C6,H61,no,N,34,,172762,30402,EWV
35,,SING,C6,H62,no,N,35,,172762,30402,EWV
36,,SING,CB,HB3,no,N,36,,172762,30402,EWV
37,,SING,CB,HB2,no,N,37,,172762,30402,EWV
38,,SING,CB,HB1,no,N,38,,172762,30402,EWV
39,,SING,C4,H4,no,N,39,,172762,30402,EWV
40,,SING,C8,H8,no,N,40,,172762,30402,EWV
41,,SING,CC,HC2,no,N,41,,172762,30402,EWV
42,,SING,CC,HC1,no,N,42,,172762,30402,EWV
43,,SING,C11,1H1,no,N,43,,172762,30402,EWV
44,,SING,C1,H1,no,N,44,,172762,30402,EWV
45,,SING,CA,HA2,no,N,45,,172762,30402,EWV
46,,SING,CA,HA1,no,N,46,,172762,30402,EWV
47,,SING,CA,HA3,no,N,47,,172762,30402,EWV
1,,SING,C1,C2,no,N,1,,172787,30403,PCW
2,,SING,C1,O3P,no,N,2,,172787,30403,PCW
3,,SING,C1,H11,no,N,3,,172787,30403,PCW
4,,SING,C1,H12,no,N,4,,172787,30403,PCW
5,,SING,C2,C3,no,N,5,,172787,30403,PCW
6,,SING,C2,O2,no,N,6,,172787,30403,PCW
7,,SING,C2,H2,no,N,7,,172787,30403,PCW
8,,SING,C3,O3,no,N,8,,172787,30403,PCW
9,,SING,C3,H31,no,N,9,,172787,30403,PCW
10,,SING,C3,H32,no,N,10,,172787,30403,PCW
11,,SING,C4,C5,no,N,11,,172787,30403,PCW
12,,SING,C4,O4P,no,N,12,,172787,30403,PCW
13,,SING,C4,H41,no,N,13,,172787,30403,PCW
14,,SING,C4,H42,no,N,14,,172787,30403,PCW
15,,SING,C5,N,no,N,15,,172787,30403,PCW
16,,SING,C5,H51,no,N,16,,172787,30403,PCW
17,,SING,C5,H52,no,N,17,,172787,30403,PCW
18,,SING,C6,N,no,N,18,,172787,30403,PCW
19,,SING,C6,H61,no,N,19,,172787,30403,PCW
20,,SING,C6,H62,no,N,20,,172787,30403,PCW
21,,SING,C6,H63,no,N,21,,172787,30403,PCW
22,,SING,C7,N,no,N,22,,172787,30403,PCW
23,,SING,C7,H71,no,N,23,,172787,30403,PCW
24,,SING,C7,H72,no,N,24,,172787,30403,PCW
25,,SING,C7,H73,no,N,25,,172787,30403,PCW
26,,SING,C8,N,no,N,26,,172787,30403,PCW
27,,SING,C8,H81,no,N,27,,172787,30403,PCW
28,,SING,C8,H82,no,N,28,,172787,30403,PCW
29,,SING,C8,H83,no,N,29,,172787,30403,PCW
30,,SING,C11,C12,no,N,30,,172787,30403,PCW
31,,SING,C11,O3,no,N,31,,172787,30403,PCW
32,,DOUB,C11,O11,no,N,32,,172787,30403,PCW
33,,SING,C12,C13,no,N,33,,172787,30403,PCW
34,,SING,C12,H121,no,N,34,,172787,30403,PCW
35,,SING,C12,H122,no,N,35,,172787,30403,PCW
36,,SING,C13,C14,no,N,36,,172787,30403,PCW
37,,SING,C13,H131,no,N,37,,172787,30403,PCW
38,,SING,C13,H132,no,N,38,,172787,30403,PCW
39,,SING,C14,C15,no,N,39,,172787,30403,PCW
40,,SING,C14,H141,no,N,40,,172787,30403,PCW
41,,SING,C14,H142,no,N,41,,172787,30403,PCW
42,,SING,C15,C16,no,N,42,,172787,30403,PCW
43,,SING,C15,H151,no,N,43,,172787,30403,PCW
44,,SING,C15,H152,no,N,44,,172787,30403,PCW
45,,SING,C16,C17,no,N,45,,172787,30403,PCW
46,,SING,C16,H161,no,N,46,,172787,30403,PCW
47,,SING,C16,H162,no,N,47,,172787,30403,PCW
48,,SING,C17,C18,no,N,48,,172787,30403,PCW
49,,SING,C17,H171,no,N,49,,172787,30403,PCW
50,,SING,C17,H172,no,N,50,,172787,30403,PCW
51,,SING,C18,C19,no,N,51,,172787,30403,PCW
52,,SING,C18,H181,no,N,52,,172787,30403,PCW
53,,SING,C18,H182,no,N,53,,172787,30403,PCW
54,,DOUB,C19,C20,no,Z,54,,172787,30403,PCW
55,,SING,C19,H19,no,N,55,,172787,30403,PCW
56,,SING,C20,C21,no,N,56,,172787,30403,PCW
57,,SING,C20,H20,no,N,57,,172787,30403,PCW
58,,SING,C21,C22,no,N,58,,172787,30403,PCW
59,,SING,C21,H211,no,N,59,,172787,30403,PCW
60,,SING,C21,H212,no,N,60,,172787,30403,PCW
61,,SING,C22,C23,no,N,61,,172787,30403,PCW
62,,SING,C22,H221,no,N,62,,172787,30403,PCW
63,,SING,C22,H222,no,N,63,,172787,30403,PCW
64,,SING,C23,C24,no,N,64,,172787,30403,PCW
65,,SING,C23,H231,no,N,65,,172787,30403,PCW
66,,SING,C23,H232,no,N,66,,172787,30403,PCW
67,,SING,C24,C25,no,N,67,,172787,30403,PCW
68,,SING,C24,H241,no,N,68,,172787,30403,PCW
69,,SING,C24,H242,no,N,69,,172787,30403,PCW
70,,SING,C25,C26,no,N,70,,172787,30403,PCW
71,,SING,C25,H251,no,N,71,,172787,30403,PCW
72,,SING,C25,H252,no,N,72,,172787,30403,PCW
73,,SING,C26,C27,no,N,73,,172787,30403,PCW
74,,SING,C26,H261,no,N,74,,172787,30403,PCW
75,,SING,C26,H262,no,N,75,,172787,30403,PCW
76,,SING,C27,C28,no,N,76,,172787,30403,PCW
77,,SING,C27,H271,no,N,77,,172787,30403,PCW
78,,SING,C27,H272,no,N,78,,172787,30403,PCW
79,,SING,C28,H281,no,N,79,,172787,30403,PCW
80,,SING,C28,H282,no,N,80,,172787,30403,PCW
81,,SING,C28,H283,no,N,81,,172787,30403,PCW
82,,SING,C31,C32,no,N,82,,172787,30403,PCW
83,,SING,C31,O2,no,N,83,,172787,30403,PCW
84,,DOUB,C31,O31,no,N,84,,172787,30403,PCW
85,,SING,C32,C33,no,N,85,,172787,30403,PCW
86,,SING,C32,H321,no,N,86,,172787,30403,PCW
87,,SING,C32,H322,no,N,87,,172787,30403,PCW
88,,SING,C33,C34,no,N,88,,172787,30403,PCW
89,,SING,C33,H331,no,N,89,,172787,30403,PCW
90,,SING,C33,H332,no,N,90,,172787,30403,PCW
91,,SING,C34,C35,no,N,91,,172787,30403,PCW
92,,SING,C34,H341,no,N,92,,172787,30403,PCW
93,,SING,C34,H342,no,N,93,,172787,30403,PCW
94,,SING,C35,C36,no,N,94,,172787,30403,PCW
95,,SING,C35,H351,no,N,95,,172787,30403,PCW
96,,SING,C35,H352,no,N,96,,172787,30403,PCW
97,,SING,C36,C37,no,N,97,,172787,30403,PCW
98,,SING,C36,H361,no,N,98,,172787,30403,PCW
99,,SING,C36,H362,no,N,99,,172787,30403,PCW
100,,SING,C37,C38,no,N,100,,172787,30403,PCW
101,,SING,C37,H371,no,N,101,,172787,30403,PCW
102,,SING,C37,H372,no,N,102,,172787,30403,PCW
103,,SING,C38,C39,no,N,103,,172787,30403,PCW
104,,SING,C38,H381,no,N,104,,172787,30403,PCW
105,,SING,C38,H382,no,N,105,,172787,30403,PCW
106,,DOUB,C39,C40,no,Z,106,,172787,30403,PCW
107,,SING,C39,H39,no,N,107,,172787,30403,PCW
108,,SING,C40,C41,no,N,108,,172787,30403,PCW
109,,SING,C40,H40,no,N,109,,172787,30403,PCW
110,,SING,C41,C42,no,N,110,,172787,30403,PCW
111,,SING,C41,H411,no,N,111,,172787,30403,PCW
112,,SING,C41,H412,no,N,112,,172787,30403,PCW
113,,SING,C42,C43,no,N,113,,172787,30403,PCW
114,,SING,C42,H421,no,N,114,,172787,30403,PCW
115,,SING,C42,H422,no,N,115,,172787,30403,PCW
116,,SING,C43,C44,no,N,116,,172787,30403,PCW
117,,SING,C43,H431,no,N,117,,172787,30403,PCW
118,,SING,C43,H432,no,N,118,,172787,30403,PCW
119,,SING,C44,C45,no,N,119,,172787,30403,PCW
120,,SING,C44,H441,no,N,120,,172787,30403,PCW
121,,SING,C44,H442,no,N,121,,172787,30403,PCW
122,,SING,C45,C46,no,N,122,,172787,30403,PCW
123,,SING,C45,H451,no,N,123,,172787,30403,PCW
124,,SING,C45,H452,no,N,124,,172787,30403,PCW
125,,SING,C46,C47,no,N,125,,172787,30403,PCW
126,,SING,C46,H461,no,N,126,,172787,30403,PCW
127,,SING,C46,H462,no,N,127,,172787,30403,PCW
128,,SING,C47,C48,no,N,128,,172787,30403,PCW
129,,SING,C47,H471,no,N,129,,172787,30403,PCW
130,,SING,C47,H472,no,N,130,,172787,30403,PCW
131,,SING,C48,H481,no,N,131,,172787,30403,PCW
132,,SING,C48,H482,no,N,132,,172787,30403,PCW
133,,SING,C48,H483,no,N,133,,172787,30403,PCW
134,,SING,O1P,P,no,N,134,,172787,30403,PCW
135,,SING,O1P,H1P,no,N,135,,172787,30403,PCW
136,,DOUB,O2P,P,no,N,136,,172787,30403,PCW
137,,SING,O3P,P,no,N,137,,172787,30403,PCW
138,,SING,O4P,P,no,N,138,,172787,30403,PCW
1,,SING,C1,O3,no,N,1,,172788,30403,17F
2,,SING,N1,C2,no,N,2,,172788,30403,17F
3,,DOUB,O1,P1,no,N,3,,172788,30403,17F
4,,SING,P1,O6,no,N,4,,172788,30403,17F
5,,SING,C2,C1,no,N,5,,172788,30403,17F
6,,SING,O2,P1,no,N,6,,172788,30403,17F
7,,SING,C3,C2,no,N,7,,172788,30403,17F
8,,SING,C3,O5,no,N,8,,172788,30403,17F
9,,SING,O3,P1,no,N,9,,172788,30403,17F
10,,SING,C4,C5,no,N,10,,172788,30403,17F
11,,DOUB,O4,C3,no,N,11,,172788,30403,17F
12,,SING,C5,C6,no,N,12,,172788,30403,17F
13,,SING,C5,O9,no,N,13,,172788,30403,17F
14,,SING,C6,O7,no,N,14,,172788,30403,17F
15,,SING,O6,C4,no,N,15,,172788,30403,17F
16,,SING,C7,C8,no,N,16,,172788,30403,17F
17,,SING,O7,C7,no,N,17,,172788,30403,17F
18,,SING,C8,C9,no,N,18,,172788,30403,17F
19,,DOUB,O8,C7,no,N,19,,172788,30403,17F
20,,SING,C9,C10,no,N,20,,172788,30403,17F
21,,SING,O9,C17,no,N,21,,172788,30403,17F
22,,SING,C10,C11,no,N,22,,172788,30403,17F
23,,SING,C11,C12,no,N,23,,172788,30403,17F
24,,SING,C12,C1X,no,N,24,,172788,30403,17F
25,,DOUB,C17,O10,no,N,25,,172788,30403,17F
26,,SING,C17,C18,no,N,26,,172788,30403,17F
27,,SING,C18,C19,no,N,27,,172788,30403,17F
28,,SING,C19,C20,no,N,28,,172788,30403,17F
29,,SING,C20,C1Y,no,N,29,,172788,30403,17F
30,,SING,C1Y,C1Z,no,N,30,,172788,30403,17F
31,,SING,C1X,C2X,no,N,31,,172788,30403,17F
32,,SING,C2X,C21,no,N,32,,172788,30403,17F
33,,DOUB,C21,C22,no,Z,33,,172788,30403,17F
34,,SING,C22,C23,no,N,34,,172788,30403,17F
35,,SING,C23,C24,no,N,35,,172788,30403,17F
36,,SING,C24,C25,no,N,36,,172788,30403,17F
37,,SING,C25,C26,no,N,37,,172788,30403,17F
38,,SING,C26,C27,no,N,38,,172788,30403,17F
39,,SING,C27,C28,no,N,39,,172788,30403,17F
40,,SING,C28,C29,no,N,40,,172788,30403,17F
41,,SING,C29,C30,no,N,41,,172788,30403,17F
42,,SING,C1Z,C31,no,N,42,,172788,30403,17F
43,,SING,C31,C32,no,N,43,,172788,30403,17F
44,,SING,C32,C33,no,N,44,,172788,30403,17F
45,,DOUB,C33,C34,no,Z,45,,172788,30403,17F
46,,SING,C34,C35,no,N,46,,172788,30403,17F
47,,SING,C35,C36,no,N,47,,172788,30403,17F
48,,SING,C36,C37,no,N,48,,172788,30403,17F
49,,SING,C37,C38,no,N,49,,172788,30403,17F
50,,SING,C38,C39,no,N,50,,172788,30403,17F
51,,SING,C39,C40,no,N,51,,172788,30403,17F
52,,SING,C40,C41,no,N,52,,172788,30403,17F
53,,SING,C41,C42,no,N,53,,172788,30403,17F
54,,SING,C1,H1,no,N,54,,172788,30403,17F
55,,SING,C1,H1A,no,N,55,,172788,30403,17F
56,,SING,N1,HN1,no,N,56,,172788,30403,17F
57,,SING,N1,HN1A,no,N,57,,172788,30403,17F
58,,SING,C2,H2,no,N,58,,172788,30403,17F
59,,SING,O2,HO2,no,N,59,,172788,30403,17F
60,,SING,C4,H4,no,N,60,,172788,30403,17F
61,,SING,C4,H4A,no,N,61,,172788,30403,17F
62,,SING,C5,H5,no,N,62,,172788,30403,17F
63,,SING,O5,HO5,no,N,63,,172788,30403,17F
64,,SING,C6,H6,no,N,64,,172788,30403,17F
65,,SING,C6,H6A,no,N,65,,172788,30403,17F
66,,SING,C8,H8,no,N,66,,172788,30403,17F
67,,SING,C8,H8A,no,N,67,,172788,30403,17F
68,,SING,C9,H9,no,N,68,,172788,30403,17F
69,,SING,C9,H9A,no,N,69,,172788,30403,17F
70,,SING,C10,H10,no,N,70,,172788,30403,17F
71,,SING,C10,H10A,no,N,71,,172788,30403,17F
72,,SING,C11,H11,no,N,72,,172788,30403,17F
73,,SING,C11,H11A,no,N,73,,172788,30403,17F
74,,SING,C12,H12,no,N,74,,172788,30403,17F
75,,SING,C12,H12A,no,N,75,,172788,30403,17F
76,,SING,C18,H18,no,N,76,,172788,30403,17F
77,,SING,C18,H18A,no,N,77,,172788,30403,17F
78,,SING,C19,H19,no,N,78,,172788,30403,17F
79,,SING,C19,H19A,no,N,79,,172788,30403,17F
80,,SING,C20,H20,no,N,80,,172788,30403,17F
81,,SING,C20,H20A,no,N,81,,172788,30403,17F
82,,SING,C1X,H29,no,N,82,,172788,30403,17F
83,,SING,C1X,H30,no,N,83,,172788,30403,17F
84,,SING,C1Y,H31,no,N,84,,172788,30403,17F
85,,SING,C1Y,H32,no,N,85,,172788,30403,17F
86,,SING,C1Z,H33,no,N,86,,172788,30403,17F
87,,SING,C1Z,H34,no,N,87,,172788,30403,17F
88,,SING,C2X,H35,no,N,88,,172788,30403,17F
89,,SING,C2X,H36,no,N,89,,172788,30403,17F
90,,SING,C21,H37,no,N,90,,172788,30403,17F
91,,SING,C22,H38,no,N,91,,172788,30403,17F
92,,SING,C23,H39,no,N,92,,172788,30403,17F
93,,SING,C23,H40,no,N,93,,172788,30403,17F
94,,SING,C24,H41,no,N,94,,172788,30403,17F
95,,SING,C24,H42,no,N,95,,172788,30403,17F
96,,SING,C25,H43,no,N,96,,172788,30403,17F
97,,SING,C25,H44,no,N,97,,172788,30403,17F
98,,SING,C26,H45,no,N,98,,172788,30403,17F
99,,SING,C26,H46,no,N,99,,172788,30403,17F
100,,SING,C27,H47,no,N,100,,172788,30403,17F
101,,SING,C27,H48,no,N,101,,172788,30403,17F
102,,SING,C28,H49,no,N,102,,172788,30403,17F
103,,SING,C28,H50,no,N,103,,172788,30403,17F
104,,SING,C29,H51,no,N,104,,172788,30403,17F
105,,SING,C29,H52,no,N,105,,172788,30403,17F
106,,SING,C30,H53,no,N,106,,172788,30403,17F
107,,SING,C30,H54,no,N,107,,172788,30403,17F
108,,SING,C30,H55,no,N,108,,172788,30403,17F
109,,SING,C31,H56,no,N,109,,172788,30403,17F
110,,SING,C31,H57,no,N,110,,172788,30403,17F
111,,SING,C32,H58,no,N,111,,172788,30403,17F
112,,SING,C32,H59,no,N,112,,172788,30403,17F
113,,SING,C33,H60,no,N,113,,172788,30403,17F
114,,SING,C34,H61,no,N,114,,172788,30403,17F
115,,SING,C35,H62,no,N,115,,172788,30403,17F
116,,SING,C35,H63,no,N,116,,172788,30403,17F
117,,SING,C36,H64,no,N,117,,172788,30403,17F
118,,SING,C36,H65,no,N,118,,172788,30403,17F
119,,SING,C37,H66,no,N,119,,172788,30403,17F
120,,SING,C37,H67,no,N,120,,172788,30403,17F
121,,SING,C38,H68,no,N,121,,172788,30403,17F
122,,SING,C38,H69,no,N,122,,172788,30403,17F
123,,SING,C39,H70,no,N,123,,172788,30403,17F
124,,SING,C39,H71,no,N,124,,172788,30403,17F
125,,SING,C40,H72,no,N,125,,172788,30403,17F
126,,SING,C40,H73,no,N,126,,172788,30403,17F
127,,SING,C41,H74,no,N,127,,172788,30403,17F
128,,SING,C41,H75,no,N,128,,172788,30403,17F
129,,SING,C42,H76,no,N,129,,172788,30403,17F
130,,SING,C42,H77,no,N,130,,172788,30403,17F
131,,SING,C42,H78,no,N,131,,172788,30403,17F
1,,DOUB,PG,O1G,no,N,1,,172789,30403,GNP
2,,SING,PG,O2G,no,N,2,,172789,30403,GNP
3,,SING,PG,O3G,no,N,3,,172789,30403,GNP
4,,SING,PG,N3B,no,N,4,,172789,30403,GNP
5,,SING,O2G,HOG2,no,N,5,,172789,30403,GNP
6,,SING,O3G,HOG3,no,N,6,,172789,30403,GNP
7,,SING,N3B,PB,no,N,7,,172789,30403,GNP
8,,SING,N3B,HNB3,no,N,8,,172789,30403,GNP
9,,DOUB,PB,O1B,no,N,9,,172789,30403,GNP
10,,SING,PB,O2B,no,N,10,,172789,30403,GNP
11,,SING,PB,O3A,no,N,11,,172789,30403,GNP
12,,SING,O2B,HOB2,no,N,12,,172789,30403,GNP
13,,SING,O3A,PA,no,N,13,,172789,30403,GNP
14,,DOUB,PA,O1A,no,N,14,,172789,30403,GNP
15,,SING,PA,O2A,no,N,15,,172789,30403,GNP
16,,SING,PA,O5',no,N,16,,172789,30403,GNP
17,,SING,O2A,HOA2,no,N,17,,172789,30403,GNP
18,,SING,O5',C5',no,N,18,,172789,30403,GNP
19,,SING,C5',C4',no,N,19,,172789,30403,GNP
20,,SING,C5',H5'2,no,N,20,,172789,30403,GNP
21,,SING,C5',H5'1,no,N,21,,172789,30403,GNP
22,,SING,C4',O4',no,N,22,,172789,30403,GNP
23,,SING,C4',C3',no,N,23,,172789,30403,GNP
24,,SING,C4',H4',no,N,24,,172789,30403,GNP
25,,SING,O4',C1',no,N,25,,172789,30403,GNP
26,,SING,C3',O3',no,N,26,,172789,30403,GNP
27,,SING,C3',C2',no,N,27,,172789,30403,GNP
28,,SING,C3',H3',no,N,28,,172789,30403,GNP
29,,SING,O3',HO3',no,N,29,,172789,30403,GNP
30,,SING,C2',O2',no,N,30,,172789,30403,GNP
31,,SING,C2',C1',no,N,31,,172789,30403,GNP
32,,SING,C2',H2',no,N,32,,172789,30403,GNP
33,,SING,O2',HO2',no,N,33,,172789,30403,GNP
34,,SING,C1',N9,no,N,34,,172789,30403,GNP
35,,SING,C1',H1',no,N,35,,172789,30403,GNP
36,,SING,N9,C8,yes,N,36,,172789,30403,GNP
37,,SING,N9,C4,yes,N,37,,172789,30403,GNP
38,,DOUB,C8,N7,yes,N,38,,172789,30403,GNP
39,,SING,C8,H8,no,N,39,,172789,30403,GNP
40,,SING,N7,C5,yes,N,40,,172789,30403,GNP
41,,SING,C5,C6,yes,N,41,,172789,30403,GNP
42,,DOUB,C5,C4,yes,N,42,,172789,30403,GNP
43,,DOUB,C6,O6,no,N,43,,172789,30403,GNP
44,,SING,C6,N1,yes,N,44,,172789,30403,GNP
45,,SING,N1,C2,yes,N,45,,172789,30403,GNP
46,,SING,N1,HN1,no,N,46,,172789,30403,GNP
47,,SING,C2,N2,no,N,47,,172789,30403,GNP
48,,DOUB,C2,N3,yes,N,48,,172789,30403,GNP
49,,SING,N2,HN21,no,N,49,,172789,30403,GNP
50,,SING,N2,HN22,no,N,50,,172789,30403,GNP
51,,SING,N3,C4,yes,N,51,,172789,30403,GNP
1,,SING,CLB,CAT,no,N,1,,172791,30403,EWS
2,,DOUB,CAT,CAD,yes,N,2,,172791,30403,EWS
3,,SING,CAT,CAE,yes,N,3,,172791,30403,EWS
4,,SING,CAD,CAF,yes,N,4,,172791,30403,EWS
5,,DOUB,CAE,CAG,yes,N,5,,172791,30403,EWS
6,,DOUB,CAF,CAV,yes,N,6,,172791,30403,EWS
7,,SING,CAG,CAV,yes,N,7,,172791,30403,EWS
8,,SING,CAV,CAN,no,N,8,,172791,30403,EWS
9,,SING,CAN,CBA,no,N,9,,172791,30403,EWS
10,,SING,NAP,CBA,no,N,10,,172791,30403,EWS
11,,SING,NAP,CAL,no,N,11,,172791,30403,EWS
12,,SING,CBA,CAO,no,N,12,,172791,30403,EWS
13,,SING,CAL,CAM,no,N,13,,172791,30403,EWS
14,,SING,CAO,CAZ,no,N,14,,172791,30403,EWS
15,,SING,CAM,CAZ,no,N,15,,172791,30403,EWS
16,,SING,CAZ,NAQ,no,N,16,,172791,30403,EWS
17,,SING,NAQ,CAS,no,N,17,,172791,30403,EWS
18,,SING,BRC,CAU,no,N,18,,172791,30403,EWS
19,,DOUB,CAS,OAA,no,N,19,,172791,30403,EWS
20,,SING,CAS,CAW,no,N,20,,172791,30403,EWS
21,,DOUB,CAK,CAU,yes,N,21,,172791,30403,EWS
22,,SING,CAK,CAY,yes,N,22,,172791,30403,EWS
23,,SING,CAU,CAH,yes,N,23,,172791,30403,EWS
24,,SING,CAW,CAY,yes,N,24,,172791,30403,EWS
25,,DOUB,CAW,CAJ,yes,N,25,,172791,30403,EWS
26,,DOUB,CAY,CAX,yes,N,26,,172791,30403,EWS
27,,DOUB,CAH,CAI,yes,N,27,,172791,30403,EWS
28,,SING,CAJ,NAR,yes,N,28,,172791,30403,EWS
29,,SING,CAX,CAI,yes,N,29,,172791,30403,EWS
30,,SING,CAX,NAR,yes,N,30,,172791,30403,EWS
31,,SING,CAD,HAD,no,N,31,,172791,30403,EWS
32,,SING,CAE,HAE,no,N,32,,172791,30403,EWS
33,,SING,CAF,HAF,no,N,33,,172791,30403,EWS
34,,SING,CAG,HAG,no,N,34,,172791,30403,EWS
35,,SING,CAH,HAH,no,N,35,,172791,30403,EWS
36,,SING,CAI,HAI,no,N,36,,172791,30403,EWS
37,,SING,CAJ,HAJ,no,N,37,,172791,30403,EWS
38,,SING,CAK,HAK,no,N,38,,172791,30403,EWS
39,,SING,CAL,HAL,no,N,39,,172791,30403,EWS
40,,SING,CAL,HAM,no,N,40,,172791,30403,EWS
41,,SING,CAM,HAN,no,N,41,,172791,30403,EWS
42,,SING,CAM,HAO,no,N,42,,172791,30403,EWS
43,,SING,CAN,HAP,no,N,43,,172791,30403,EWS
44,,SING,CAN,HAQ,no,N,44,,172791,30403,EWS
45,,SING,CAO,HAR,no,N,45,,172791,30403,EWS
46,,SING,CAO,HAS,no,N,46,,172791,30403,EWS
47,,SING,CAZ,HAZ,no,N,47,,172791,30403,EWS
48,,SING,NAP,H1,no,N,48,,172791,30403,EWS
49,,SING,NAQ,HBD,no,N,49,,172791,30403,EWS
50,,SING,NAR,HBE,no,N,50,,172791,30403,EWS
51,,SING,CBA,HBA,no,N,51,,172791,30403,EWS
1,,SING,N,CA,no,N,1,,172830,30405,HYP
2,,SING,N,CD,no,N,2,,172830,30405,HYP
3,,SING,N,H,no,N,3,,172830,30405,HYP
4,,SING,CA,C,no,N,4,,172830,30405,HYP
5,,SING,CA,CB,no,N,5,,172830,30405,HYP
6,,SING,CA,HA,no,N,6,,172830,30405,HYP
7,,DOUB,C,O,no,N,7,,172830,30405,HYP
8,,SING,C,OXT,no,N,8,,172830,30405,HYP
9,,SING,CB,CG,no,N,9,,172830,30405,HYP
10,,SING,CB,HB2,no,N,10,,172830,30405,HYP
11,,SING,CB,HB3,no,N,11,,172830,30405,HYP
12,,SING,CG,CD,no,N,12,,172830,30405,HYP
13,,SING,CG,OD1,no,N,13,,172830,30405,HYP
14,,SING,CG,HG,no,N,14,,172830,30405,HYP
15,,SING,CD,HD22,no,N,15,,172830,30405,HYP
16,,SING,CD,HD23,no,N,16,,172830,30405,HYP
17,,SING,OD1,HD1,no,N,17,,172830,30405,HYP
18,,SING,OXT,HXT,no,N,18,,172830,30405,HYP
1,,SING,N,CA,no,N,1,,172955,30411,NLE
2,,SING,N,H,no,N,2,,172955,30411,NLE
3,,SING,N,HN2,no,N,3,,172955,30411,NLE
4,,SING,CA,C,no,N,4,,172955,30411,NLE
5,,SING,CA,CB,no,N,5,,172955,30411,NLE
6,,SING,CA,HA,no,N,6,,172955,30411,NLE
7,,DOUB,C,O,no,N,7,,172955,30411,NLE
8,,SING,C,OXT,no,N,8,,172955,30411,NLE
9,,SING,OXT,HXT,no,N,9,,172955,30411,NLE
10,,SING,CB,CG,no,N,10,,172955,30411,NLE
11,,SING,CB,HB2,no,N,11,,172955,30411,NLE
12,,SING,CB,HB3,no,N,12,,172955,30411,NLE
13,,SING,CG,CD,no,N,13,,172955,30411,NLE
14,,SING,CG,HG2,no,N,14,,172955,30411,NLE
15,,SING,CG,HG3,no,N,15,,172955,30411,NLE
16,,SING,CD,CE,no,N,16,,172955,30411,NLE
17,,SING,CD,HD2,no,N,17,,172955,30411,NLE
18,,SING,CD,HD3,no,N,18,,172955,30411,NLE
19,,SING,CE,HE1,no,N,19,,172955,30411,NLE
20,,SING,CE,HE2,no,N,20,,172955,30411,NLE
21,,SING,CE,HE3,no,N,21,,172955,30411,NLE
1,,SING,N,CA,no,N,1,,172990,30413,NLE
2,,SING,N,H,no,N,2,,172990,30413,NLE
3,,SING,N,HN2,no,N,3,,172990,30413,NLE
4,,SING,CA,C,no,N,4,,172990,30413,NLE
5,,SING,CA,CB,no,N,5,,172990,30413,NLE
6,,SING,CA,HA,no,N,6,,172990,30413,NLE
7,,DOUB,C,O,no,N,7,,172990,30413,NLE
8,,SING,C,OXT,no,N,8,,172990,30413,NLE
9,,SING,OXT,HXT,no,N,9,,172990,30413,NLE
10,,SING,CB,CG,no,N,10,,172990,30413,NLE
11,,SING,CB,HB2,no,N,11,,172990,30413,NLE
12,,SING,CB,HB3,no,N,12,,172990,30413,NLE
13,,SING,CG,CD,no,N,13,,172990,30413,NLE
14,,SING,CG,HG2,no,N,14,,172990,30413,NLE
15,,SING,CG,HG3,no,N,15,,172990,30413,NLE
16,,SING,CD,CE,no,N,16,,172990,30413,NLE
17,,SING,CD,HD2,no,N,17,,172990,30413,NLE
18,,SING,CD,HD3,no,N,18,,172990,30413,NLE
19,,SING,CE,HE1,no,N,19,,172990,30413,NLE
20,,SING,CE,HE2,no,N,20,,172990,30413,NLE
21,,SING,CE,HE3,no,N,21,,172990,30413,NLE
1,,SING,N,CA,no,N,1,,173008,30414,DAB
2,,SING,N,H,no,N,2,,173008,30414,DAB
3,,SING,N,H2,no,N,3,,173008,30414,DAB
4,,SING,CA,C,no,N,4,,173008,30414,DAB
5,,SING,CA,CB,no,N,5,,173008,30414,DAB
6,,SING,CA,HA,no,N,6,,173008,30414,DAB
7,,DOUB,C,O,no,N,7,,173008,30414,DAB
8,,SING,C,OXT,no,N,8,,173008,30414,DAB
9,,SING,CB,CG,no,N,9,,173008,30414,DAB
10,,SING,CB,HB2,no,N,10,,173008,30414,DAB
11,,SING,CB,HB3,no,N,11,,173008,30414,DAB
12,,SING,CG,ND,no,N,12,,173008,30414,DAB
13,,SING,CG,HG2,no,N,13,,173008,30414,DAB
14,,SING,CG,HG3,no,N,14,,173008,30414,DAB
15,,SING,ND,HD1,no,N,15,,173008,30414,DAB
16,,SING,ND,HD2,no,N,16,,173008,30414,DAB
17,,SING,OXT,HXT,no,N,17,,173008,30414,DAB
1,,SING,N,HN1,no,N,1,,173183,30424,NH2
2,,SING,N,HN2,no,N,2,,173183,30424,NH2
1,,DOUB,C,O,no,N,1,,173184,30424,ACE
2,,SING,C,CH3,no,N,2,,173184,30424,ACE
3,,SING,C,H,no,N,3,,173184,30424,ACE
4,,SING,CH3,H1,no,N,4,,173184,30424,ACE
5,,SING,CH3,H2,no,N,5,,173184,30424,ACE
6,,SING,CH3,H3,no,N,6,,173184,30424,ACE
1,,SING,O1,P1,no,N,1,,173208,30425,PX4
2,,SING,O1,H1P,no,N,2,,173208,30425,PX4
3,,DOUB,O2,P1,no,N,3,,173208,30425,PX4
4,,SING,P1,O3,no,N,4,,173208,30425,PX4
5,,SING,P1,O4,no,N,5,,173208,30425,PX4
6,,SING,O3,C1,no,N,6,,173208,30425,PX4
7,,SING,C1,C2,no,N,7,,173208,30425,PX4
8,,SING,C1,H1,no,N,8,,173208,30425,PX4
9,,SING,C1,H2,no,N,9,,173208,30425,PX4
10,,SING,C2,N1,no,N,10,,173208,30425,PX4
11,,SING,C2,H3,no,N,11,,173208,30425,PX4
12,,SING,C2,H4,no,N,12,,173208,30425,PX4
13,,SING,N1,C3,no,N,13,,173208,30425,PX4
14,,SING,N1,C4,no,N,14,,173208,30425,PX4
15,,SING,N1,C5,no,N,15,,173208,30425,PX4
16,,SING,C3,H5,no,N,16,,173208,30425,PX4
17,,SING,C3,H6,no,N,17,,173208,30425,PX4
18,,SING,C3,H7,no,N,18,,173208,30425,PX4
19,,SING,C4,H8,no,N,19,,173208,30425,PX4
20,,SING,C4,H9,no,N,20,,173208,30425,PX4
21,,SING,C4,H10,no,N,21,,173208,30425,PX4
22,,SING,C5,H11,no,N,22,,173208,30425,PX4
23,,SING,C5,H12,no,N,23,,173208,30425,PX4
24,,SING,C5,H13,no,N,24,,173208,30425,PX4
25,,SING,O4,C6,no,N,25,,173208,30425,PX4
26,,SING,C6,C7,no,N,26,,173208,30425,PX4
27,,SING,C6,H14,no,N,27,,173208,30425,PX4
28,,SING,C6,H15,no,N,28,,173208,30425,PX4
29,,SING,C7,C8,no,N,29,,173208,30425,PX4
30,,SING,C7,O7,no,N,30,,173208,30425,PX4
31,,SING,C7,H16,no,N,31,,173208,30425,PX4
32,,SING,C8,O5,no,N,32,,173208,30425,PX4
33,,SING,C8,H17,no,N,33,,173208,30425,PX4
34,,SING,C8,H18,no,N,34,,173208,30425,PX4
35,,SING,O5,C9,no,N,35,,173208,30425,PX4
36,,DOUB,C9,O6,no,N,36,,173208,30425,PX4
37,,SING,C9,C10,no,N,37,,173208,30425,PX4
38,,SING,C10,C11,no,N,38,,173208,30425,PX4
39,,SING,C10,H19,no,N,39,,173208,30425,PX4
40,,SING,C10,H20,no,N,40,,173208,30425,PX4
41,,SING,C11,C12,no,N,41,,173208,30425,PX4
42,,SING,C11,H21,no,N,42,,173208,30425,PX4
43,,SING,C11,H22,no,N,43,,173208,30425,PX4
44,,SING,C12,C13,no,N,44,,173208,30425,PX4
45,,SING,C12,H23,no,N,45,,173208,30425,PX4
46,,SING,C12,H24,no,N,46,,173208,30425,PX4
47,,SING,C13,C14,no,N,47,,173208,30425,PX4
48,,SING,C13,H25,no,N,48,,173208,30425,PX4
49,,SING,C13,H26,no,N,49,,173208,30425,PX4
50,,SING,C14,C15,no,N,50,,173208,30425,PX4
51,,SING,C14,H27,no,N,51,,173208,30425,PX4
52,,SING,C14,H28,no,N,52,,173208,30425,PX4
53,,SING,C15,C16,no,N,53,,173208,30425,PX4
54,,SING,C15,H29,no,N,54,,173208,30425,PX4
55,,SING,C15,H30,no,N,55,,173208,30425,PX4
56,,SING,C16,C17,no,N,56,,173208,30425,PX4
57,,SING,C16,H31,no,N,57,,173208,30425,PX4
58,,SING,C16,H32,no,N,58,,173208,30425,PX4
59,,SING,C17,C18,no,N,59,,173208,30425,PX4
60,,SING,C17,H33,no,N,60,,173208,30425,PX4
61,,SING,C17,H34,no,N,61,,173208,30425,PX4
62,,SING,C18,C19,no,N,62,,173208,30425,PX4
63,,SING,C18,H35,no,N,63,,173208,30425,PX4
64,,SING,C18,H36,no,N,64,,173208,30425,PX4
65,,SING,C19,C20,no,N,65,,173208,30425,PX4
66,,SING,C19,H37,no,N,66,,173208,30425,PX4
67,,SING,C19,H38,no,N,67,,173208,30425,PX4
68,,SING,C20,C21,no,N,68,,173208,30425,PX4
69,,SING,C20,H39,no,N,69,,173208,30425,PX4
70,,SING,C20,H40,no,N,70,,173208,30425,PX4
71,,SING,C21,C22,no,N,71,,173208,30425,PX4
72,,SING,C21,H41,no,N,72,,173208,30425,PX4
73,,SING,C21,H42,no,N,73,,173208,30425,PX4
74,,SING,C22,H43,no,N,74,,173208,30425,PX4
75,,SING,C22,H44,no,N,75,,173208,30425,PX4
76,,SING,C22,H45,no,N,76,,173208,30425,PX4
77,,SING,O7,C23,no,N,77,,173208,30425,PX4
78,,DOUB,C23,O8,no,N,78,,173208,30425,PX4
79,,SING,C23,C24,no,N,79,,173208,30425,PX4
80,,SING,C24,C25,no,N,80,,173208,30425,PX4
81,,SING,C24,H46,no,N,81,,173208,30425,PX4
82,,SING,C24,H47,no,N,82,,173208,30425,PX4
83,,SING,C25,C26,no,N,83,,173208,30425,PX4
84,,SING,C25,H48,no,N,84,,173208,30425,PX4
85,,SING,C25,H49,no,N,85,,173208,30425,PX4
86,,SING,C26,C27,no,N,86,,173208,30425,PX4
87,,SING,C26,H50,no,N,87,,173208,30425,PX4
88,,SING,C26,H51,no,N,88,,173208,30425,PX4
89,,SING,C27,C28,no,N,89,,173208,30425,PX4
90,,SING,C27,H52,no,N,90,,173208,30425,PX4
91,,SING,C27,H53,no,N,91,,173208,30425,PX4
92,,SING,C28,C29,no,N,92,,173208,30425,PX4
93,,SING,C28,H54,no,N,93,,173208,30425,PX4
94,,SING,C28,H55,no,N,94,,173208,30425,PX4
95,,SING,C29,C30,no,N,95,,173208,30425,PX4
96,,SING,C29,H56,no,N,96,,173208,30425,PX4
97,,SING,C29,H57,no,N,97,,173208,30425,PX4
98,,SING,C30,C31,no,N,98,,173208,30425,PX4
99,,SING,C30,H58,no,N,99,,173208,30425,PX4
100,,SING,C30,H59,no,N,100,,173208,30425,PX4
101,,SING,C31,C32,no,N,101,,173208,30425,PX4
102,,SING,C31,H60,no,N,102,,173208,30425,PX4
103,,SING,C31,H61,no,N,103,,173208,30425,PX4
104,,SING,C32,C33,no,N,104,,173208,30425,PX4
105,,SING,C32,H62,no,N,105,,173208,30425,PX4
106,,SING,C32,H63,no,N,106,,173208,30425,PX4
107,,SING,C33,C34,no,N,107,,173208,30425,PX4
108,,SING,C33,H64,no,N,108,,173208,30425,PX4
109,,SING,C33,H65,no,N,109,,173208,30425,PX4
110,,SING,C34,C35,no,N,110,,173208,30425,PX4
111,,SING,C34,H66,no,N,111,,173208,30425,PX4
112,,SING,C34,H67,no,N,112,,173208,30425,PX4
113,,SING,C35,C36,no,N,113,,173208,30425,PX4
114,,SING,C35,H68,no,N,114,,173208,30425,PX4
115,,SING,C35,H69,no,N,115,,173208,30425,PX4
116,,SING,C36,H70,no,N,116,,173208,30425,PX4
117,,SING,C36,H71,no,N,117,,173208,30425,PX4
118,,SING,C36,H72,no,N,118,,173208,30425,PX4
1,,SING,O1,P1,no,N,1,,173232,30426,PX4
2,,SING,O1,H1P,no,N,2,,173232,30426,PX4
3,,DOUB,O2,P1,no,N,3,,173232,30426,PX4
4,,SING,P1,O3,no,N,4,,173232,30426,PX4
5,,SING,P1,O4,no,N,5,,173232,30426,PX4
6,,SING,O3,C1,no,N,6,,173232,30426,PX4
7,,SING,C1,C2,no,N,7,,173232,30426,PX4
8,,SING,C1,H1,no,N,8,,173232,30426,PX4
9,,SING,C1,H2,no,N,9,,173232,30426,PX4
10,,SING,C2,N1,no,N,10,,173232,30426,PX4
11,,SING,C2,H3,no,N,11,,173232,30426,PX4
12,,SING,C2,H4,no,N,12,,173232,30426,PX4
13,,SING,N1,C3,no,N,13,,173232,30426,PX4
14,,SING,N1,C4,no,N,14,,173232,30426,PX4
15,,SING,N1,C5,no,N,15,,173232,30426,PX4
16,,SING,C3,H5,no,N,16,,173232,30426,PX4
17,,SING,C3,H6,no,N,17,,173232,30426,PX4
18,,SING,C3,H7,no,N,18,,173232,30426,PX4
19,,SING,C4,H8,no,N,19,,173232,30426,PX4
20,,SING,C4,H9,no,N,20,,173232,30426,PX4
21,,SING,C4,H10,no,N,21,,173232,30426,PX4
22,,SING,C5,H11,no,N,22,,173232,30426,PX4
23,,SING,C5,H12,no,N,23,,173232,30426,PX4
24,,SING,C5,H13,no,N,24,,173232,30426,PX4
25,,SING,O4,C6,no,N,25,,173232,30426,PX4
26,,SING,C6,C7,no,N,26,,173232,30426,PX4
27,,SING,C6,H14,no,N,27,,173232,30426,PX4
28,,SING,C6,H15,no,N,28,,173232,30426,PX4
29,,SING,C7,C8,no,N,29,,173232,30426,PX4
30,,SING,C7,O7,no,N,30,,173232,30426,PX4
31,,SING,C7,H16,no,N,31,,173232,30426,PX4
32,,SING,C8,O5,no,N,32,,173232,30426,PX4
33,,SING,C8,H17,no,N,33,,173232,30426,PX4
34,,SING,C8,H18,no,N,34,,173232,30426,PX4
35,,SING,O5,C9,no,N,35,,173232,30426,PX4
36,,DOUB,C9,O6,no,N,36,,173232,30426,PX4
37,,SING,C9,C10,no,N,37,,173232,30426,PX4
38,,SING,C10,C11,no,N,38,,173232,30426,PX4
39,,SING,C10,H19,no,N,39,,173232,30426,PX4
40,,SING,C10,H20,no,N,40,,173232,30426,PX4
41,,SING,C11,C12,no,N,41,,173232,30426,PX4
42,,SING,C11,H21,no,N,42,,173232,30426,PX4
43,,SING,C11,H22,no,N,43,,173232,30426,PX4
44,,SING,C12,C13,no,N,44,,173232,30426,PX4
45,,SING,C12,H23,no,N,45,,173232,30426,PX4
46,,SING,C12,H24,no,N,46,,173232,30426,PX4
47,,SING,C13,C14,no,N,47,,173232,30426,PX4
48,,SING,C13,H25,no,N,48,,173232,30426,PX4
49,,SING,C13,H26,no,N,49,,173232,30426,PX4
50,,SING,C14,C15,no,N,50,,173232,30426,PX4
51,,SING,C14,H27,no,N,51,,173232,30426,PX4
52,,SING,C14,H28,no,N,52,,173232,30426,PX4
53,,SING,C15,C16,no,N,53,,173232,30426,PX4
54,,SING,C15,H29,no,N,54,,173232,30426,PX4
55,,SING,C15,H30,no,N,55,,173232,30426,PX4
56,,SING,C16,C17,no,N,56,,173232,30426,PX4
57,,SING,C16,H31,no,N,57,,173232,30426,PX4
58,,SING,C16,H32,no,N,58,,173232,30426,PX4
59,,SING,C17,C18,no,N,59,,173232,30426,PX4
60,,SING,C17,H33,no,N,60,,173232,30426,PX4
61,,SING,C17,H34,no,N,61,,173232,30426,PX4
62,,SING,C18,C19,no,N,62,,173232,30426,PX4
63,,SING,C18,H35,no,N,63,,173232,30426,PX4
64,,SING,C18,H36,no,N,64,,173232,30426,PX4
65,,SING,C19,C20,no,N,65,,173232,30426,PX4
66,,SING,C19,H37,no,N,66,,173232,30426,PX4
67,,SING,C19,H38,no,N,67,,173232,30426,PX4
68,,SING,C20,C21,no,N,68,,173232,30426,PX4
69,,SING,C20,H39,no,N,69,,173232,30426,PX4
70,,SING,C20,H40,no,N,70,,173232,30426,PX4
71,,SING,C21,C22,no,N,71,,173232,30426,PX4
72,,SING,C21,H41,no,N,72,,173232,30426,PX4
73,,SING,C21,H42,no,N,73,,173232,30426,PX4
74,,SING,C22,H43,no,N,74,,173232,30426,PX4
75,,SING,C22,H44,no,N,75,,173232,30426,PX4
76,,SING,C22,H45,no,N,76,,173232,30426,PX4
77,,SING,O7,C23,no,N,77,,173232,30426,PX4
78,,DOUB,C23,O8,no,N,78,,173232,30426,PX4
79,,SING,C23,C24,no,N,79,,173232,30426,PX4
80,,SING,C24,C25,no,N,80,,173232,30426,PX4
81,,SING,C24,H46,no,N,81,,173232,30426,PX4
82,,SING,C24,H47,no,N,82,,173232,30426,PX4
83,,SING,C25,C26,no,N,83,,173232,30426,PX4
84,,SING,C25,H48,no,N,84,,173232,30426,PX4
85,,SING,C25,H49,no,N,85,,173232,30426,PX4
86,,SING,C26,C27,no,N,86,,173232,30426,PX4
87,,SING,C26,H50,no,N,87,,173232,30426,PX4
88,,SING,C26,H51,no,N,88,,173232,30426,PX4
89,,SING,C27,C28,no,N,89,,173232,30426,PX4
90,,SING,C27,H52,no,N,90,,173232,30426,PX4
91,,SING,C27,H53,no,N,91,,173232,30426,PX4
92,,SING,C28,C29,no,N,92,,173232,30426,PX4
93,,SING,C28,H54,no,N,93,,173232,30426,PX4
94,,SING,C28,H55,no,N,94,,173232,30426,PX4
95,,SING,C29,C30,no,N,95,,173232,30426,PX4
96,,SING,C29,H56,no,N,96,,173232,30426,PX4
97,,SING,C29,H57,no,N,97,,173232,30426,PX4
98,,SING,C30,C31,no,N,98,,173232,30426,PX4
99,,SING,C30,H58,no,N,99,,173232,30426,PX4
100,,SING,C30,H59,no,N,100,,173232,30426,PX4
101,,SING,C31,C32,no,N,101,,173232,30426,PX4
102,,SING,C31,H60,no,N,102,,173232,30426,PX4
103,,SING,C31,H61,no,N,103,,173232,30426,PX4
104,,SING,C32,C33,no,N,104,,173232,30426,PX4
105,,SING,C32,H62,no,N,105,,173232,30426,PX4
106,,SING,C32,H63,no,N,106,,173232,30426,PX4
107,,SING,C33,C34,no,N,107,,173232,30426,PX4
108,,SING,C33,H64,no,N,108,,173232,30426,PX4
109,,SING,C33,H65,no,N,109,,173232,30426,PX4
110,,SING,C34,C35,no,N,110,,173232,30426,PX4
111,,SING,C34,H66,no,N,111,,173232,30426,PX4
112,,SING,C34,H67,no,N,112,,173232,30426,PX4
113,,SING,C35,C36,no,N,113,,173232,30426,PX4
114,,SING,C35,H68,no,N,114,,173232,30426,PX4
115,,SING,C35,H69,no,N,115,,173232,30426,PX4
116,,SING,C36,H70,no,N,116,,173232,30426,PX4
117,,SING,C36,H71,no,N,117,,173232,30426,PX4
118,,SING,C36,H72,no,N,118,,173232,30426,PX4
1,,SING,N,CA,no,N,1,,173316,30431,DPN
2,,SING,N,H,no,N,2,,173316,30431,DPN
3,,SING,N,H2,no,N,3,,173316,30431,DPN
4,,SING,CA,C,no,N,4,,173316,30431,DPN
5,,SING,CA,CB,no,N,5,,173316,30431,DPN
6,,SING,CA,HA,no,N,6,,173316,30431,DPN
7,,DOUB,C,O,no,N,7,,173316,30431,DPN
8,,SING,C,OXT,no,N,8,,173316,30431,DPN
9,,SING,OXT,HXT,no,N,9,,173316,30431,DPN
10,,SING,CB,CG,no,N,10,,173316,30431,DPN
11,,SING,CB,HB2,no,N,11,,173316,30431,DPN
12,,SING,CB,HB3,no,N,12,,173316,30431,DPN
13,,DOUB,CG,CD1,yes,N,13,,173316,30431,DPN
14,,SING,CG,CD2,yes,N,14,,173316,30431,DPN
15,,SING,CD1,CE1,yes,N,15,,173316,30431,DPN
16,,SING,CD1,HD1,no,N,16,,173316,30431,DPN
17,,DOUB,CD2,CE2,yes,N,17,,173316,30431,DPN
18,,SING,CD2,HD2,no,N,18,,173316,30431,DPN
19,,DOUB,CE1,CZ,yes,N,19,,173316,30431,DPN
20,,SING,CE1,HE1,no,N,20,,173316,30431,DPN
21,,SING,CE2,CZ,yes,N,21,,173316,30431,DPN
22,,SING,CE2,HE2,no,N,22,,173316,30431,DPN
23,,SING,CZ,HZ,no,N,23,,173316,30431,DPN
1,,SING,N,HN1,no,N,1,,173527,30443,NH2
2,,SING,N,HN2,no,N,2,,173527,30443,NH2
1,,SING,N,HN1,no,N,1,,173589,30446,NH2
2,,SING,N,HN2,no,N,2,,173589,30446,NH2
1,,SING,N,HN1,no,N,1,,173604,30447,NH2
2,,SING,N,HN2,no,N,2,,173604,30447,NH2
1,,SING,N,HN1,no,N,1,,173619,30448,NH2
2,,SING,N,HN2,no,N,2,,173619,30448,NH2
1,,SING,N,HN1,no,N,1,,173635,30449,NH2
2,,SING,N,HN2,no,N,2,,173635,30449,NH2
1,,SING,N,HN1,no,N,1,,173671,30451,NH2
2,,SING,N,HN2,no,N,2,,173671,30451,NH2
1,,DOUB,O,C,no,N,1,,173694,30452,4J5
2,,SING,CA,C,no,N,2,,173694,30452,4J5
3,,SING,C,OXT,no,N,3,,173694,30452,4J5
4,,SING,CA,N,no,N,4,,173694,30452,4J5
5,,SING,N,H,no,N,5,,173694,30452,4J5
6,,SING,N,HNA,no,N,6,,173694,30452,4J5
7,,SING,OXT,HXT,no,N,7,,173694,30452,4J5
8,,SING,HA,CA,no,N,8,,173694,30452,4J5
9,,SING,CA,CB,no,N,9,,173694,30452,4J5
10,,SING,HB2,CB,no,N,10,,173694,30452,4J5
11,,SING,CB,HB3,no,N,11,,173694,30452,4J5
12,,SING,CB,CG,no,N,12,,173694,30452,4J5
13,,SING,HD,ND,no,N,13,,173694,30452,4J5
14,,SING,CE,ND,no,N,14,,173694,30452,4J5
15,,SING,ND,CG,no,N,15,,173694,30452,4J5
16,,SING,NH1,CE,no,N,16,,173694,30452,4J5
17,,DOUB,CE,NH2,no,N,17,,173694,30452,4J5
18,,SING,CG,HG3,no,N,18,,173694,30452,4J5
19,,SING,CG,HG2,no,N,19,,173694,30452,4J5
20,,SING,HH11,NH1,no,N,20,,173694,30452,4J5
21,,SING,HH12,NH1,no,N,21,,173694,30452,4J5
22,,SING,HH22,NH2,no,N,22,,173694,30452,4J5
23,,SING,NH2,HH21,no,N,23,,173694,30452,4J5
1,,SING,N,CA,no,N,1,,173695,30452,DAB
2,,SING,N,H,no,N,2,,173695,30452,DAB
3,,SING,N,H2,no,N,3,,173695,30452,DAB
4,,SING,CA,C,no,N,4,,173695,30452,DAB
5,,SING,CA,CB,no,N,5,,173695,30452,DAB
6,,SING,CA,HA,no,N,6,,173695,30452,DAB
7,,DOUB,C,O,no,N,7,,173695,30452,DAB
8,,SING,C,OXT,no,N,8,,173695,30452,DAB
9,,SING,CB,CG,no,N,9,,173695,30452,DAB
10,,SING,CB,HB2,no,N,10,,173695,30452,DAB
11,,SING,CB,HB3,no,N,11,,173695,30452,DAB
12,,SING,CG,ND,no,N,12,,173695,30452,DAB
13,,SING,CG,HG2,no,N,13,,173695,30452,DAB
14,,SING,CG,HG3,no,N,14,,173695,30452,DAB
15,,SING,ND,HD1,no,N,15,,173695,30452,DAB
16,,SING,ND,HD2,no,N,16,,173695,30452,DAB
17,,SING,OXT,HXT,no,N,17,,173695,30452,DAB
1,,SING,N,CA,no,N,1,,173696,30452,DPR
2,,SING,N,CD,no,N,2,,173696,30452,DPR
3,,SING,N,H,no,N,3,,173696,30452,DPR
4,,SING,CA,CB,no,N,4,,173696,30452,DPR
5,,SING,CA,C,no,N,5,,173696,30452,DPR
6,,SING,CA,HA,no,N,6,,173696,30452,DPR
7,,SING,CB,CG,no,N,7,,173696,30452,DPR
8,,SING,CB,HB2,no,N,8,,173696,30452,DPR
9,,SING,CB,HB3,no,N,9,,173696,30452,DPR
10,,SING,CG,CD,no,N,10,,173696,30452,DPR
11,,SING,CG,HG2,no,N,11,,173696,30452,DPR
12,,SING,CG,HG3,no,N,12,,173696,30452,DPR
13,,SING,CD,HD2,no,N,13,,173696,30452,DPR
14,,SING,CD,HD3,no,N,14,,173696,30452,DPR
15,,DOUB,C,O,no,N,15,,173696,30452,DPR
16,,SING,C,OXT,no,N,16,,173696,30452,DPR
17,,SING,OXT,HXT,no,N,17,,173696,30452,DPR
1,,DOUB,C,O,no,N,1,,173719,30453,ACE
2,,SING,C,CH3,no,N,2,,173719,30453,ACE
3,,SING,C,H,no,N,3,,173719,30453,ACE
4,,SING,CH3,H1,no,N,4,,173719,30453,ACE
5,,SING,CH3,H2,no,N,5,,173719,30453,ACE
6,,SING,CH3,H3,no,N,6,,173719,30453,ACE
1,,SING,N,CA,no,N,1,,173720,30453,DAL
2,,SING,N,H,no,N,2,,173720,30453,DAL
3,,SING,N,H2,no,N,3,,173720,30453,DAL
4,,SING,CA,CB,no,N,4,,173720,30453,DAL
5,,SING,CA,C,no,N,5,,173720,30453,DAL
6,,SING,CA,HA,no,N,6,,173720,30453,DAL
7,,SING,CB,HB1,no,N,7,,173720,30453,DAL
8,,SING,CB,HB2,no,N,8,,173720,30453,DAL
9,,SING,CB,HB3,no,N,9,,173720,30453,DAL
10,,DOUB,C,O,no,N,10,,173720,30453,DAL
11,,SING,C,OXT,no,N,11,,173720,30453,DAL
12,,SING,OXT,HXT,no,N,12,,173720,30453,DAL
1,,SING,N,CA,no,N,1,,173721,30453,NVA
2,,SING,N,H,no,N,2,,173721,30453,NVA
3,,SING,N,H2,no,N,3,,173721,30453,NVA
4,,SING,CA,CB,no,N,4,,173721,30453,NVA
5,,SING,CA,C,no,N,5,,173721,30453,NVA
6,,SING,CA,HA,no,N,6,,173721,30453,NVA
7,,SING,CB,CG,no,N,7,,173721,30453,NVA
8,,SING,CB,HB2,no,N,8,,173721,30453,NVA
9,,SING,CB,HB3,no,N,9,,173721,30453,NVA
10,,SING,CG,CD,no,N,10,,173721,30453,NVA
11,,SING,CG,HG2,no,N,11,,173721,30453,NVA
12,,SING,CG,HG3,no,N,12,,173721,30453,NVA
13,,SING,CD,HD1,no,N,13,,173721,30453,NVA
14,,SING,CD,HD2,no,N,14,,173721,30453,NVA
15,,SING,CD,HD3,no,N,15,,173721,30453,NVA
16,,DOUB,C,O,no,N,16,,173721,30453,NVA
17,,SING,C,OXT,no,N,17,,173721,30453,NVA
18,,SING,OXT,HXT,no,N,18,,173721,30453,NVA
1,,SING,N,HN1,no,N,1,,173722,30453,NH2
2,,SING,N,HN2,no,N,2,,173722,30453,NH2
1,,SING,C10,C9,no,N,1,,174176,30478,2VN
2,,SING,C10,C11,no,N,2,,174176,30478,2VN
3,,SING,C14,C15,no,N,3,,174176,30478,2VN
4,,SING,C14,C13,no,N,4,,174176,30478,2VN
5,,SING,N1,C2,no,N,5,,174176,30478,2VN
6,,SING,N1,C7,no,N,6,,174176,30478,2VN
7,,SING,C9,N2,no,N,7,,174176,30478,2VN
8,,DOUB,O3,C27,no,N,8,,174176,30478,2VN
9,,SING,C3,C2,no,N,9,,174176,30478,2VN
10,,SING,C3,C4,no,N,10,,174176,30478,2VN
11,,SING,C11,C12,no,N,11,,174176,30478,2VN
12,,SING,C15,C16,no,N,12,,174176,30478,2VN
13,,SING,C2,C1,no,N,13,,174176,30478,2VN
14,,SING,O2,C27,no,N,14,,174176,30478,2VN
15,,SING,C27,C26,no,N,15,,174176,30478,2VN
16,,SING,C13,C12,no,N,16,,174176,30478,2VN
17,,SING,C13,C18,no,N,17,,174176,30478,2VN
18,,DOUB,C7,O1,no,N,18,,174176,30478,2VN
19,,SING,C7,N2,no,N,19,,174176,30478,2VN
20,,SING,C29,C26,no,N,20,,174176,30478,2VN
21,,SING,C28,C26,no,N,21,,174176,30478,2VN
22,,SING,N2,C8,no,N,22,,174176,30478,2VN
23,,SING,C26,S1,no,N,23,,174176,30478,2VN
24,,SING,C4,C55,no,N,24,,174176,30478,2VN
25,,SING,C16,C17,no,N,25,,174176,30478,2VN
26,,SING,C18,C17,no,N,26,,174176,30478,2VN
27,,SING,C1,C6,no,N,27,,174176,30478,2VN
28,,SING,C8,C19,no,N,28,,174176,30478,2VN
29,,SING,C55,C6,no,N,29,,174176,30478,2VN
30,,SING,S1,C23,no,N,30,,174176,30478,2VN
31,,DOUB,C22,C23,yes,N,31,,174176,30478,2VN
32,,SING,C22,C21,yes,N,32,,174176,30478,2VN
33,,SING,C23,C24,yes,N,33,,174176,30478,2VN
34,,DOUB,C21,C20,yes,N,34,,174176,30478,2VN
35,,DOUB,C24,C25,yes,N,35,,174176,30478,2VN
36,,SING,C20,C25,yes,N,36,,174176,30478,2VN
37,,SING,C20,C19,no,N,37,,174176,30478,2VN
38,,SING,C1,H2,no,N,38,,174176,30478,2VN
39,,SING,C1,H1,no,N,39,,174176,30478,2VN
40,,SING,C10,H18,no,N,40,,174176,30478,2VN
41,,SING,C10,H17,no,N,41,,174176,30478,2VN
42,,SING,C11,H20,no,N,42,,174176,30478,2VN
43,,SING,C11,H19,no,N,43,,174176,30478,2VN
44,,SING,C12,H22,no,N,44,,174176,30478,2VN
45,,SING,C12,H21,no,N,45,,174176,30478,2VN
46,,SING,C13,H23,no,N,46,,174176,30478,2VN
47,,SING,C14,H24,no,N,47,,174176,30478,2VN
48,,SING,C14,H25,no,N,48,,174176,30478,2VN
49,,SING,C15,H26,no,N,49,,174176,30478,2VN
50,,SING,C15,H27,no,N,50,,174176,30478,2VN
51,,SING,C16,H28,no,N,51,,174176,30478,2VN
52,,SING,C16,H29,no,N,52,,174176,30478,2VN
53,,SING,C17,H31,no,N,53,,174176,30478,2VN
54,,SING,C17,H30,no,N,54,,174176,30478,2VN
55,,SING,C18,H32,no,N,55,,174176,30478,2VN
56,,SING,C18,H33,no,N,56,,174176,30478,2VN
57,,SING,C19,H35,no,N,57,,174176,30478,2VN
58,,SING,C19,H34,no,N,58,,174176,30478,2VN
59,,SING,C2,H3,no,N,59,,174176,30478,2VN
60,,SING,C21,HK6,no,N,60,,174176,30478,2VN
61,,SING,C22,HL7,no,N,61,,174176,30478,2VN
62,,SING,C24,HL8,no,N,62,,174176,30478,2VN
63,,SING,C25,HK9,no,N,63,,174176,30478,2VN
64,,SING,C28,HJ2,no,N,64,,174176,30478,2VN
65,,SING,C28,HJ1,no,N,65,,174176,30478,2VN
66,,SING,C28,HJ0,no,N,66,,174176,30478,2VN
67,,SING,C29,HJ4,no,N,67,,174176,30478,2VN
68,,SING,C29,HJ5,no,N,68,,174176,30478,2VN
69,,SING,C29,HJ3,no,N,69,,174176,30478,2VN
70,,SING,C3,H4,no,N,70,,174176,30478,2VN
71,,SING,C3,H5,no,N,71,,174176,30478,2VN
72,,SING,C4,H7,no,N,72,,174176,30478,2VN
73,,SING,C4,H6,no,N,73,,174176,30478,2VN
74,,SING,C55,H9,no,N,74,,174176,30478,2VN
75,,SING,C55,H8,no,N,75,,174176,30478,2VN
76,,SING,C6,H11,no,N,76,,174176,30478,2VN
77,,SING,C6,H10,no,N,77,,174176,30478,2VN
78,,SING,C8,H14,no,N,78,,174176,30478,2VN
79,,SING,C8,H13,no,N,79,,174176,30478,2VN
80,,SING,C9,H16,no,N,80,,174176,30478,2VN
81,,SING,C9,H15,no,N,81,,174176,30478,2VN
82,,SING,N1,H12,no,N,82,,174176,30478,2VN
83,,SING,O2,H36,no,N,83,,174176,30478,2VN
1,,SING,N,HN1,no,N,1,,174197,30479,NH2
2,,SING,N,HN2,no,N,2,,174197,30479,NH2
1,,SING,N,HN1,no,N,1,,174255,30482,NH2
2,,SING,N,HN2,no,N,2,,174255,30482,NH2
1,,SING,N,HN1,no,N,1,,174277,30483,NH2
2,,SING,N,HN2,no,N,2,,174277,30483,NH2
1,,SING,N,CA,no,N,1,,174345,30486,DPR
2,,SING,N,CD,no,N,2,,174345,30486,DPR
3,,SING,N,H,no,N,3,,174345,30486,DPR
4,,SING,CA,CB,no,N,4,,174345,30486,DPR
5,,SING,CA,C,no,N,5,,174345,30486,DPR
6,,SING,CA,HA,no,N,6,,174345,30486,DPR
7,,SING,CB,CG,no,N,7,,174345,30486,DPR
8,,SING,CB,HB2,no,N,8,,174345,30486,DPR
9,,SING,CB,HB3,no,N,9,,174345,30486,DPR
10,,SING,CG,CD,no,N,10,,174345,30486,DPR
11,,SING,CG,HG2,no,N,11,,174345,30486,DPR
12,,SING,CG,HG3,no,N,12,,174345,30486,DPR
13,,SING,CD,HD2,no,N,13,,174345,30486,DPR
14,,SING,CD,HD3,no,N,14,,174345,30486,DPR
15,,DOUB,C,O,no,N,15,,174345,30486,DPR
16,,SING,C,OXT,no,N,16,,174345,30486,DPR
17,,SING,OXT,HXT,no,N,17,,174345,30486,DPR
1,,SING,N,CA,no,N,1,,174362,30487,DPR
2,,SING,N,CD,no,N,2,,174362,30487,DPR
3,,SING,N,H,no,N,3,,174362,30487,DPR
4,,SING,CA,CB,no,N,4,,174362,30487,DPR
5,,SING,CA,C,no,N,5,,174362,30487,DPR
6,,SING,CA,HA,no,N,6,,174362,30487,DPR
7,,SING,CB,CG,no,N,7,,174362,30487,DPR
8,,SING,CB,HB2,no,N,8,,174362,30487,DPR
9,,SING,CB,HB3,no,N,9,,174362,30487,DPR
10,,SING,CG,CD,no,N,10,,174362,30487,DPR
11,,SING,CG,HG2,no,N,11,,174362,30487,DPR
12,,SING,CG,HG3,no,N,12,,174362,30487,DPR
13,,SING,CD,HD2,no,N,13,,174362,30487,DPR
14,,SING,CD,HD3,no,N,14,,174362,30487,DPR
15,,DOUB,C,O,no,N,15,,174362,30487,DPR
16,,SING,C,OXT,no,N,16,,174362,30487,DPR
17,,SING,OXT,HXT,no,N,17,,174362,30487,DPR
1,,SING,N,CA,no,N,1,,174379,30488,DPR
2,,SING,N,CD,no,N,2,,174379,30488,DPR
3,,SING,N,H,no,N,3,,174379,30488,DPR
4,,SING,CA,CB,no,N,4,,174379,30488,DPR
5,,SING,CA,C,no,N,5,,174379,30488,DPR
6,,SING,CA,HA,no,N,6,,174379,30488,DPR
7,,SING,CB,CG,no,N,7,,174379,30488,DPR
8,,SING,CB,HB2,no,N,8,,174379,30488,DPR
9,,SING,CB,HB3,no,N,9,,174379,30488,DPR
10,,SING,CG,CD,no,N,10,,174379,30488,DPR
11,,SING,CG,HG2,no,N,11,,174379,30488,DPR
12,,SING,CG,HG3,no,N,12,,174379,30488,DPR
13,,SING,CD,HD2,no,N,13,,174379,30488,DPR
14,,SING,CD,HD3,no,N,14,,174379,30488,DPR
15,,DOUB,C,O,no,N,15,,174379,30488,DPR
16,,SING,C,OXT,no,N,16,,174379,30488,DPR
17,,SING,OXT,HXT,no,N,17,,174379,30488,DPR
1,,SING,N,CA,no,N,1,,174396,30489,DPR
2,,SING,N,CD,no,N,2,,174396,30489,DPR
3,,SING,N,H,no,N,3,,174396,30489,DPR
4,,SING,CA,CB,no,N,4,,174396,30489,DPR
5,,SING,CA,C,no,N,5,,174396,30489,DPR
6,,SING,CA,HA,no,N,6,,174396,30489,DPR
7,,SING,CB,CG,no,N,7,,174396,30489,DPR
8,,SING,CB,HB2,no,N,8,,174396,30489,DPR
9,,SING,CB,HB3,no,N,9,,174396,30489,DPR
10,,SING,CG,CD,no,N,10,,174396,30489,DPR
11,,SING,CG,HG2,no,N,11,,174396,30489,DPR
12,,SING,CG,HG3,no,N,12,,174396,30489,DPR
13,,SING,CD,HD2,no,N,13,,174396,30489,DPR
14,,SING,CD,HD3,no,N,14,,174396,30489,DPR
15,,DOUB,C,O,no,N,15,,174396,30489,DPR
16,,SING,C,OXT,no,N,16,,174396,30489,DPR
17,,SING,OXT,HXT,no,N,17,,174396,30489,DPR
1,,SING,N,CA,no,N,1,,174413,30490,DPR
2,,SING,N,CD,no,N,2,,174413,30490,DPR
3,,SING,N,H,no,N,3,,174413,30490,DPR
4,,SING,CA,CB,no,N,4,,174413,30490,DPR
5,,SING,CA,C,no,N,5,,174413,30490,DPR
6,,SING,CA,HA,no,N,6,,174413,30490,DPR
7,,SING,CB,CG,no,N,7,,174413,30490,DPR
8,,SING,CB,HB2,no,N,8,,174413,30490,DPR
9,,SING,CB,HB3,no,N,9,,174413,30490,DPR
10,,SING,CG,CD,no,N,10,,174413,30490,DPR
11,,SING,CG,HG2,no,N,11,,174413,30490,DPR
12,,SING,CG,HG3,no,N,12,,174413,30490,DPR
13,,SING,CD,HD2,no,N,13,,174413,30490,DPR
14,,SING,CD,HD3,no,N,14,,174413,30490,DPR
15,,DOUB,C,O,no,N,15,,174413,30490,DPR
16,,SING,C,OXT,no,N,16,,174413,30490,DPR
17,,SING,OXT,HXT,no,N,17,,174413,30490,DPR
1,,SING,N,CA,no,N,1,,174548,30496,DPR
2,,SING,N,CD,no,N,2,,174548,30496,DPR
3,,SING,N,H,no,N,3,,174548,30496,DPR
4,,SING,CA,CB,no,N,4,,174548,30496,DPR
5,,SING,CA,C,no,N,5,,174548,30496,DPR
6,,SING,CA,HA,no,N,6,,174548,30496,DPR
7,,SING,CB,CG,no,N,7,,174548,30496,DPR
8,,SING,CB,HB2,no,N,8,,174548,30496,DPR
9,,SING,CB,HB3,no,N,9,,174548,30496,DPR
10,,SING,CG,CD,no,N,10,,174548,30496,DPR
11,,SING,CG,HG2,no,N,11,,174548,30496,DPR
12,,SING,CG,HG3,no,N,12,,174548,30496,DPR
13,,SING,CD,HD2,no,N,13,,174548,30496,DPR
14,,SING,CD,HD3,no,N,14,,174548,30496,DPR
15,,DOUB,C,O,no,N,15,,174548,30496,DPR
16,,SING,C,OXT,no,N,16,,174548,30496,DPR
17,,SING,OXT,HXT,no,N,17,,174548,30496,DPR
1,,SING,N,HN1,no,N,1,,174549,30496,NH2
2,,SING,N,HN2,no,N,2,,174549,30496,NH2
1,,SING,N,CA,no,N,1,,174550,30496,AIB
2,,SING,N,H,no,N,2,,174550,30496,AIB
3,,SING,N,H2,no,N,3,,174550,30496,AIB
4,,SING,CA,C,no,N,4,,174550,30496,AIB
5,,SING,CA,CB1,no,N,5,,174550,30496,AIB
6,,SING,CA,CB2,no,N,6,,174550,30496,AIB
7,,DOUB,C,O,no,N,7,,174550,30496,AIB
8,,SING,C,OXT,no,N,8,,174550,30496,AIB
9,,SING,OXT,HO2,no,N,9,,174550,30496,AIB
10,,SING,CB1,HB11,no,N,10,,174550,30496,AIB
11,,SING,CB1,HB12,no,N,11,,174550,30496,AIB
12,,SING,CB1,HB13,no,N,12,,174550,30496,AIB
13,,SING,CB2,HB21,no,N,13,,174550,30496,AIB
14,,SING,CB2,HB22,no,N,14,,174550,30496,AIB
15,,SING,CB2,HB23,no,N,15,,174550,30496,AIB
1,,SING,N,CA,no,N,1,,174566,30497,ORN
2,,SING,N,H,no,N,2,,174566,30497,ORN
3,,SING,N,H2,no,N,3,,174566,30497,ORN
4,,SING,CA,CB,no,N,4,,174566,30497,ORN
5,,SING,CA,C,no,N,5,,174566,30497,ORN
6,,SING,CA,HA,no,N,6,,174566,30497,ORN
7,,SING,CB,CG,no,N,7,,174566,30497,ORN
8,,SING,CB,HB2,no,N,8,,174566,30497,ORN
9,,SING,CB,HB3,no,N,9,,174566,30497,ORN
10,,SING,CG,CD,no,N,10,,174566,30497,ORN
11,,SING,CG,HG2,no,N,11,,174566,30497,ORN
12,,SING,CG,HG3,no,N,12,,174566,30497,ORN
13,,SING,CD,NE,no,N,13,,174566,30497,ORN
14,,SING,CD,HD2,no,N,14,,174566,30497,ORN
15,,SING,CD,HD3,no,N,15,,174566,30497,ORN
16,,SING,NE,HE1,no,N,16,,174566,30497,ORN
17,,SING,NE,HE2,no,N,17,,174566,30497,ORN
18,,DOUB,C,O,no,N,18,,174566,30497,ORN
19,,SING,C,OXT,no,N,19,,174566,30497,ORN
20,,SING,OXT,HXT,no,N,20,,174566,30497,ORN
1,,SING,N,CA,no,N,1,,174567,30497,DPR
2,,SING,N,CD,no,N,2,,174567,30497,DPR
3,,SING,N,H,no,N,3,,174567,30497,DPR
4,,SING,CA,CB,no,N,4,,174567,30497,DPR
5,,SING,CA,C,no,N,5,,174567,30497,DPR
6,,SING,CA,HA,no,N,6,,174567,30497,DPR
7,,SING,CB,CG,no,N,7,,174567,30497,DPR
8,,SING,CB,HB2,no,N,8,,174567,30497,DPR
9,,SING,CB,HB3,no,N,9,,174567,30497,DPR
10,,SING,CG,CD,no,N,10,,174567,30497,DPR
11,,SING,CG,HG2,no,N,11,,174567,30497,DPR
12,,SING,CG,HG3,no,N,12,,174567,30497,DPR
13,,SING,CD,HD2,no,N,13,,174567,30497,DPR
14,,SING,CD,HD3,no,N,14,,174567,30497,DPR
15,,DOUB,C,O,no,N,15,,174567,30497,DPR
16,,SING,C,OXT,no,N,16,,174567,30497,DPR
17,,SING,OXT,HXT,no,N,17,,174567,30497,DPR
1,,SING,N,HN1,no,N,1,,174568,30497,NH2
2,,SING,N,HN2,no,N,2,,174568,30497,NH2
1,,SING,N,CB,no,N,1,,174584,30498,B3E
2,,SING,N,H,no,N,2,,174584,30498,B3E
3,,SING,N,H2,no,N,3,,174584,30498,B3E
4,,SING,CB,CG,no,N,4,,174584,30498,B3E
5,,SING,CB,CA,no,N,5,,174584,30498,B3E
6,,SING,CB,HB,no,N,6,,174584,30498,B3E
7,,SING,CG,CD,no,N,7,,174584,30498,B3E
8,,SING,CG,HG2,no,N,8,,174584,30498,B3E
9,,SING,CG,HG3,no,N,9,,174584,30498,B3E
10,,SING,CD,CE,no,N,10,,174584,30498,B3E
11,,SING,CD,HD2,no,N,11,,174584,30498,B3E
12,,SING,CD,HD3,no,N,12,,174584,30498,B3E
13,,DOUB,CE,OF2,no,N,13,,174584,30498,B3E
14,,SING,CE,OF1,no,N,14,,174584,30498,B3E
15,,SING,OF1,HOF1,no,N,15,,174584,30498,B3E
16,,SING,CA,C,no,N,16,,174584,30498,B3E
17,,SING,CA,HA1,no,N,17,,174584,30498,B3E
18,,SING,CA,HA2,no,N,18,,174584,30498,B3E
19,,SING,C,OXT,no,N,19,,174584,30498,B3E
20,,DOUB,C,O,no,N,20,,174584,30498,B3E
21,,SING,OXT,HXT,no,N,21,,174584,30498,B3E
1,,SING,N,CB,no,N,1,,174585,30498,B3K
2,,SING,N,H,no,N,2,,174585,30498,B3K
3,,SING,N,H2,no,N,3,,174585,30498,B3K
4,,SING,CB,CG,no,N,4,,174585,30498,B3K
5,,SING,CB,CA,no,N,5,,174585,30498,B3K
6,,SING,CB,HB,no,N,6,,174585,30498,B3K
7,,SING,CG,CD,no,N,7,,174585,30498,B3K
8,,SING,CG,HG2,no,N,8,,174585,30498,B3K
9,,SING,CG,HG3,no,N,9,,174585,30498,B3K
10,,SING,CD,CE,no,N,10,,174585,30498,B3K
11,,SING,CD,HD2,no,N,11,,174585,30498,B3K
12,,SING,CD,HD3,no,N,12,,174585,30498,B3K
13,,SING,CE,CF,no,N,13,,174585,30498,B3K
14,,SING,CE,HE2,no,N,14,,174585,30498,B3K
15,,SING,CE,HE3,no,N,15,,174585,30498,B3K
16,,SING,CF,NZ,no,N,16,,174585,30498,B3K
17,,SING,CF,HF1,no,N,17,,174585,30498,B3K
18,,SING,CF,HF2,no,N,18,,174585,30498,B3K
19,,SING,NZ,HNZ1,no,N,19,,174585,30498,B3K
20,,SING,NZ,HNZ2,no,N,20,,174585,30498,B3K
21,,SING,CA,C,no,N,21,,174585,30498,B3K
22,,SING,CA,HA1,no,N,22,,174585,30498,B3K
23,,SING,CA,HA2,no,N,23,,174585,30498,B3K
24,,SING,C,OXT,no,N,24,,174585,30498,B3K
25,,DOUB,C,O,no,N,25,,174585,30498,B3K
26,,SING,OXT,HXT,no,N,26,,174585,30498,B3K
1,,SING,N,CN,no,N,1,,174586,30498,MVA
2,,SING,N,CA,no,N,2,,174586,30498,MVA
3,,SING,N,H,no,N,3,,174586,30498,MVA
4,,SING,CN,HN1,no,N,4,,174586,30498,MVA
5,,SING,CN,HN2,no,N,5,,174586,30498,MVA
6,,SING,CN,HN3,no,N,6,,174586,30498,MVA
7,,SING,CA,CB,no,N,7,,174586,30498,MVA
8,,SING,CA,C,no,N,8,,174586,30498,MVA
9,,SING,CA,HA,no,N,9,,174586,30498,MVA
10,,SING,CB,CG1,no,N,10,,174586,30498,MVA
11,,SING,CB,CG2,no,N,11,,174586,30498,MVA
12,,SING,CB,HB,no,N,12,,174586,30498,MVA
13,,SING,CG1,HG11,no,N,13,,174586,30498,MVA
14,,SING,CG1,HG12,no,N,14,,174586,30498,MVA
15,,SING,CG1,HG13,no,N,15,,174586,30498,MVA
16,,SING,CG2,HG21,no,N,16,,174586,30498,MVA
17,,SING,CG2,HG22,no,N,17,,174586,30498,MVA
18,,SING,CG2,HG23,no,N,18,,174586,30498,MVA
19,,DOUB,C,O,no,N,19,,174586,30498,MVA
20,,SING,C,OXT,no,N,20,,174586,30498,MVA
21,,SING,OXT,HXT,no,N,21,,174586,30498,MVA
1,,SING,N,CA,no,N,1,,174587,30498,AIB
2,,SING,N,H,no,N,2,,174587,30498,AIB
3,,SING,N,H2,no,N,3,,174587,30498,AIB
4,,SING,CA,C,no,N,4,,174587,30498,AIB
5,,SING,CA,CB1,no,N,5,,174587,30498,AIB
6,,SING,CA,CB2,no,N,6,,174587,30498,AIB
7,,DOUB,C,O,no,N,7,,174587,30498,AIB
8,,SING,C,OXT,no,N,8,,174587,30498,AIB
9,,SING,OXT,HO2,no,N,9,,174587,30498,AIB
10,,SING,CB1,HB11,no,N,10,,174587,30498,AIB
11,,SING,CB1,HB12,no,N,11,,174587,30498,AIB
12,,SING,CB1,HB13,no,N,12,,174587,30498,AIB
13,,SING,CB2,HB21,no,N,13,,174587,30498,AIB
14,,SING,CB2,HB22,no,N,14,,174587,30498,AIB
15,,SING,CB2,HB23,no,N,15,,174587,30498,AIB
1,,SING,N,CA,no,N,1,,174588,30498,DPR
2,,SING,N,CD,no,N,2,,174588,30498,DPR
3,,SING,N,H,no,N,3,,174588,30498,DPR
4,,SING,CA,CB,no,N,4,,174588,30498,DPR
5,,SING,CA,C,no,N,5,,174588,30498,DPR
6,,SING,CA,HA,no,N,6,,174588,30498,DPR
7,,SING,CB,CG,no,N,7,,174588,30498,DPR
8,,SING,CB,HB2,no,N,8,,174588,30498,DPR
9,,SING,CB,HB3,no,N,9,,174588,30498,DPR
10,,SING,CG,CD,no,N,10,,174588,30498,DPR
11,,SING,CG,HG2,no,N,11,,174588,30498,DPR
12,,SING,CG,HG3,no,N,12,,174588,30498,DPR
13,,SING,CD,HD2,no,N,13,,174588,30498,DPR
14,,SING,CD,HD3,no,N,14,,174588,30498,DPR
15,,DOUB,C,O,no,N,15,,174588,30498,DPR
16,,SING,C,OXT,no,N,16,,174588,30498,DPR
17,,SING,OXT,HXT,no,N,17,,174588,30498,DPR
1,,SING,N,HN1,no,N,1,,174589,30498,NH2
2,,SING,N,HN2,no,N,2,,174589,30498,NH2
1,,SING,N,CA,no,N,1,,174605,30499,DPR
2,,SING,N,CD,no,N,2,,174605,30499,DPR
3,,SING,N,H,no,N,3,,174605,30499,DPR
4,,SING,CA,CB,no,N,4,,174605,30499,DPR
5,,SING,CA,C,no,N,5,,174605,30499,DPR
6,,SING,CA,HA,no,N,6,,174605,30499,DPR
7,,SING,CB,CG,no,N,7,,174605,30499,DPR
8,,SING,CB,HB2,no,N,8,,174605,30499,DPR
9,,SING,CB,HB3,no,N,9,,174605,30499,DPR
10,,SING,CG,CD,no,N,10,,174605,30499,DPR
11,,SING,CG,HG2,no,N,11,,174605,30499,DPR
12,,SING,CG,HG3,no,N,12,,174605,30499,DPR
13,,SING,CD,HD2,no,N,13,,174605,30499,DPR
14,,SING,CD,HD3,no,N,14,,174605,30499,DPR
15,,DOUB,C,O,no,N,15,,174605,30499,DPR
16,,SING,C,OXT,no,N,16,,174605,30499,DPR
17,,SING,OXT,HXT,no,N,17,,174605,30499,DPR
1,,SING,N,HN1,no,N,1,,174606,30499,NH2
2,,SING,N,HN2,no,N,2,,174606,30499,NH2
1,,SING,N,CA,no,N,1,,174607,30499,AIB
2,,SING,N,H,no,N,2,,174607,30499,AIB
3,,SING,N,H2,no,N,3,,174607,30499,AIB
4,,SING,CA,C,no,N,4,,174607,30499,AIB
5,,SING,CA,CB1,no,N,5,,174607,30499,AIB
6,,SING,CA,CB2,no,N,6,,174607,30499,AIB
7,,DOUB,C,O,no,N,7,,174607,30499,AIB
8,,SING,C,OXT,no,N,8,,174607,30499,AIB
9,,SING,OXT,HO2,no,N,9,,174607,30499,AIB
10,,SING,CB1,HB11,no,N,10,,174607,30499,AIB
11,,SING,CB1,HB12,no,N,11,,174607,30499,AIB
12,,SING,CB1,HB13,no,N,12,,174607,30499,AIB
13,,SING,CB2,HB21,no,N,13,,174607,30499,AIB
14,,SING,CB2,HB22,no,N,14,,174607,30499,AIB
15,,SING,CB2,HB23,no,N,15,,174607,30499,AIB
1,,SING,N,CN,no,N,1,,174608,30499,MVA
2,,SING,N,CA,no,N,2,,174608,30499,MVA
3,,SING,N,H,no,N,3,,174608,30499,MVA
4,,SING,CN,HN1,no,N,4,,174608,30499,MVA
5,,SING,CN,HN2,no,N,5,,174608,30499,MVA
6,,SING,CN,HN3,no,N,6,,174608,30499,MVA
7,,SING,CA,CB,no,N,7,,174608,30499,MVA
8,,SING,CA,C,no,N,8,,174608,30499,MVA
9,,SING,CA,HA,no,N,9,,174608,30499,MVA
10,,SING,CB,CG1,no,N,10,,174608,30499,MVA
11,,SING,CB,CG2,no,N,11,,174608,30499,MVA
12,,SING,CB,HB,no,N,12,,174608,30499,MVA
13,,SING,CG1,HG11,no,N,13,,174608,30499,MVA
14,,SING,CG1,HG12,no,N,14,,174608,30499,MVA
15,,SING,CG1,HG13,no,N,15,,174608,30499,MVA
16,,SING,CG2,HG21,no,N,16,,174608,30499,MVA
17,,SING,CG2,HG22,no,N,17,,174608,30499,MVA
18,,SING,CG2,HG23,no,N,18,,174608,30499,MVA
19,,DOUB,C,O,no,N,19,,174608,30499,MVA
20,,SING,C,OXT,no,N,20,,174608,30499,MVA
21,,SING,OXT,HXT,no,N,21,,174608,30499,MVA
1,,DOUB,OH,CH,no,N,1,,174672,30502,ALY
2,,SING,CH,CH3,no,N,2,,174672,30502,ALY
3,,SING,CH,NZ,no,N,3,,174672,30502,ALY
4,,SING,CH3,HH31,no,N,4,,174672,30502,ALY
5,,SING,CH3,HH32,no,N,5,,174672,30502,ALY
6,,SING,CH3,HH33,no,N,6,,174672,30502,ALY
7,,SING,NZ,CE,no,N,7,,174672,30502,ALY
8,,SING,NZ,HZ,no,N,8,,174672,30502,ALY
9,,SING,CE,CD,no,N,9,,174672,30502,ALY
10,,SING,CE,HE3,no,N,10,,174672,30502,ALY
11,,SING,CE,HE2,no,N,11,,174672,30502,ALY
12,,SING,CD,CG,no,N,12,,174672,30502,ALY
13,,SING,CD,HD3,no,N,13,,174672,30502,ALY
14,,SING,CD,HD2,no,N,14,,174672,30502,ALY
15,,SING,CG,CB,no,N,15,,174672,30502,ALY
16,,SING,CG,HG3,no,N,16,,174672,30502,ALY
17,,SING,CG,HG2,no,N,17,,174672,30502,ALY
18,,SING,CB,CA,no,N,18,,174672,30502,ALY
19,,SING,CB,HB3,no,N,19,,174672,30502,ALY
20,,SING,CB,HB2,no,N,20,,174672,30502,ALY
21,,SING,CA,N,no,N,21,,174672,30502,ALY
22,,SING,CA,C,no,N,22,,174672,30502,ALY
23,,SING,CA,HCA,no,N,23,,174672,30502,ALY
24,,SING,N,H,no,N,24,,174672,30502,ALY
25,,SING,N,H2,no,N,25,,174672,30502,ALY
26,,DOUB,C,O,no,N,26,,174672,30502,ALY
27,,SING,C,OXT,no,N,27,,174672,30502,ALY
28,,SING,OXT,HXT,no,N,28,,174672,30502,ALY
1,,DOUB,OP1,P,no,N,1,,174848,30511,RY
2,,DOUB,O2,C2,no,N,2,,174848,30511,RY
3,,SING,O3',C3',no,N,3,,174848,30511,RY
4,,SING,O2',C2',no,N,4,,174848,30511,RY
5,,SING,P,OP2,no,N,5,,174848,30511,RY
6,,SING,P,O5',no,N,6,,174848,30511,RY
7,,SING,C2,N3,no,N,7,,174848,30511,RY
8,,SING,C2,N1,no,N,8,,174848,30511,RY
9,,SING,C3',C4',no,N,9,,174848,30511,RY
10,,SING,C3',C2',no,N,10,,174848,30511,RY
11,,SING,C4',O4',no,N,11,,174848,30511,RY
12,,SING,C4',C5',no,N,12,,174848,30511,RY
13,,SING,C1',C2',no,N,13,,174848,30511,RY
14,,SING,C1',O4',no,N,14,,174848,30511,RY
15,,SING,C1',N1,no,N,15,,174848,30511,RY
16,,SING,N3,C4,no,N,16,,174848,30511,RY
17,,SING,N1,C6,no,N,17,,174848,30511,RY
18,,SING,C5',O5',no,N,18,,174848,30511,RY
19,,SING,C4,N4,no,N,19,,174848,30511,RY
20,,DOUB,C4,C5,no,N,20,,174848,30511,RY
21,,SING,C6,C5,no,N,21,,174848,30511,RY
22,,SING,P,OP3,no,N,22,,174848,30511,RY
23,,SING,C5',H5'',no,N,23,,174848,30511,RY
24,,SING,C5',H5',no,N,24,,174848,30511,RY
25,,SING,C4',H4',no,N,25,,174848,30511,RY
26,,SING,C3',H3',no,N,26,,174848,30511,RY
27,,SING,O3',H1,no,N,27,,174848,30511,RY
28,,SING,C2',H2',no,N,28,,174848,30511,RY
29,,SING,O2',HO2',no,N,29,,174848,30511,RY
30,,SING,C1',H1',no,N,30,,174848,30511,RY
31,,SING,N3,H3,no,N,31,,174848,30511,RY
32,,SING,N4,H41,no,N,32,,174848,30511,RY
33,,SING,N4,H42,no,N,33,,174848,30511,RY
34,,SING,C5,H5,no,N,34,,174848,30511,RY
35,,SING,C6,H6,no,N,35,,174848,30511,RY
36,,SING,C6,H2,no,N,36,,174848,30511,RY
37,,SING,OP2,H4,no,N,37,,174848,30511,RY
38,,SING,OP3,H7,no,N,38,,174848,30511,RY
1,,DOUB,OP1,P,no,N,1,,174871,30512,RY
2,,DOUB,O2,C2,no,N,2,,174871,30512,RY
3,,SING,O3',C3',no,N,3,,174871,30512,RY
4,,SING,O2',C2',no,N,4,,174871,30512,RY
5,,SING,P,OP2,no,N,5,,174871,30512,RY
6,,SING,P,O5',no,N,6,,174871,30512,RY
7,,SING,C2,N3,no,N,7,,174871,30512,RY
8,,SING,C2,N1,no,N,8,,174871,30512,RY
9,,SING,C3',C4',no,N,9,,174871,30512,RY
10,,SING,C3',C2',no,N,10,,174871,30512,RY
11,,SING,C4',O4',no,N,11,,174871,30512,RY
12,,SING,C4',C5',no,N,12,,174871,30512,RY
13,,SING,C1',C2',no,N,13,,174871,30512,RY
14,,SING,C1',O4',no,N,14,,174871,30512,RY
15,,SING,C1',N1,no,N,15,,174871,30512,RY
16,,SING,N3,C4,no,N,16,,174871,30512,RY
17,,SING,N1,C6,no,N,17,,174871,30512,RY
18,,SING,C5',O5',no,N,18,,174871,30512,RY
19,,SING,C4,N4,no,N,19,,174871,30512,RY
20,,DOUB,C4,C5,no,N,20,,174871,30512,RY
21,,SING,C6,C5,no,N,21,,174871,30512,RY
22,,SING,P,OP3,no,N,22,,174871,30512,RY
23,,SING,C5',H5'',no,N,23,,174871,30512,RY
24,,SING,C5',H5',no,N,24,,174871,30512,RY
25,,SING,C4',H4',no,N,25,,174871,30512,RY
26,,SING,C3',H3',no,N,26,,174871,30512,RY
27,,SING,O3',H1,no,N,27,,174871,30512,RY
28,,SING,C2',H2',no,N,28,,174871,30512,RY
29,,SING,O2',HO2',no,N,29,,174871,30512,RY
30,,SING,C1',H1',no,N,30,,174871,30512,RY
31,,SING,N3,H3,no,N,31,,174871,30512,RY
32,,SING,N4,H41,no,N,32,,174871,30512,RY
33,,SING,N4,H42,no,N,33,,174871,30512,RY
34,,SING,C5,H5,no,N,34,,174871,30512,RY
35,,SING,C6,H6,no,N,35,,174871,30512,RY
36,,SING,C6,H2,no,N,36,,174871,30512,RY
37,,SING,OP2,H4,no,N,37,,174871,30512,RY
38,,SING,OP3,H7,no,N,38,,174871,30512,RY
1,,SING,N,HN1,no,N,1,,174949,30516,NH2
2,,SING,N,HN2,no,N,2,,174949,30516,NH2
1,,SING,N,CA,no,N,1,,175022,30519,HYP
2,,SING,N,CD,no,N,2,,175022,30519,HYP
3,,SING,N,H,no,N,3,,175022,30519,HYP
4,,SING,CA,C,no,N,4,,175022,30519,HYP
5,,SING,CA,CB,no,N,5,,175022,30519,HYP
6,,SING,CA,HA,no,N,6,,175022,30519,HYP
7,,DOUB,C,O,no,N,7,,175022,30519,HYP
8,,SING,C,OXT,no,N,8,,175022,30519,HYP
9,,SING,CB,CG,no,N,9,,175022,30519,HYP
10,,SING,CB,HB2,no,N,10,,175022,30519,HYP
11,,SING,CB,HB3,no,N,11,,175022,30519,HYP
12,,SING,CG,CD,no,N,12,,175022,30519,HYP
13,,SING,CG,OD1,no,N,13,,175022,30519,HYP
14,,SING,CG,HG,no,N,14,,175022,30519,HYP
15,,SING,CD,HD22,no,N,15,,175022,30519,HYP
16,,SING,CD,HD23,no,N,16,,175022,30519,HYP
17,,SING,OD1,HD1,no,N,17,,175022,30519,HYP
18,,SING,OXT,HXT,no,N,18,,175022,30519,HYP
1,,SING,N,HN1,no,N,1,,175023,30519,NH2
2,,SING,N,HN2,no,N,2,,175023,30519,NH2
1,,SING,N,HN1,no,N,1,,175123,30524,NH2
2,,SING,N,HN2,no,N,2,,175123,30524,NH2
1,,DOUB,S1,O1,no,N,1,,175208,30529,WW7
2,,DOUB,S1,O2,no,N,2,,175208,30529,WW7
3,,SING,S1,N1,no,N,3,,175208,30529,WW7
4,,SING,S1,C1,no,N,4,,175208,30529,WW7
5,,SING,N1,C11,no,N,5,,175208,30529,WW7
6,,SING,N1,HN1,no,N,6,,175208,30529,WW7
7,,DOUB,C4,C3,yes,N,7,,175208,30529,WW7
8,,SING,C4,C10,yes,N,8,,175208,30529,WW7
9,,SING,C4,H4,no,N,9,,175208,30529,WW7
10,,SING,C3,C2,yes,N,10,,175208,30529,WW7
11,,SING,C3,H3,no,N,11,,175208,30529,WW7
12,,DOUB,C2,C1,yes,N,12,,175208,30529,WW7
13,,SING,C2,H2,no,N,13,,175208,30529,WW7
14,,SING,C1,C9,yes,N,14,,175208,30529,WW7
15,,DOUB,C9,C10,yes,N,15,,175208,30529,WW7
16,,SING,C9,C8,yes,N,16,,175208,30529,WW7
17,,SING,C10,C5,yes,N,17,,175208,30529,WW7
18,,SING,CL1,C5,no,N,18,,175208,30529,WW7
19,,DOUB,C5,C6,yes,N,19,,175208,30529,WW7
20,,SING,C6,C7,yes,N,20,,175208,30529,WW7
21,,SING,C6,H6,no,N,21,,175208,30529,WW7
22,,DOUB,C7,C8,yes,N,22,,175208,30529,WW7
23,,SING,C7,H7,no,N,23,,175208,30529,WW7
24,,SING,C8,H8,no,N,24,,175208,30529,WW7
25,,SING,C11,C12,no,N,25,,175208,30529,WW7
26,,SING,C11,H111,no,N,26,,175208,30529,WW7
27,,SING,C11,H112,no,N,27,,175208,30529,WW7
28,,SING,C12,C13,no,N,28,,175208,30529,WW7
29,,SING,C12,H121,no,N,29,,175208,30529,WW7
30,,SING,C12,H122,no,N,30,,175208,30529,WW7
31,,SING,C14,C13,no,N,31,,175208,30529,WW7
32,,SING,C14,C15,no,N,32,,175208,30529,WW7
33,,SING,C14,H141,no,N,33,,175208,30529,WW7
34,,SING,C14,H142,no,N,34,,175208,30529,WW7
35,,SING,C13,H131,no,N,35,,175208,30529,WW7
36,,SING,C13,H132,no,N,36,,175208,30529,WW7
37,,SING,C15,C16,no,N,37,,175208,30529,WW7
38,,SING,C15,H151,no,N,38,,175208,30529,WW7
39,,SING,C15,H152,no,N,39,,175208,30529,WW7
40,,SING,C16,N2,no,N,40,,175208,30529,WW7
41,,SING,C16,H161,no,N,41,,175208,30529,WW7
42,,SING,C16,H162,no,N,42,,175208,30529,WW7
43,,SING,N2,HN21,no,N,43,,175208,30529,WW7
44,,SING,N2,HN22,no,N,44,,175208,30529,WW7
1,,SING,N,CA,no,N,1,,175314,30534,PCA
2,,SING,N,CD,no,N,2,,175314,30534,PCA
3,,SING,N,H,no,N,3,,175314,30534,PCA
4,,SING,CA,CB,no,N,4,,175314,30534,PCA
5,,SING,CA,C,no,N,5,,175314,30534,PCA
6,,SING,CA,HA,no,N,6,,175314,30534,PCA
7,,SING,CB,CG,no,N,7,,175314,30534,PCA
8,,SING,CB,HB2,no,N,8,,175314,30534,PCA
9,,SING,CB,HB3,no,N,9,,175314,30534,PCA
10,,SING,CG,CD,no,N,10,,175314,30534,PCA
11,,SING,CG,HG2,no,N,11,,175314,30534,PCA
12,,SING,CG,HG3,no,N,12,,175314,30534,PCA
13,,DOUB,CD,OE,no,N,13,,175314,30534,PCA
14,,DOUB,C,O,no,N,14,,175314,30534,PCA
15,,SING,C,OXT,no,N,15,,175314,30534,PCA
16,,SING,OXT,HXT,no,N,16,,175314,30534,PCA
1,,SING,N,HN1,no,N,1,,175315,30534,NH2
2,,SING,N,HN2,no,N,2,,175315,30534,NH2
1,,SING,N,CA,no,N,1,,175334,30535,PCA
2,,SING,N,CD,no,N,2,,175334,30535,PCA
3,,SING,N,H,no,N,3,,175334,30535,PCA
4,,SING,CA,CB,no,N,4,,175334,30535,PCA
5,,SING,CA,C,no,N,5,,175334,30535,PCA
6,,SING,CA,HA,no,N,6,,175334,30535,PCA
7,,SING,CB,CG,no,N,7,,175334,30535,PCA
8,,SING,CB,HB2,no,N,8,,175334,30535,PCA
9,,SING,CB,HB3,no,N,9,,175334,30535,PCA
10,,SING,CG,CD,no,N,10,,175334,30535,PCA
11,,SING,CG,HG2,no,N,11,,175334,30535,PCA
12,,SING,CG,HG3,no,N,12,,175334,30535,PCA
13,,DOUB,CD,OE,no,N,13,,175334,30535,PCA
14,,DOUB,C,O,no,N,14,,175334,30535,PCA
15,,SING,C,OXT,no,N,15,,175334,30535,PCA
16,,SING,OXT,HXT,no,N,16,,175334,30535,PCA
1,,SING,N,HN1,no,N,1,,175335,30535,NH2
2,,SING,N,HN2,no,N,2,,175335,30535,NH2
1,,SING,N,CA,no,N,1,,175354,30536,PCA
2,,SING,N,CD,no,N,2,,175354,30536,PCA
3,,SING,N,H,no,N,3,,175354,30536,PCA
4,,SING,CA,CB,no,N,4,,175354,30536,PCA
5,,SING,CA,C,no,N,5,,175354,30536,PCA
6,,SING,CA,HA,no,N,6,,175354,30536,PCA
7,,SING,CB,CG,no,N,7,,175354,30536,PCA
8,,SING,CB,HB2,no,N,8,,175354,30536,PCA
9,,SING,CB,HB3,no,N,9,,175354,30536,PCA
10,,SING,CG,CD,no,N,10,,175354,30536,PCA
11,,SING,CG,HG2,no,N,11,,175354,30536,PCA
12,,SING,CG,HG3,no,N,12,,175354,30536,PCA
13,,DOUB,CD,OE,no,N,13,,175354,30536,PCA
14,,DOUB,C,O,no,N,14,,175354,30536,PCA
15,,SING,C,OXT,no,N,15,,175354,30536,PCA
16,,SING,OXT,HXT,no,N,16,,175354,30536,PCA
1,,SING,N,HN1,no,N,1,,175355,30536,NH2
2,,SING,N,HN2,no,N,2,,175355,30536,NH2
1,,SING,N,HN1,no,N,1,,175445,30544,NH2
2,,SING,N,HN2,no,N,2,,175445,30544,NH2
1,,SING,C1,C2,no,N,1,,175545,30550,ACD
2,,DOUB,C1,O1,no,N,2,,175545,30550,ACD
3,,SING,C1,O2,no,N,3,,175545,30550,ACD
4,,SING,C2,C3,no,N,4,,175545,30550,ACD
5,,SING,C2,H21,no,N,5,,175545,30550,ACD
6,,SING,C2,H22,no,N,6,,175545,30550,ACD
7,,SING,C3,C4,no,N,7,,175545,30550,ACD
8,,SING,C3,H31,no,N,8,,175545,30550,ACD
9,,SING,C3,H32,no,N,9,,175545,30550,ACD
10,,SING,C4,C5,no,N,10,,175545,30550,ACD
11,,SING,C4,H41,no,N,11,,175545,30550,ACD
12,,SING,C4,H42,no,N,12,,175545,30550,ACD
13,,DOUB,C5,C6,no,Z,13,,175545,30550,ACD
14,,SING,C5,H5,no,N,14,,175545,30550,ACD
15,,SING,C6,C7,no,N,15,,175545,30550,ACD
16,,SING,C6,H6,no,N,16,,175545,30550,ACD
17,,SING,C7,C8,no,N,17,,175545,30550,ACD
18,,SING,C7,H71,no,N,18,,175545,30550,ACD
19,,SING,C7,H72,no,N,19,,175545,30550,ACD
20,,DOUB,C8,C9,no,Z,20,,175545,30550,ACD
21,,SING,C8,H8,no,N,21,,175545,30550,ACD
22,,SING,C9,C10,no,N,22,,175545,30550,ACD
23,,SING,C9,H9,no,N,23,,175545,30550,ACD
24,,SING,C10,C11,no,N,24,,175545,30550,ACD
25,,SING,C10,H101,no,N,25,,175545,30550,ACD
26,,SING,C10,H102,no,N,26,,175545,30550,ACD
27,,DOUB,C11,C12,no,Z,27,,175545,30550,ACD
28,,SING,C11,H11,no,N,28,,175545,30550,ACD
29,,SING,C12,C13,no,N,29,,175545,30550,ACD
30,,SING,C12,H12,no,N,30,,175545,30550,ACD
31,,SING,C13,C14,no,N,31,,175545,30550,ACD
32,,SING,C13,H131,no,N,32,,175545,30550,ACD
33,,SING,C13,H132,no,N,33,,175545,30550,ACD
34,,DOUB,C14,C15,no,Z,34,,175545,30550,ACD
35,,SING,C14,H14,no,N,35,,175545,30550,ACD
36,,SING,C15,C16,no,N,36,,175545,30550,ACD
37,,SING,C15,H15,no,N,37,,175545,30550,ACD
38,,SING,C16,C17,no,N,38,,175545,30550,ACD
39,,SING,C16,H161,no,N,39,,175545,30550,ACD
40,,SING,C16,H162,no,N,40,,175545,30550,ACD
41,,SING,C17,C18,no,N,41,,175545,30550,ACD
42,,SING,C17,H171,no,N,42,,175545,30550,ACD
43,,SING,C17,H172,no,N,43,,175545,30550,ACD
44,,SING,C18,C19,no,N,44,,175545,30550,ACD
45,,SING,C18,H181,no,N,45,,175545,30550,ACD
46,,SING,C18,H182,no,N,46,,175545,30550,ACD
47,,SING,C19,C20,no,N,47,,175545,30550,ACD
48,,SING,C19,H191,no,N,48,,175545,30550,ACD
49,,SING,C19,H192,no,N,49,,175545,30550,ACD
50,,SING,C20,H201,no,N,50,,175545,30550,ACD
51,,SING,C20,H202,no,N,51,,175545,30550,ACD
52,,SING,C20,H203,no,N,52,,175545,30550,ACD
53,,SING,O2,HO2,no,N,53,,175545,30550,ACD
1,,SING,N,HN1,no,N,1,,175694,30557,NH2
2,,SING,N,HN2,no,N,2,,175694,30557,NH2
1,,SING,N,HN1,no,N,1,,175711,30558,NH2
2,,SING,N,HN2,no,N,2,,175711,30558,NH2
1,,SING,C30,N27,no,N,1,,176066,30577,BO6
2,,DOUB,C28,N27,yes,N,2,,176066,30577,BO6
3,,SING,C28,C29,yes,N,3,,176066,30577,BO6
4,,SING,N27,C26,yes,N,4,,176066,30577,BO6
5,,DOUB,C29,C24,yes,N,5,,176066,30577,BO6
6,,DOUB,C26,C25,yes,N,6,,176066,30577,BO6
7,,SING,C24,C25,yes,N,7,,176066,30577,BO6
8,,SING,C24,C23,no,N,8,,176066,30577,BO6
9,,DOUB,C20,C21,yes,N,9,,176066,30577,BO6
10,,SING,C20,N19,yes,N,10,,176066,30577,BO6
11,,DOUB,C23,C22,no,E,11,,176066,30577,BO6
12,,SING,C31,N19,no,N,12,,176066,30577,BO6
13,,SING,C21,C16,yes,N,13,,176066,30577,BO6
14,,SING,C22,C11,no,N,14,,176066,30577,BO6
15,,DOUB,N19,C18,yes,N,15,,176066,30577,BO6
16,,SING,C16,C15,no,N,16,,176066,30577,BO6
17,,DOUB,C16,C17,yes,N,17,,176066,30577,BO6
18,,SING,C18,C17,yes,N,18,,176066,30577,BO6
19,,DOUB,C15,C14,no,E,19,,176066,30577,BO6
20,,DOUB,C10,C11,yes,N,20,,176066,30577,BO6
21,,SING,C10,C4,yes,N,21,,176066,30577,BO6
22,,SING,C11,C12,yes,N,22,,176066,30577,BO6
23,,SING,C14,C7,no,N,23,,176066,30577,BO6
24,,DOUB,C6,C7,yes,N,24,,176066,30577,BO6
25,,SING,C6,C3,yes,N,25,,176066,30577,BO6
26,,SING,C7,C8,yes,N,26,,176066,30577,BO6
27,,SING,C4,C3,yes,N,27,,176066,30577,BO6
28,,DOUB,C4,C5,yes,N,28,,176066,30577,BO6
29,,DOUB,C12,C13,yes,N,29,,176066,30577,BO6
30,,DOUB,C3,C2,yes,N,30,,176066,30577,BO6
31,,SING,C5,C13,yes,N,31,,176066,30577,BO6
32,,SING,C5,N1,yes,N,32,,176066,30577,BO6
33,,DOUB,C8,C9,yes,N,33,,176066,30577,BO6
34,,SING,C2,C9,yes,N,34,,176066,30577,BO6
35,,SING,C2,N1,yes,N,35,,176066,30577,BO6
36,,SING,C17,H17,no,N,36,,176066,30577,BO6
37,,SING,C18,H18,no,N,37,,176066,30577,BO6
38,,SING,C31,H9N,no,N,38,,176066,30577,BO6
39,,SING,C31,H9O,no,N,39,,176066,30577,BO6
40,,SING,C31,H31,no,N,40,,176066,30577,BO6
41,,SING,C20,H20,no,N,41,,176066,30577,BO6
42,,SING,C21,H21,no,N,42,,176066,30577,BO6
43,,SING,C15,H2,no,N,43,,176066,30577,BO6
44,,SING,C14,H3,no,N,44,,176066,30577,BO6
45,,SING,C6,H6,no,N,45,,176066,30577,BO6
46,,SING,C8,H8,no,N,46,,176066,30577,BO6
47,,SING,C9,H9,no,N,47,,176066,30577,BO6
48,,SING,N1,H1,no,N,48,,176066,30577,BO6
49,,SING,C10,H10,no,N,49,,176066,30577,BO6
50,,SING,C13,H13,no,N,50,,176066,30577,BO6
51,,SING,C12,H12,no,N,51,,176066,30577,BO6
52,,SING,C22,H22,no,N,52,,176066,30577,BO6
53,,SING,C23,H23,no,N,53,,176066,30577,BO6
54,,SING,C25,H25,no,N,54,,176066,30577,BO6
55,,SING,C26,H26,no,N,55,,176066,30577,BO6
56,,SING,C30,H30,no,N,56,,176066,30577,BO6
57,,SING,C30,H9L,no,N,57,,176066,30577,BO6
58,,SING,C30,H9M,no,N,58,,176066,30577,BO6
59,,SING,C28,H28,no,N,59,,176066,30577,BO6
60,,SING,C29,H29,no,N,60,,176066,30577,BO6
1,,DOUB,C,O,no,N,1,,176178,30585,ACE
2,,SING,C,CH3,no,N,2,,176178,30585,ACE
3,,SING,C,H,no,N,3,,176178,30585,ACE
4,,SING,CH3,H1,no,N,4,,176178,30585,ACE
5,,SING,CH3,H2,no,N,5,,176178,30585,ACE
6,,SING,CH3,H3,no,N,6,,176178,30585,ACE
1,,DOUB,OH,CH,no,N,1,,176179,30585,ALY
2,,SING,CH,CH3,no,N,2,,176179,30585,ALY
3,,SING,CH,NZ,no,N,3,,176179,30585,ALY
4,,SING,CH3,HH31,no,N,4,,176179,30585,ALY
5,,SING,CH3,HH32,no,N,5,,176179,30585,ALY
6,,SING,CH3,HH33,no,N,6,,176179,30585,ALY
7,,SING,NZ,CE,no,N,7,,176179,30585,ALY
8,,SING,NZ,HZ,no,N,8,,176179,30585,ALY
9,,SING,CE,CD,no,N,9,,176179,30585,ALY
10,,SING,CE,HE3,no,N,10,,176179,30585,ALY
11,,SING,CE,HE2,no,N,11,,176179,30585,ALY
12,,SING,CD,CG,no,N,12,,176179,30585,ALY
13,,SING,CD,HD3,no,N,13,,176179,30585,ALY
14,,SING,CD,HD2,no,N,14,,176179,30585,ALY
15,,SING,CG,CB,no,N,15,,176179,30585,ALY
16,,SING,CG,HG3,no,N,16,,176179,30585,ALY
17,,SING,CG,HG2,no,N,17,,176179,30585,ALY
18,,SING,CB,CA,no,N,18,,176179,30585,ALY
19,,SING,CB,HB3,no,N,19,,176179,30585,ALY
20,,SING,CB,HB2,no,N,20,,176179,30585,ALY
21,,SING,CA,N,no,N,21,,176179,30585,ALY
22,,SING,CA,C,no,N,22,,176179,30585,ALY
23,,SING,CA,HCA,no,N,23,,176179,30585,ALY
24,,SING,N,H,no,N,24,,176179,30585,ALY
25,,SING,N,H2,no,N,25,,176179,30585,ALY
26,,DOUB,C,O,no,N,26,,176179,30585,ALY
27,,SING,C,OXT,no,N,27,,176179,30585,ALY
28,,SING,OXT,HXT,no,N,28,,176179,30585,ALY
1,,SING,N,HN1,no,N,1,,176180,30585,NH2
2,,SING,N,HN2,no,N,2,,176180,30585,NH2
1,,SING,N,CA,no,N,1,,176320,30594,ORN
2,,SING,N,H,no,N,2,,176320,30594,ORN
3,,SING,N,H2,no,N,3,,176320,30594,ORN
4,,SING,CA,CB,no,N,4,,176320,30594,ORN
5,,SING,CA,C,no,N,5,,176320,30594,ORN
6,,SING,CA,HA,no,N,6,,176320,30594,ORN
7,,SING,CB,CG,no,N,7,,176320,30594,ORN
8,,SING,CB,HB2,no,N,8,,176320,30594,ORN
9,,SING,CB,HB3,no,N,9,,176320,30594,ORN
10,,SING,CG,CD,no,N,10,,176320,30594,ORN
11,,SING,CG,HG2,no,N,11,,176320,30594,ORN
12,,SING,CG,HG3,no,N,12,,176320,30594,ORN
13,,SING,CD,NE,no,N,13,,176320,30594,ORN
14,,SING,CD,HD2,no,N,14,,176320,30594,ORN
15,,SING,CD,HD3,no,N,15,,176320,30594,ORN
16,,SING,NE,HE1,no,N,16,,176320,30594,ORN
17,,SING,NE,HE2,no,N,17,,176320,30594,ORN
18,,DOUB,C,O,no,N,18,,176320,30594,ORN
19,,SING,C,OXT,no,N,19,,176320,30594,ORN
20,,SING,OXT,HXT,no,N,20,,176320,30594,ORN
1,,SING,N,CA,no,N,1,,176337,30595,DAB
2,,SING,N,H,no,N,2,,176337,30595,DAB
3,,SING,N,H2,no,N,3,,176337,30595,DAB
4,,SING,CA,C,no,N,4,,176337,30595,DAB
5,,SING,CA,CB,no,N,5,,176337,30595,DAB
6,,SING,CA,HA,no,N,6,,176337,30595,DAB
7,,DOUB,C,O,no,N,7,,176337,30595,DAB
8,,SING,C,OXT,no,N,8,,176337,30595,DAB
9,,SING,CB,CG,no,N,9,,176337,30595,DAB
10,,SING,CB,HB2,no,N,10,,176337,30595,DAB
11,,SING,CB,HB3,no,N,11,,176337,30595,DAB
12,,SING,CG,ND,no,N,12,,176337,30595,DAB
13,,SING,CG,HG2,no,N,13,,176337,30595,DAB
14,,SING,CG,HG3,no,N,14,,176337,30595,DAB
15,,SING,ND,HD1,no,N,15,,176337,30595,DAB
16,,SING,ND,HD2,no,N,16,,176337,30595,DAB
17,,SING,OXT,HXT,no,N,17,,176337,30595,DAB
1,,SING,P,O1P,no,N,1,,176355,30596,2PO
2,,SING,P,O2P,no,N,2,,176355,30596,2PO
3,,DOUB,P,O3P,no,N,3,,176355,30596,2PO
4,,SING,P,HP,no,N,4,,176355,30596,2PO
1,,SING,N,CA,no,N,1,,176466,30601,DPP
2,,SING,N,H,no,N,2,,176466,30601,DPP
3,,SING,N,H2,no,N,3,,176466,30601,DPP
4,,SING,CA,C,no,N,4,,176466,30601,DPP
5,,SING,CA,CB,no,N,5,,176466,30601,DPP
6,,SING,CA,HA,no,N,6,,176466,30601,DPP
7,,DOUB,C,O,no,N,7,,176466,30601,DPP
8,,SING,C,OXT,no,N,8,,176466,30601,DPP
9,,SING,CB,NG,no,N,9,,176466,30601,DPP
10,,SING,CB,HB2,no,N,10,,176466,30601,DPP
11,,SING,CB,HB3,no,N,11,,176466,30601,DPP
12,,SING,NG,HG1,no,N,12,,176466,30601,DPP
13,,SING,NG,HG2,no,N,13,,176466,30601,DPP
14,,SING,OXT,HXT,no,N,14,,176466,30601,DPP
1,,DOUB,O13,C7,no,N,1,,176655,30610,N8J
2,,SING,C7,N29,no,N,2,,176655,30610,N8J
3,,SING,C7,C6,no,N,3,,176655,30610,N8J
4,,SING,N29,S26,no,N,4,,176655,30610,N8J
5,,DOUB,O28,S26,no,N,5,,176655,30610,N8J
6,,DOUB,C6,C8,yes,N,6,,176655,30610,N8J
7,,SING,C6,C5,yes,N,7,,176655,30610,N8J
8,,SING,C8,C9,yes,N,8,,176655,30610,N8J
9,,SING,S26,C30,no,N,9,,176655,30610,N8J
10,,DOUB,S26,O27,no,N,10,,176655,30610,N8J
11,,DOUB,C5,C4,yes,N,11,,176655,30610,N8J
12,,SING,C30,C31,no,N,12,,176655,30610,N8J
13,,DOUB,C9,C10,yes,N,13,,176655,30610,N8J
14,,SING,C10,C4,yes,N,14,,176655,30610,N8J
15,,SING,C10,O3,no,N,15,,176655,30610,N8J
16,,SING,C4,N1,no,N,16,,176655,30610,N8J
17,,DOUB,C31,C32,yes,N,17,,176655,30610,N8J
18,,SING,C31,C36,yes,N,18,,176655,30610,N8J
19,,SING,C32,C33,yes,N,19,,176655,30610,N8J
20,,SING,O3,C11,no,N,20,,176655,30610,N8J
21,,SING,N1,C2,no,N,21,,176655,30610,N8J
22,,SING,N1,C12,no,N,22,,176655,30610,N8J
23,,DOUB,C36,C35,yes,N,23,,176655,30610,N8J
24,,DOUB,C33,C34,yes,N,24,,176655,30610,N8J
25,,SING,C2,C14,no,N,25,,176655,30610,N8J
26,,SING,C11,C12,no,N,26,,176655,30610,N8J
27,,SING,C11,C23,no,N,27,,176655,30610,N8J
28,,SING,C14,C15,no,N,28,,176655,30610,N8J
29,,SING,C14,C17,no,N,29,,176655,30610,N8J
30,,SING,C15,C16,no,N,30,,176655,30610,N8J
31,,SING,C35,C34,yes,N,31,,176655,30610,N8J
32,,DOUB,C23,C22,yes,N,32,,176655,30610,N8J
33,,SING,C23,C24,yes,N,33,,176655,30610,N8J
34,,SING,C22,C21,yes,N,34,,176655,30610,N8J
35,,SING,C17,C16,no,N,35,,176655,30610,N8J
36,,SING,CL25,C24,no,N,36,,176655,30610,N8J
37,,DOUB,C24,C18,yes,N,37,,176655,30610,N8J
38,,DOUB,C21,C19,yes,N,38,,176655,30610,N8J
39,,SING,C18,C19,yes,N,39,,176655,30610,N8J
40,,SING,C19,CL20,no,N,40,,176655,30610,N8J
41,,SING,C5,H6,no,N,41,,176655,30610,N8J
42,,SING,C8,H7,no,N,42,,176655,30610,N8J
43,,SING,C15,H10,no,N,43,,176655,30610,N8J
44,,SING,C15,H11,no,N,44,,176655,30610,N8J
45,,SING,C17,H15,no,N,45,,176655,30610,N8J
46,,SING,C17,H14,no,N,46,,176655,30610,N8J
47,,SING,C21,H17,no,N,47,,176655,30610,N8J
48,,SING,C22,H18,no,N,48,,176655,30610,N8J
49,,SING,C2,H2,no,N,49,,176655,30610,N8J
50,,SING,C2,H4,no,N,50,,176655,30610,N8J
51,,SING,C9,H8,no,N,51,,176655,30610,N8J
52,,SING,C11,H5,no,N,52,,176655,30610,N8J
53,,SING,C12,H3,no,N,53,,176655,30610,N8J
54,,SING,C12,H1,no,N,54,,176655,30610,N8J
55,,SING,C14,H9,no,N,55,,176655,30610,N8J
56,,SING,C16,H12,no,N,56,,176655,30610,N8J
57,,SING,C16,H13,no,N,57,,176655,30610,N8J
58,,SING,C18,H16,no,N,58,,176655,30610,N8J
59,,SING,N29,H19,no,N,59,,176655,30610,N8J
60,,SING,C30,H21,no,N,60,,176655,30610,N8J
61,,SING,C30,H20,no,N,61,,176655,30610,N8J
62,,SING,C32,H22,no,N,62,,176655,30610,N8J
63,,SING,C33,H23,no,N,63,,176655,30610,N8J
64,,SING,C34,H24,no,N,64,,176655,30610,N8J
65,,SING,C35,H25,no,N,65,,176655,30610,N8J
66,,SING,C36,H26,no,N,66,,176655,30610,N8J
1,,SING,N,HN1,no,N,1,,176726,30615,NH2
2,,SING,N,HN2,no,N,2,,176726,30615,NH2
1,,SING,N,HN1,no,N,1,,176758,30616,NH2
2,,SING,N,HN2,no,N,2,,176758,30616,NH2
1,,SING,N,HN1,no,N,1,,176789,30617,NH2
2,,SING,N,HN2,no,N,2,,176789,30617,NH2
1,,SING,N,HN1,no,N,1,,176808,30618,NH2
2,,SING,N,HN2,no,N,2,,176808,30618,NH2
1,,SING,N,CA,no,N,1,,177022,30630,DBB
2,,SING,CA,C,no,N,2,,177022,30630,DBB
3,,SING,CA,CB,no,N,3,,177022,30630,DBB
4,,DOUB,C,O,no,N,4,,177022,30630,DBB
5,,SING,CB,CG,no,N,5,,177022,30630,DBB
6,,SING,C,OXT,no,N,6,,177022,30630,DBB
7,,SING,N,H,no,N,7,,177022,30630,DBB
8,,SING,N,H1,no,N,8,,177022,30630,DBB
9,,SING,CA,HA,no,N,9,,177022,30630,DBB
10,,SING,CB,HB2,no,N,10,,177022,30630,DBB
11,,SING,CB,HB3,no,N,11,,177022,30630,DBB
12,,SING,CG,HG1,no,N,12,,177022,30630,DBB
13,,SING,CG,HG2,no,N,13,,177022,30630,DBB
14,,SING,CG,HG3,no,N,14,,177022,30630,DBB
15,,SING,OXT,HXT,no,N,15,,177022,30630,DBB
1,,SING,N,CA,no,N,1,,177023,30630,IAS
2,,SING,N,H,no,N,2,,177023,30630,IAS
3,,SING,N,H2,no,N,3,,177023,30630,IAS
4,,SING,CA,C,no,N,4,,177023,30630,IAS
5,,SING,CA,CB,no,N,5,,177023,30630,IAS
6,,SING,CA,HA,no,N,6,,177023,30630,IAS
7,,DOUB,C,O,no,N,7,,177023,30630,IAS
8,,SING,C,OXT,no,N,8,,177023,30630,IAS
9,,SING,CB,CG,no,N,9,,177023,30630,IAS
10,,SING,CB,HB2,no,N,10,,177023,30630,IAS
11,,SING,CB,HB3,no,N,11,,177023,30630,IAS
12,,DOUB,CG,OD1,no,N,12,,177023,30630,IAS
13,,SING,OXT,HXT,no,N,13,,177023,30630,IAS
14,,SING,CG,OD2,no,N,14,,177023,30630,IAS
15,,SING,OD2,HD2,no,N,15,,177023,30630,IAS
1,,SING,N,CA,no,N,1,,177041,30631,DBB
2,,SING,CA,C,no,N,2,,177041,30631,DBB
3,,SING,CA,CB,no,N,3,,177041,30631,DBB
4,,DOUB,C,O,no,N,4,,177041,30631,DBB
5,,SING,CB,CG,no,N,5,,177041,30631,DBB
6,,SING,C,OXT,no,N,6,,177041,30631,DBB
7,,SING,N,H,no,N,7,,177041,30631,DBB
8,,SING,N,H1,no,N,8,,177041,30631,DBB
9,,SING,CA,HA,no,N,9,,177041,30631,DBB
10,,SING,CB,HB2,no,N,10,,177041,30631,DBB
11,,SING,CB,HB3,no,N,11,,177041,30631,DBB
12,,SING,CG,HG1,no,N,12,,177041,30631,DBB
13,,SING,CG,HG2,no,N,13,,177041,30631,DBB
14,,SING,CG,HG3,no,N,14,,177041,30631,DBB
15,,SING,OXT,HXT,no,N,15,,177041,30631,DBB
1,,SING,C1,C2,no,N,1,,177208,30639,PCW
2,,SING,C1,O3P,no,N,2,,177208,30639,PCW
3,,SING,C1,H11,no,N,3,,177208,30639,PCW
4,,SING,C1,H12,no,N,4,,177208,30639,PCW
5,,SING,C2,C3,no,N,5,,177208,30639,PCW
6,,SING,C2,O2,no,N,6,,177208,30639,PCW
7,,SING,C2,H2,no,N,7,,177208,30639,PCW
8,,SING,C3,O3,no,N,8,,177208,30639,PCW
9,,SING,C3,H31,no,N,9,,177208,30639,PCW
10,,SING,C3,H32,no,N,10,,177208,30639,PCW
11,,SING,C4,C5,no,N,11,,177208,30639,PCW
12,,SING,C4,O4P,no,N,12,,177208,30639,PCW
13,,SING,C4,H41,no,N,13,,177208,30639,PCW
14,,SING,C4,H42,no,N,14,,177208,30639,PCW
15,,SING,C5,N,no,N,15,,177208,30639,PCW
16,,SING,C5,H51,no,N,16,,177208,30639,PCW
17,,SING,C5,H52,no,N,17,,177208,30639,PCW
18,,SING,C6,N,no,N,18,,177208,30639,PCW
19,,SING,C6,H61,no,N,19,,177208,30639,PCW
20,,SING,C6,H62,no,N,20,,177208,30639,PCW
21,,SING,C6,H63,no,N,21,,177208,30639,PCW
22,,SING,C7,N,no,N,22,,177208,30639,PCW
23,,SING,C7,H71,no,N,23,,177208,30639,PCW
24,,SING,C7,H72,no,N,24,,177208,30639,PCW
25,,SING,C7,H73,no,N,25,,177208,30639,PCW
26,,SING,C8,N,no,N,26,,177208,30639,PCW
27,,SING,C8,H81,no,N,27,,177208,30639,PCW
28,,SING,C8,H82,no,N,28,,177208,30639,PCW
29,,SING,C8,H83,no,N,29,,177208,30639,PCW
30,,SING,C11,C12,no,N,30,,177208,30639,PCW
31,,SING,C11,O3,no,N,31,,177208,30639,PCW
32,,DOUB,C11,O11,no,N,32,,177208,30639,PCW
33,,SING,C12,C13,no,N,33,,177208,30639,PCW
34,,SING,C12,H121,no,N,34,,177208,30639,PCW
35,,SING,C12,H122,no,N,35,,177208,30639,PCW
36,,SING,C13,C14,no,N,36,,177208,30639,PCW
37,,SING,C13,H131,no,N,37,,177208,30639,PCW
38,,SING,C13,H132,no,N,38,,177208,30639,PCW
39,,SING,C14,C15,no,N,39,,177208,30639,PCW
40,,SING,C14,H141,no,N,40,,177208,30639,PCW
41,,SING,C14,H142,no,N,41,,177208,30639,PCW
42,,SING,C15,C16,no,N,42,,177208,30639,PCW
43,,SING,C15,H151,no,N,43,,177208,30639,PCW
44,,SING,C15,H152,no,N,44,,177208,30639,PCW
45,,SING,C16,C17,no,N,45,,177208,30639,PCW
46,,SING,C16,H161,no,N,46,,177208,30639,PCW
47,,SING,C16,H162,no,N,47,,177208,30639,PCW
48,,SING,C17,C18,no,N,48,,177208,30639,PCW
49,,SING,C17,H171,no,N,49,,177208,30639,PCW
50,,SING,C17,H172,no,N,50,,177208,30639,PCW
51,,SING,C18,C19,no,N,51,,177208,30639,PCW
52,,SING,C18,H181,no,N,52,,177208,30639,PCW
53,,SING,C18,H182,no,N,53,,177208,30639,PCW
54,,DOUB,C19,C20,no,Z,54,,177208,30639,PCW
55,,SING,C19,H19,no,N,55,,177208,30639,PCW
56,,SING,C20,C21,no,N,56,,177208,30639,PCW
57,,SING,C20,H20,no,N,57,,177208,30639,PCW
58,,SING,C21,C22,no,N,58,,177208,30639,PCW
59,,SING,C21,H211,no,N,59,,177208,30639,PCW
60,,SING,C21,H212,no,N,60,,177208,30639,PCW
61,,SING,C22,C23,no,N,61,,177208,30639,PCW
62,,SING,C22,H221,no,N,62,,177208,30639,PCW
63,,SING,C22,H222,no,N,63,,177208,30639,PCW
64,,SING,C23,C24,no,N,64,,177208,30639,PCW
65,,SING,C23,H231,no,N,65,,177208,30639,PCW
66,,SING,C23,H232,no,N,66,,177208,30639,PCW
67,,SING,C24,C25,no,N,67,,177208,30639,PCW
68,,SING,C24,H241,no,N,68,,177208,30639,PCW
69,,SING,C24,H242,no,N,69,,177208,30639,PCW
70,,SING,C25,C26,no,N,70,,177208,30639,PCW
71,,SING,C25,H251,no,N,71,,177208,30639,PCW
72,,SING,C25,H252,no,N,72,,177208,30639,PCW
73,,SING,C26,C27,no,N,73,,177208,30639,PCW
74,,SING,C26,H261,no,N,74,,177208,30639,PCW
75,,SING,C26,H262,no,N,75,,177208,30639,PCW
76,,SING,C27,C28,no,N,76,,177208,30639,PCW
77,,SING,C27,H271,no,N,77,,177208,30639,PCW
78,,SING,C27,H272,no,N,78,,177208,30639,PCW
79,,SING,C28,H281,no,N,79,,177208,30639,PCW
80,,SING,C28,H282,no,N,80,,177208,30639,PCW
81,,SING,C28,H283,no,N,81,,177208,30639,PCW
82,,SING,C31,C32,no,N,82,,177208,30639,PCW
83,,SING,C31,O2,no,N,83,,177208,30639,PCW
84,,DOUB,C31,O31,no,N,84,,177208,30639,PCW
85,,SING,C32,C33,no,N,85,,177208,30639,PCW
86,,SING,C32,H321,no,N,86,,177208,30639,PCW
87,,SING,C32,H322,no,N,87,,177208,30639,PCW
88,,SING,C33,C34,no,N,88,,177208,30639,PCW
89,,SING,C33,H331,no,N,89,,177208,30639,PCW
90,,SING,C33,H332,no,N,90,,177208,30639,PCW
91,,SING,C34,C35,no,N,91,,177208,30639,PCW
92,,SING,C34,H341,no,N,92,,177208,30639,PCW
93,,SING,C34,H342,no,N,93,,177208,30639,PCW
94,,SING,C35,C36,no,N,94,,177208,30639,PCW
95,,SING,C35,H351,no,N,95,,177208,30639,PCW
96,,SING,C35,H352,no,N,96,,177208,30639,PCW
97,,SING,C36,C37,no,N,97,,177208,30639,PCW
98,,SING,C36,H361,no,N,98,,177208,30639,PCW
99,,SING,C36,H362,no,N,99,,177208,30639,PCW
100,,SING,C37,C38,no,N,100,,177208,30639,PCW
101,,SING,C37,H371,no,N,101,,177208,30639,PCW
102,,SING,C37,H372,no,N,102,,177208,30639,PCW
103,,SING,C38,C39,no,N,103,,177208,30639,PCW
104,,SING,C38,H381,no,N,104,,177208,30639,PCW
105,,SING,C38,H382,no,N,105,,177208,30639,PCW
106,,DOUB,C39,C40,no,Z,106,,177208,30639,PCW
107,,SING,C39,H39,no,N,107,,177208,30639,PCW
108,,SING,C40,C41,no,N,108,,177208,30639,PCW
109,,SING,C40,H40,no,N,109,,177208,30639,PCW
110,,SING,C41,C42,no,N,110,,177208,30639,PCW
111,,SING,C41,H411,no,N,111,,177208,30639,PCW
112,,SING,C41,H412,no,N,112,,177208,30639,PCW
113,,SING,C42,C43,no,N,113,,177208,30639,PCW
114,,SING,C42,H421,no,N,114,,177208,30639,PCW
115,,SING,C42,H422,no,N,115,,177208,30639,PCW
116,,SING,C43,C44,no,N,116,,177208,30639,PCW
117,,SING,C43,H431,no,N,117,,177208,30639,PCW
118,,SING,C43,H432,no,N,118,,177208,30639,PCW
119,,SING,C44,C45,no,N,119,,177208,30639,PCW
120,,SING,C44,H441,no,N,120,,177208,30639,PCW
121,,SING,C44,H442,no,N,121,,177208,30639,PCW
122,,SING,C45,C46,no,N,122,,177208,30639,PCW
123,,SING,C45,H451,no,N,123,,177208,30639,PCW
124,,SING,C45,H452,no,N,124,,177208,30639,PCW
125,,SING,C46,C47,no,N,125,,177208,30639,PCW
126,,SING,C46,H461,no,N,126,,177208,30639,PCW
127,,SING,C46,H462,no,N,127,,177208,30639,PCW
128,,SING,C47,C48,no,N,128,,177208,30639,PCW
129,,SING,C47,H471,no,N,129,,177208,30639,PCW
130,,SING,C47,H472,no,N,130,,177208,30639,PCW
131,,SING,C48,H481,no,N,131,,177208,30639,PCW
132,,SING,C48,H482,no,N,132,,177208,30639,PCW
133,,SING,C48,H483,no,N,133,,177208,30639,PCW
134,,SING,O1P,P,no,N,134,,177208,30639,PCW
135,,SING,O1P,H1P,no,N,135,,177208,30639,PCW
136,,DOUB,O2P,P,no,N,136,,177208,30639,PCW
137,,SING,O3P,P,no,N,137,,177208,30639,PCW
138,,SING,O4P,P,no,N,138,,177208,30639,PCW
1,,SING,C1,O3,no,N,1,,177209,30639,17F
2,,SING,N1,C2,no,N,2,,177209,30639,17F
3,,DOUB,O1,P1,no,N,3,,177209,30639,17F
4,,SING,P1,O6,no,N,4,,177209,30639,17F
5,,SING,C2,C1,no,N,5,,177209,30639,17F
6,,SING,O2,P1,no,N,6,,177209,30639,17F
7,,SING,C3,C2,no,N,7,,177209,30639,17F
8,,SING,C3,O5,no,N,8,,177209,30639,17F
9,,SING,O3,P1,no,N,9,,177209,30639,17F
10,,SING,C4,C5,no,N,10,,177209,30639,17F
11,,DOUB,O4,C3,no,N,11,,177209,30639,17F
12,,SING,C5,C6,no,N,12,,177209,30639,17F
13,,SING,C5,O9,no,N,13,,177209,30639,17F
14,,SING,C6,O7,no,N,14,,177209,30639,17F
15,,SING,O6,C4,no,N,15,,177209,30639,17F
16,,SING,C7,C8,no,N,16,,177209,30639,17F
17,,SING,O7,C7,no,N,17,,177209,30639,17F
18,,SING,C8,C9,no,N,18,,177209,30639,17F
19,,DOUB,O8,C7,no,N,19,,177209,30639,17F
20,,SING,C9,C10,no,N,20,,177209,30639,17F
21,,SING,O9,C17,no,N,21,,177209,30639,17F
22,,SING,C10,C11,no,N,22,,177209,30639,17F
23,,SING,C11,C12,no,N,23,,177209,30639,17F
24,,SING,C12,C1X,no,N,24,,177209,30639,17F
25,,DOUB,C17,O10,no,N,25,,177209,30639,17F
26,,SING,C17,C18,no,N,26,,177209,30639,17F
27,,SING,C18,C19,no,N,27,,177209,30639,17F
28,,SING,C19,C20,no,N,28,,177209,30639,17F
29,,SING,C20,C1Y,no,N,29,,177209,30639,17F
30,,SING,C1Y,C1Z,no,N,30,,177209,30639,17F
31,,SING,C1X,C2X,no,N,31,,177209,30639,17F
32,,SING,C2X,C21,no,N,32,,177209,30639,17F
33,,DOUB,C21,C22,no,Z,33,,177209,30639,17F
34,,SING,C22,C23,no,N,34,,177209,30639,17F
35,,SING,C23,C24,no,N,35,,177209,30639,17F
36,,SING,C24,C25,no,N,36,,177209,30639,17F
37,,SING,C25,C26,no,N,37,,177209,30639,17F
38,,SING,C26,C27,no,N,38,,177209,30639,17F
39,,SING,C27,C28,no,N,39,,177209,30639,17F
40,,SING,C28,C29,no,N,40,,177209,30639,17F
41,,SING,C29,C30,no,N,41,,177209,30639,17F
42,,SING,C1Z,C31,no,N,42,,177209,30639,17F
43,,SING,C31,C32,no,N,43,,177209,30639,17F
44,,SING,C32,C33,no,N,44,,177209,30639,17F
45,,DOUB,C33,C34,no,Z,45,,177209,30639,17F
46,,SING,C34,C35,no,N,46,,177209,30639,17F
47,,SING,C35,C36,no,N,47,,177209,30639,17F
48,,SING,C36,C37,no,N,48,,177209,30639,17F
49,,SING,C37,C38,no,N,49,,177209,30639,17F
50,,SING,C38,C39,no,N,50,,177209,30639,17F
51,,SING,C39,C40,no,N,51,,177209,30639,17F
52,,SING,C40,C41,no,N,52,,177209,30639,17F
53,,SING,C41,C42,no,N,53,,177209,30639,17F
54,,SING,C1,H1,no,N,54,,177209,30639,17F
55,,SING,C1,H1A,no,N,55,,177209,30639,17F
56,,SING,N1,HN1,no,N,56,,177209,30639,17F
57,,SING,N1,HN1A,no,N,57,,177209,30639,17F
58,,SING,C2,H2,no,N,58,,177209,30639,17F
59,,SING,O2,HO2,no,N,59,,177209,30639,17F
60,,SING,C4,H4,no,N,60,,177209,30639,17F
61,,SING,C4,H4A,no,N,61,,177209,30639,17F
62,,SING,C5,H5,no,N,62,,177209,30639,17F
63,,SING,O5,HO5,no,N,63,,177209,30639,17F
64,,SING,C6,H6,no,N,64,,177209,30639,17F
65,,SING,C6,H6A,no,N,65,,177209,30639,17F
66,,SING,C8,H8,no,N,66,,177209,30639,17F
67,,SING,C8,H8A,no,N,67,,177209,30639,17F
68,,SING,C9,H9,no,N,68,,177209,30639,17F
69,,SING,C9,H9A,no,N,69,,177209,30639,17F
70,,SING,C10,H10,no,N,70,,177209,30639,17F
71,,SING,C10,H10A,no,N,71,,177209,30639,17F
72,,SING,C11,H11,no,N,72,,177209,30639,17F
73,,SING,C11,H11A,no,N,73,,177209,30639,17F
74,,SING,C12,H12,no,N,74,,177209,30639,17F
75,,SING,C12,H12A,no,N,75,,177209,30639,17F
76,,SING,C18,H18,no,N,76,,177209,30639,17F
77,,SING,C18,H18A,no,N,77,,177209,30639,17F
78,,SING,C19,H19,no,N,78,,177209,30639,17F
79,,SING,C19,H19A,no,N,79,,177209,30639,17F
80,,SING,C20,H20,no,N,80,,177209,30639,17F
81,,SING,C20,H20A,no,N,81,,177209,30639,17F
82,,SING,C1X,H29,no,N,82,,177209,30639,17F
83,,SING,C1X,H30,no,N,83,,177209,30639,17F
84,,SING,C1Y,H31,no,N,84,,177209,30639,17F
85,,SING,C1Y,H32,no,N,85,,177209,30639,17F
86,,SING,C1Z,H33,no,N,86,,177209,30639,17F
87,,SING,C1Z,H34,no,N,87,,177209,30639,17F
88,,SING,C2X,H35,no,N,88,,177209,30639,17F
89,,SING,C2X,H36,no,N,89,,177209,30639,17F
90,,SING,C21,H37,no,N,90,,177209,30639,17F
91,,SING,C22,H38,no,N,91,,177209,30639,17F
92,,SING,C23,H39,no,N,92,,177209,30639,17F
93,,SING,C23,H40,no,N,93,,177209,30639,17F
94,,SING,C24,H41,no,N,94,,177209,30639,17F
95,,SING,C24,H42,no,N,95,,177209,30639,17F
96,,SING,C25,H43,no,N,96,,177209,30639,17F
97,,SING,C25,H44,no,N,97,,177209,30639,17F
98,,SING,C26,H45,no,N,98,,177209,30639,17F
99,,SING,C26,H46,no,N,99,,177209,30639,17F
100,,SING,C27,H47,no,N,100,,177209,30639,17F
101,,SING,C27,H48,no,N,101,,177209,30639,17F
102,,SING,C28,H49,no,N,102,,177209,30639,17F
103,,SING,C28,H50,no,N,103,,177209,30639,17F
104,,SING,C29,H51,no,N,104,,177209,30639,17F
105,,SING,C29,H52,no,N,105,,177209,30639,17F
106,,SING,C30,H53,no,N,106,,177209,30639,17F
107,,SING,C30,H54,no,N,107,,177209,30639,17F
108,,SING,C30,H55,no,N,108,,177209,30639,17F
109,,SING,C31,H56,no,N,109,,177209,30639,17F
110,,SING,C31,H57,no,N,110,,177209,30639,17F
111,,SING,C32,H58,no,N,111,,177209,30639,17F
112,,SING,C32,H59,no,N,112,,177209,30639,17F
113,,SING,C33,H60,no,N,113,,177209,30639,17F
114,,SING,C34,H61,no,N,114,,177209,30639,17F
115,,SING,C35,H62,no,N,115,,177209,30639,17F
116,,SING,C35,H63,no,N,116,,177209,30639,17F
117,,SING,C36,H64,no,N,117,,177209,30639,17F
118,,SING,C36,H65,no,N,118,,177209,30639,17F
119,,SING,C37,H66,no,N,119,,177209,30639,17F
120,,SING,C37,H67,no,N,120,,177209,30639,17F
121,,SING,C38,H68,no,N,121,,177209,30639,17F
122,,SING,C38,H69,no,N,122,,177209,30639,17F
123,,SING,C39,H70,no,N,123,,177209,30639,17F
124,,SING,C39,H71,no,N,124,,177209,30639,17F
125,,SING,C40,H72,no,N,125,,177209,30639,17F
126,,SING,C40,H73,no,N,126,,177209,30639,17F
127,,SING,C41,H74,no,N,127,,177209,30639,17F
128,,SING,C41,H75,no,N,128,,177209,30639,17F
129,,SING,C42,H76,no,N,129,,177209,30639,17F
130,,SING,C42,H77,no,N,130,,177209,30639,17F
131,,SING,C42,H78,no,N,131,,177209,30639,17F
1,,DOUB,PG,O1G,no,N,1,,177210,30639,GNP
2,,SING,PG,O2G,no,N,2,,177210,30639,GNP
3,,SING,PG,O3G,no,N,3,,177210,30639,GNP
4,,SING,PG,N3B,no,N,4,,177210,30639,GNP
5,,SING,O2G,HOG2,no,N,5,,177210,30639,GNP
6,,SING,O3G,HOG3,no,N,6,,177210,30639,GNP
7,,SING,N3B,PB,no,N,7,,177210,30639,GNP
8,,SING,N3B,HNB3,no,N,8,,177210,30639,GNP
9,,DOUB,PB,O1B,no,N,9,,177210,30639,GNP
10,,SING,PB,O2B,no,N,10,,177210,30639,GNP
11,,SING,PB,O3A,no,N,11,,177210,30639,GNP
12,,SING,O2B,HOB2,no,N,12,,177210,30639,GNP
13,,SING,O3A,PA,no,N,13,,177210,30639,GNP
14,,DOUB,PA,O1A,no,N,14,,177210,30639,GNP
15,,SING,PA,O2A,no,N,15,,177210,30639,GNP
16,,SING,PA,O5',no,N,16,,177210,30639,GNP
17,,SING,O2A,HOA2,no,N,17,,177210,30639,GNP
18,,SING,O5',C5',no,N,18,,177210,30639,GNP
19,,SING,C5',C4',no,N,19,,177210,30639,GNP
20,,SING,C5',H5'2,no,N,20,,177210,30639,GNP
21,,SING,C5',H5'1,no,N,21,,177210,30639,GNP
22,,SING,C4',O4',no,N,22,,177210,30639,GNP
23,,SING,C4',C3',no,N,23,,177210,30639,GNP
24,,SING,C4',H4',no,N,24,,177210,30639,GNP
25,,SING,O4',C1',no,N,25,,177210,30639,GNP
26,,SING,C3',O3',no,N,26,,177210,30639,GNP
27,,SING,C3',C2',no,N,27,,177210,30639,GNP
28,,SING,C3',H3',no,N,28,,177210,30639,GNP
29,,SING,O3',HO3',no,N,29,,177210,30639,GNP
30,,SING,C2',O2',no,N,30,,177210,30639,GNP
31,,SING,C2',C1',no,N,31,,177210,30639,GNP
32,,SING,C2',H2',no,N,32,,177210,30639,GNP
33,,SING,O2',HO2',no,N,33,,177210,30639,GNP
34,,SING,C1',N9,no,N,34,,177210,30639,GNP
35,,SING,C1',H1',no,N,35,,177210,30639,GNP
36,,SING,N9,C8,yes,N,36,,177210,30639,GNP
37,,SING,N9,C4,yes,N,37,,177210,30639,GNP
38,,DOUB,C8,N7,yes,N,38,,177210,30639,GNP
39,,SING,C8,H8,no,N,39,,177210,30639,GNP
40,,SING,N7,C5,yes,N,40,,177210,30639,GNP
41,,SING,C5,C6,yes,N,41,,177210,30639,GNP
42,,DOUB,C5,C4,yes,N,42,,177210,30639,GNP
43,,DOUB,C6,O6,no,N,43,,177210,30639,GNP
44,,SING,C6,N1,yes,N,44,,177210,30639,GNP
45,,SING,N1,C2,yes,N,45,,177210,30639,GNP
46,,SING,N1,HN1,no,N,46,,177210,30639,GNP
47,,SING,C2,N2,no,N,47,,177210,30639,GNP
48,,DOUB,C2,N3,yes,N,48,,177210,30639,GNP
49,,SING,N2,HN21,no,N,49,,177210,30639,GNP
50,,SING,N2,HN22,no,N,50,,177210,30639,GNP
51,,SING,N3,C4,yes,N,51,,177210,30639,GNP
1,,SING,C1,C2,no,N,1,,177246,30640,PCW
2,,SING,C1,O3P,no,N,2,,177246,30640,PCW
3,,SING,C1,H11,no,N,3,,177246,30640,PCW
4,,SING,C1,H12,no,N,4,,177246,30640,PCW
5,,SING,C2,C3,no,N,5,,177246,30640,PCW
6,,SING,C2,O2,no,N,6,,177246,30640,PCW
7,,SING,C2,H2,no,N,7,,177246,30640,PCW
8,,SING,C3,O3,no,N,8,,177246,30640,PCW
9,,SING,C3,H31,no,N,9,,177246,30640,PCW
10,,SING,C3,H32,no,N,10,,177246,30640,PCW
11,,SING,C4,C5,no,N,11,,177246,30640,PCW
12,,SING,C4,O4P,no,N,12,,177246,30640,PCW
13,,SING,C4,H41,no,N,13,,177246,30640,PCW
14,,SING,C4,H42,no,N,14,,177246,30640,PCW
15,,SING,C5,N,no,N,15,,177246,30640,PCW
16,,SING,C5,H51,no,N,16,,177246,30640,PCW
17,,SING,C5,H52,no,N,17,,177246,30640,PCW
18,,SING,C6,N,no,N,18,,177246,30640,PCW
19,,SING,C6,H61,no,N,19,,177246,30640,PCW
20,,SING,C6,H62,no,N,20,,177246,30640,PCW
21,,SING,C6,H63,no,N,21,,177246,30640,PCW
22,,SING,C7,N,no,N,22,,177246,30640,PCW
23,,SING,C7,H71,no,N,23,,177246,30640,PCW
24,,SING,C7,H72,no,N,24,,177246,30640,PCW
25,,SING,C7,H73,no,N,25,,177246,30640,PCW
26,,SING,C8,N,no,N,26,,177246,30640,PCW
27,,SING,C8,H81,no,N,27,,177246,30640,PCW
28,,SING,C8,H82,no,N,28,,177246,30640,PCW
29,,SING,C8,H83,no,N,29,,177246,30640,PCW
30,,SING,C11,C12,no,N,30,,177246,30640,PCW
31,,SING,C11,O3,no,N,31,,177246,30640,PCW
32,,DOUB,C11,O11,no,N,32,,177246,30640,PCW
33,,SING,C12,C13,no,N,33,,177246,30640,PCW
34,,SING,C12,H121,no,N,34,,177246,30640,PCW
35,,SING,C12,H122,no,N,35,,177246,30640,PCW
36,,SING,C13,C14,no,N,36,,177246,30640,PCW
37,,SING,C13,H131,no,N,37,,177246,30640,PCW
38,,SING,C13,H132,no,N,38,,177246,30640,PCW
39,,SING,C14,C15,no,N,39,,177246,30640,PCW
40,,SING,C14,H141,no,N,40,,177246,30640,PCW
41,,SING,C14,H142,no,N,41,,177246,30640,PCW
42,,SING,C15,C16,no,N,42,,177246,30640,PCW
43,,SING,C15,H151,no,N,43,,177246,30640,PCW
44,,SING,C15,H152,no,N,44,,177246,30640,PCW
45,,SING,C16,C17,no,N,45,,177246,30640,PCW
46,,SING,C16,H161,no,N,46,,177246,30640,PCW
47,,SING,C16,H162,no,N,47,,177246,30640,PCW
48,,SING,C17,C18,no,N,48,,177246,30640,PCW
49,,SING,C17,H171,no,N,49,,177246,30640,PCW
50,,SING,C17,H172,no,N,50,,177246,30640,PCW
51,,SING,C18,C19,no,N,51,,177246,30640,PCW
52,,SING,C18,H181,no,N,52,,177246,30640,PCW
53,,SING,C18,H182,no,N,53,,177246,30640,PCW
54,,DOUB,C19,C20,no,Z,54,,177246,30640,PCW
55,,SING,C19,H19,no,N,55,,177246,30640,PCW
56,,SING,C20,C21,no,N,56,,177246,30640,PCW
57,,SING,C20,H20,no,N,57,,177246,30640,PCW
58,,SING,C21,C22,no,N,58,,177246,30640,PCW
59,,SING,C21,H211,no,N,59,,177246,30640,PCW
60,,SING,C21,H212,no,N,60,,177246,30640,PCW
61,,SING,C22,C23,no,N,61,,177246,30640,PCW
62,,SING,C22,H221,no,N,62,,177246,30640,PCW
63,,SING,C22,H222,no,N,63,,177246,30640,PCW
64,,SING,C23,C24,no,N,64,,177246,30640,PCW
65,,SING,C23,H231,no,N,65,,177246,30640,PCW
66,,SING,C23,H232,no,N,66,,177246,30640,PCW
67,,SING,C24,C25,no,N,67,,177246,30640,PCW
68,,SING,C24,H241,no,N,68,,177246,30640,PCW
69,,SING,C24,H242,no,N,69,,177246,30640,PCW
70,,SING,C25,C26,no,N,70,,177246,30640,PCW
71,,SING,C25,H251,no,N,71,,177246,30640,PCW
72,,SING,C25,H252,no,N,72,,177246,30640,PCW
73,,SING,C26,C27,no,N,73,,177246,30640,PCW
74,,SING,C26,H261,no,N,74,,177246,30640,PCW
75,,SING,C26,H262,no,N,75,,177246,30640,PCW
76,,SING,C27,C28,no,N,76,,177246,30640,PCW
77,,SING,C27,H271,no,N,77,,177246,30640,PCW
78,,SING,C27,H272,no,N,78,,177246,30640,PCW
79,,SING,C28,H281,no,N,79,,177246,30640,PCW
80,,SING,C28,H282,no,N,80,,177246,30640,PCW
81,,SING,C28,H283,no,N,81,,177246,30640,PCW
82,,SING,C31,C32,no,N,82,,177246,30640,PCW
83,,SING,C31,O2,no,N,83,,177246,30640,PCW
84,,DOUB,C31,O31,no,N,84,,177246,30640,PCW
85,,SING,C32,C33,no,N,85,,177246,30640,PCW
86,,SING,C32,H321,no,N,86,,177246,30640,PCW
87,,SING,C32,H322,no,N,87,,177246,30640,PCW
88,,SING,C33,C34,no,N,88,,177246,30640,PCW
89,,SING,C33,H331,no,N,89,,177246,30640,PCW
90,,SING,C33,H332,no,N,90,,177246,30640,PCW
91,,SING,C34,C35,no,N,91,,177246,30640,PCW
92,,SING,C34,H341,no,N,92,,177246,30640,PCW
93,,SING,C34,H342,no,N,93,,177246,30640,PCW
94,,SING,C35,C36,no,N,94,,177246,30640,PCW
95,,SING,C35,H351,no,N,95,,177246,30640,PCW
96,,SING,C35,H352,no,N,96,,177246,30640,PCW
97,,SING,C36,C37,no,N,97,,177246,30640,PCW
98,,SING,C36,H361,no,N,98,,177246,30640,PCW
99,,SING,C36,H362,no,N,99,,177246,30640,PCW
100,,SING,C37,C38,no,N,100,,177246,30640,PCW
101,,SING,C37,H371,no,N,101,,177246,30640,PCW
102,,SING,C37,H372,no,N,102,,177246,30640,PCW
103,,SING,C38,C39,no,N,103,,177246,30640,PCW
104,,SING,C38,H381,no,N,104,,177246,30640,PCW
105,,SING,C38,H382,no,N,105,,177246,30640,PCW
106,,DOUB,C39,C40,no,Z,106,,177246,30640,PCW
107,,SING,C39,H39,no,N,107,,177246,30640,PCW
108,,SING,C40,C41,no,N,108,,177246,30640,PCW
109,,SING,C40,H40,no,N,109,,177246,30640,PCW
110,,SING,C41,C42,no,N,110,,177246,30640,PCW
111,,SING,C41,H411,no,N,111,,177246,30640,PCW
112,,SING,C41,H412,no,N,112,,177246,30640,PCW
113,,SING,C42,C43,no,N,113,,177246,30640,PCW
114,,SING,C42,H421,no,N,114,,177246,30640,PCW
115,,SING,C42,H422,no,N,115,,177246,30640,PCW
116,,SING,C43,C44,no,N,116,,177246,30640,PCW
117,,SING,C43,H431,no,N,117,,177246,30640,PCW
118,,SING,C43,H432,no,N,118,,177246,30640,PCW
119,,SING,C44,C45,no,N,119,,177246,30640,PCW
120,,SING,C44,H441,no,N,120,,177246,30640,PCW
121,,SING,C44,H442,no,N,121,,177246,30640,PCW
122,,SING,C45,C46,no,N,122,,177246,30640,PCW
123,,SING,C45,H451,no,N,123,,177246,30640,PCW
124,,SING,C45,H452,no,N,124,,177246,30640,PCW
125,,SING,C46,C47,no,N,125,,177246,30640,PCW
126,,SING,C46,H461,no,N,126,,177246,30640,PCW
127,,SING,C46,H462,no,N,127,,177246,30640,PCW
128,,SING,C47,C48,no,N,128,,177246,30640,PCW
129,,SING,C47,H471,no,N,129,,177246,30640,PCW
130,,SING,C47,H472,no,N,130,,177246,30640,PCW
131,,SING,C48,H481,no,N,131,,177246,30640,PCW
132,,SING,C48,H482,no,N,132,,177246,30640,PCW
133,,SING,C48,H483,no,N,133,,177246,30640,PCW
134,,SING,O1P,P,no,N,134,,177246,30640,PCW
135,,SING,O1P,H1P,no,N,135,,177246,30640,PCW
136,,DOUB,O2P,P,no,N,136,,177246,30640,PCW
137,,SING,O3P,P,no,N,137,,177246,30640,PCW
138,,SING,O4P,P,no,N,138,,177246,30640,PCW
1,,SING,C1,O3,no,N,1,,177247,30640,17F
2,,SING,N1,C2,no,N,2,,177247,30640,17F
3,,DOUB,O1,P1,no,N,3,,177247,30640,17F
4,,SING,P1,O6,no,N,4,,177247,30640,17F
5,,SING,C2,C1,no,N,5,,177247,30640,17F
6,,SING,O2,P1,no,N,6,,177247,30640,17F
7,,SING,C3,C2,no,N,7,,177247,30640,17F
8,,SING,C3,O5,no,N,8,,177247,30640,17F
9,,SING,O3,P1,no,N,9,,177247,30640,17F
10,,SING,C4,C5,no,N,10,,177247,30640,17F
11,,DOUB,O4,C3,no,N,11,,177247,30640,17F
12,,SING,C5,C6,no,N,12,,177247,30640,17F
13,,SING,C5,O9,no,N,13,,177247,30640,17F
14,,SING,C6,O7,no,N,14,,177247,30640,17F
15,,SING,O6,C4,no,N,15,,177247,30640,17F
16,,SING,C7,C8,no,N,16,,177247,30640,17F
17,,SING,O7,C7,no,N,17,,177247,30640,17F
18,,SING,C8,C9,no,N,18,,177247,30640,17F
19,,DOUB,O8,C7,no,N,19,,177247,30640,17F
20,,SING,C9,C10,no,N,20,,177247,30640,17F
21,,SING,O9,C17,no,N,21,,177247,30640,17F
22,,SING,C10,C11,no,N,22,,177247,30640,17F
23,,SING,C11,C12,no,N,23,,177247,30640,17F
24,,SING,C12,C1X,no,N,24,,177247,30640,17F
25,,DOUB,C17,O10,no,N,25,,177247,30640,17F
26,,SING,C17,C18,no,N,26,,177247,30640,17F
27,,SING,C18,C19,no,N,27,,177247,30640,17F
28,,SING,C19,C20,no,N,28,,177247,30640,17F
29,,SING,C20,C1Y,no,N,29,,177247,30640,17F
30,,SING,C1Y,C1Z,no,N,30,,177247,30640,17F
31,,SING,C1X,C2X,no,N,31,,177247,30640,17F
32,,SING,C2X,C21,no,N,32,,177247,30640,17F
33,,DOUB,C21,C22,no,Z,33,,177247,30640,17F
34,,SING,C22,C23,no,N,34,,177247,30640,17F
35,,SING,C23,C24,no,N,35,,177247,30640,17F
36,,SING,C24,C25,no,N,36,,177247,30640,17F
37,,SING,C25,C26,no,N,37,,177247,30640,17F
38,,SING,C26,C27,no,N,38,,177247,30640,17F
39,,SING,C27,C28,no,N,39,,177247,30640,17F
40,,SING,C28,C29,no,N,40,,177247,30640,17F
41,,SING,C29,C30,no,N,41,,177247,30640,17F
42,,SING,C1Z,C31,no,N,42,,177247,30640,17F
43,,SING,C31,C32,no,N,43,,177247,30640,17F
44,,SING,C32,C33,no,N,44,,177247,30640,17F
45,,DOUB,C33,C34,no,Z,45,,177247,30640,17F
46,,SING,C34,C35,no,N,46,,177247,30640,17F
47,,SING,C35,C36,no,N,47,,177247,30640,17F
48,,SING,C36,C37,no,N,48,,177247,30640,17F
49,,SING,C37,C38,no,N,49,,177247,30640,17F
50,,SING,C38,C39,no,N,50,,177247,30640,17F
51,,SING,C39,C40,no,N,51,,177247,30640,17F
52,,SING,C40,C41,no,N,52,,177247,30640,17F
53,,SING,C41,C42,no,N,53,,177247,30640,17F
54,,SING,C1,H1,no,N,54,,177247,30640,17F
55,,SING,C1,H1A,no,N,55,,177247,30640,17F
56,,SING,N1,HN1,no,N,56,,177247,30640,17F
57,,SING,N1,HN1A,no,N,57,,177247,30640,17F
58,,SING,C2,H2,no,N,58,,177247,30640,17F
59,,SING,O2,HO2,no,N,59,,177247,30640,17F
60,,SING,C4,H4,no,N,60,,177247,30640,17F
61,,SING,C4,H4A,no,N,61,,177247,30640,17F
62,,SING,C5,H5,no,N,62,,177247,30640,17F
63,,SING,O5,HO5,no,N,63,,177247,30640,17F
64,,SING,C6,H6,no,N,64,,177247,30640,17F
65,,SING,C6,H6A,no,N,65,,177247,30640,17F
66,,SING,C8,H8,no,N,66,,177247,30640,17F
67,,SING,C8,H8A,no,N,67,,177247,30640,17F
68,,SING,C9,H9,no,N,68,,177247,30640,17F
69,,SING,C9,H9A,no,N,69,,177247,30640,17F
70,,SING,C10,H10,no,N,70,,177247,30640,17F
71,,SING,C10,H10A,no,N,71,,177247,30640,17F
72,,SING,C11,H11,no,N,72,,177247,30640,17F
73,,SING,C11,H11A,no,N,73,,177247,30640,17F
74,,SING,C12,H12,no,N,74,,177247,30640,17F
75,,SING,C12,H12A,no,N,75,,177247,30640,17F
76,,SING,C18,H18,no,N,76,,177247,30640,17F
77,,SING,C18,H18A,no,N,77,,177247,30640,17F
78,,SING,C19,H19,no,N,78,,177247,30640,17F
79,,SING,C19,H19A,no,N,79,,177247,30640,17F
80,,SING,C20,H20,no,N,80,,177247,30640,17F
81,,SING,C20,H20A,no,N,81,,177247,30640,17F
82,,SING,C1X,H29,no,N,82,,177247,30640,17F
83,,SING,C1X,H30,no,N,83,,177247,30640,17F
84,,SING,C1Y,H31,no,N,84,,177247,30640,17F
85,,SING,C1Y,H32,no,N,85,,177247,30640,17F
86,,SING,C1Z,H33,no,N,86,,177247,30640,17F
87,,SING,C1Z,H34,no,N,87,,177247,30640,17F
88,,SING,C2X,H35,no,N,88,,177247,30640,17F
89,,SING,C2X,H36,no,N,89,,177247,30640,17F
90,,SING,C21,H37,no,N,90,,177247,30640,17F
91,,SING,C22,H38,no,N,91,,177247,30640,17F
92,,SING,C23,H39,no,N,92,,177247,30640,17F
93,,SING,C23,H40,no,N,93,,177247,30640,17F
94,,SING,C24,H41,no,N,94,,177247,30640,17F
95,,SING,C24,H42,no,N,95,,177247,30640,17F
96,,SING,C25,H43,no,N,96,,177247,30640,17F
97,,SING,C25,H44,no,N,97,,177247,30640,17F
98,,SING,C26,H45,no,N,98,,177247,30640,17F
99,,SING,C26,H46,no,N,99,,177247,30640,17F
100,,SING,C27,H47,no,N,100,,177247,30640,17F
101,,SING,C27,H48,no,N,101,,177247,30640,17F
102,,SING,C28,H49,no,N,102,,177247,30640,17F
103,,SING,C28,H50,no,N,103,,177247,30640,17F
104,,SING,C29,H51,no,N,104,,177247,30640,17F
105,,SING,C29,H52,no,N,105,,177247,30640,17F
106,,SING,C30,H53,no,N,106,,177247,30640,17F
107,,SING,C30,H54,no,N,107,,177247,30640,17F
108,,SING,C30,H55,no,N,108,,177247,30640,17F
109,,SING,C31,H56,no,N,109,,177247,30640,17F
110,,SING,C31,H57,no,N,110,,177247,30640,17F
111,,SING,C32,H58,no,N,111,,177247,30640,17F
112,,SING,C32,H59,no,N,112,,177247,30640,17F
113,,SING,C33,H60,no,N,113,,177247,30640,17F
114,,SING,C34,H61,no,N,114,,177247,30640,17F
115,,SING,C35,H62,no,N,115,,177247,30640,17F
116,,SING,C35,H63,no,N,116,,177247,30640,17F
117,,SING,C36,H64,no,N,117,,177247,30640,17F
118,,SING,C36,H65,no,N,118,,177247,30640,17F
119,,SING,C37,H66,no,N,119,,177247,30640,17F
120,,SING,C37,H67,no,N,120,,177247,30640,17F
121,,SING,C38,H68,no,N,121,,177247,30640,17F
122,,SING,C38,H69,no,N,122,,177247,30640,17F
123,,SING,C39,H70,no,N,123,,177247,30640,17F
124,,SING,C39,H71,no,N,124,,177247,30640,17F
125,,SING,C40,H72,no,N,125,,177247,30640,17F
126,,SING,C40,H73,no,N,126,,177247,30640,17F
127,,SING,C41,H74,no,N,127,,177247,30640,17F
128,,SING,C41,H75,no,N,128,,177247,30640,17F
129,,SING,C42,H76,no,N,129,,177247,30640,17F
130,,SING,C42,H77,no,N,130,,177247,30640,17F
131,,SING,C42,H78,no,N,131,,177247,30640,17F
1,,DOUB,PG,O1G,no,N,1,,177248,30640,GNP
2,,SING,PG,O2G,no,N,2,,177248,30640,GNP
3,,SING,PG,O3G,no,N,3,,177248,30640,GNP
4,,SING,PG,N3B,no,N,4,,177248,30640,GNP
5,,SING,O2G,HOG2,no,N,5,,177248,30640,GNP
6,,SING,O3G,HOG3,no,N,6,,177248,30640,GNP
7,,SING,N3B,PB,no,N,7,,177248,30640,GNP
8,,SING,N3B,HNB3,no,N,8,,177248,30640,GNP
9,,DOUB,PB,O1B,no,N,9,,177248,30640,GNP
10,,SING,PB,O2B,no,N,10,,177248,30640,GNP
11,,SING,PB,O3A,no,N,11,,177248,30640,GNP
12,,SING,O2B,HOB2,no,N,12,,177248,30640,GNP
13,,SING,O3A,PA,no,N,13,,177248,30640,GNP
14,,DOUB,PA,O1A,no,N,14,,177248,30640,GNP
15,,SING,PA,O2A,no,N,15,,177248,30640,GNP
16,,SING,PA,O5',no,N,16,,177248,30640,GNP
17,,SING,O2A,HOA2,no,N,17,,177248,30640,GNP
18,,SING,O5',C5',no,N,18,,177248,30640,GNP
19,,SING,C5',C4',no,N,19,,177248,30640,GNP
20,,SING,C5',H5'2,no,N,20,,177248,30640,GNP
21,,SING,C5',H5'1,no,N,21,,177248,30640,GNP
22,,SING,C4',O4',no,N,22,,177248,30640,GNP
23,,SING,C4',C3',no,N,23,,177248,30640,GNP
24,,SING,C4',H4',no,N,24,,177248,30640,GNP
25,,SING,O4',C1',no,N,25,,177248,30640,GNP
26,,SING,C3',O3',no,N,26,,177248,30640,GNP
27,,SING,C3',C2',no,N,27,,177248,30640,GNP
28,,SING,C3',H3',no,N,28,,177248,30640,GNP
29,,SING,O3',HO3',no,N,29,,177248,30640,GNP
30,,SING,C2',O2',no,N,30,,177248,30640,GNP
31,,SING,C2',C1',no,N,31,,177248,30640,GNP
32,,SING,C2',H2',no,N,32,,177248,30640,GNP
33,,SING,O2',HO2',no,N,33,,177248,30640,GNP
34,,SING,C1',N9,no,N,34,,177248,30640,GNP
35,,SING,C1',H1',no,N,35,,177248,30640,GNP
36,,SING,N9,C8,yes,N,36,,177248,30640,GNP
37,,SING,N9,C4,yes,N,37,,177248,30640,GNP
38,,DOUB,C8,N7,yes,N,38,,177248,30640,GNP
39,,SING,C8,H8,no,N,39,,177248,30640,GNP
40,,SING,N7,C5,yes,N,40,,177248,30640,GNP
41,,SING,C5,C6,yes,N,41,,177248,30640,GNP
42,,DOUB,C5,C4,yes,N,42,,177248,30640,GNP
43,,DOUB,C6,O6,no,N,43,,177248,30640,GNP
44,,SING,C6,N1,yes,N,44,,177248,30640,GNP
45,,SING,N1,C2,yes,N,45,,177248,30640,GNP
46,,SING,N1,HN1,no,N,46,,177248,30640,GNP
47,,SING,C2,N2,no,N,47,,177248,30640,GNP
48,,DOUB,C2,N3,yes,N,48,,177248,30640,GNP
49,,SING,N2,HN21,no,N,49,,177248,30640,GNP
50,,SING,N2,HN22,no,N,50,,177248,30640,GNP
51,,SING,N3,C4,yes,N,51,,177248,30640,GNP
1,,SING,N,CA,no,N,1,,177278,30641,DPR
2,,SING,N,CD,no,N,2,,177278,30641,DPR
3,,SING,N,H,no,N,3,,177278,30641,DPR
4,,SING,CA,CB,no,N,4,,177278,30641,DPR
5,,SING,CA,C,no,N,5,,177278,30641,DPR
6,,SING,CA,HA,no,N,6,,177278,30641,DPR
7,,SING,CB,CG,no,N,7,,177278,30641,DPR
8,,SING,CB,HB2,no,N,8,,177278,30641,DPR
9,,SING,CB,HB3,no,N,9,,177278,30641,DPR
10,,SING,CG,CD,no,N,10,,177278,30641,DPR
11,,SING,CG,HG2,no,N,11,,177278,30641,DPR
12,,SING,CG,HG3,no,N,12,,177278,30641,DPR
13,,SING,CD,HD2,no,N,13,,177278,30641,DPR
14,,SING,CD,HD3,no,N,14,,177278,30641,DPR
15,,DOUB,C,O,no,N,15,,177278,30641,DPR
16,,SING,C,OXT,no,N,16,,177278,30641,DPR
17,,SING,OXT,HXT,no,N,17,,177278,30641,DPR
1,,SING,N,HN1,no,N,1,,177279,30641,NH2
2,,SING,N,HN2,no,N,2,,177279,30641,NH2
1,,SING,N,CA,no,N,1,,177280,30641,NLE
2,,SING,N,H,no,N,2,,177280,30641,NLE
3,,SING,N,HN2,no,N,3,,177280,30641,NLE
4,,SING,CA,C,no,N,4,,177280,30641,NLE
5,,SING,CA,CB,no,N,5,,177280,30641,NLE
6,,SING,CA,HA,no,N,6,,177280,30641,NLE
7,,DOUB,C,O,no,N,7,,177280,30641,NLE
8,,SING,C,OXT,no,N,8,,177280,30641,NLE
9,,SING,OXT,HXT,no,N,9,,177280,30641,NLE
10,,SING,CB,CG,no,N,10,,177280,30641,NLE
11,,SING,CB,HB2,no,N,11,,177280,30641,NLE
12,,SING,CB,HB3,no,N,12,,177280,30641,NLE
13,,SING,CG,CD,no,N,13,,177280,30641,NLE
14,,SING,CG,HG2,no,N,14,,177280,30641,NLE
15,,SING,CG,HG3,no,N,15,,177280,30641,NLE
16,,SING,CD,CE,no,N,16,,177280,30641,NLE
17,,SING,CD,HD2,no,N,17,,177280,30641,NLE
18,,SING,CD,HD3,no,N,18,,177280,30641,NLE
19,,SING,CE,HE1,no,N,19,,177280,30641,NLE
20,,SING,CE,HE2,no,N,20,,177280,30641,NLE
21,,SING,CE,HE3,no,N,21,,177280,30641,NLE
1,,SING,N,CA,no,N,1,,177299,30642,AIB
2,,SING,N,H,no,N,2,,177299,30642,AIB
3,,SING,N,H2,no,N,3,,177299,30642,AIB
4,,SING,CA,C,no,N,4,,177299,30642,AIB
5,,SING,CA,CB1,no,N,5,,177299,30642,AIB
6,,SING,CA,CB2,no,N,6,,177299,30642,AIB
7,,DOUB,C,O,no,N,7,,177299,30642,AIB
8,,SING,C,OXT,no,N,8,,177299,30642,AIB
9,,SING,OXT,HO2,no,N,9,,177299,30642,AIB
10,,SING,CB1,HB11,no,N,10,,177299,30642,AIB
11,,SING,CB1,HB12,no,N,11,,177299,30642,AIB
12,,SING,CB1,HB13,no,N,12,,177299,30642,AIB
13,,SING,CB2,HB21,no,N,13,,177299,30642,AIB
14,,SING,CB2,HB22,no,N,14,,177299,30642,AIB
15,,SING,CB2,HB23,no,N,15,,177299,30642,AIB
1,,SING,N,HN1,no,N,1,,177300,30642,NH2
2,,SING,N,HN2,no,N,2,,177300,30642,NH2
1,,SING,N,CA,no,N,1,,177301,30642,NLE
2,,SING,N,H,no,N,2,,177301,30642,NLE
3,,SING,N,HN2,no,N,3,,177301,30642,NLE
4,,SING,CA,C,no,N,4,,177301,30642,NLE
5,,SING,CA,CB,no,N,5,,177301,30642,NLE
6,,SING,CA,HA,no,N,6,,177301,30642,NLE
7,,DOUB,C,O,no,N,7,,177301,30642,NLE
8,,SING,C,OXT,no,N,8,,177301,30642,NLE
9,,SING,OXT,HXT,no,N,9,,177301,30642,NLE
10,,SING,CB,CG,no,N,10,,177301,30642,NLE
11,,SING,CB,HB2,no,N,11,,177301,30642,NLE
12,,SING,CB,HB3,no,N,12,,177301,30642,NLE
13,,SING,CG,CD,no,N,13,,177301,30642,NLE
14,,SING,CG,HG2,no,N,14,,177301,30642,NLE
15,,SING,CG,HG3,no,N,15,,177301,30642,NLE
16,,SING,CD,CE,no,N,16,,177301,30642,NLE
17,,SING,CD,HD2,no,N,17,,177301,30642,NLE
18,,SING,CD,HD3,no,N,18,,177301,30642,NLE
19,,SING,CE,HE1,no,N,19,,177301,30642,NLE
20,,SING,CE,HE2,no,N,20,,177301,30642,NLE
21,,SING,CE,HE3,no,N,21,,177301,30642,NLE
1,,SING,N,HN1,no,N,1,,177320,30643,NH2
2,,SING,N,HN2,no,N,2,,177320,30643,NH2
1,,SING,N,CA,no,N,1,,177321,30643,NLE
2,,SING,N,H,no,N,2,,177321,30643,NLE
3,,SING,N,HN2,no,N,3,,177321,30643,NLE
4,,SING,CA,C,no,N,4,,177321,30643,NLE
5,,SING,CA,CB,no,N,5,,177321,30643,NLE
6,,SING,CA,HA,no,N,6,,177321,30643,NLE
7,,DOUB,C,O,no,N,7,,177321,30643,NLE
8,,SING,C,OXT,no,N,8,,177321,30643,NLE
9,,SING,OXT,HXT,no,N,9,,177321,30643,NLE
10,,SING,CB,CG,no,N,10,,177321,30643,NLE
11,,SING,CB,HB2,no,N,11,,177321,30643,NLE
12,,SING,CB,HB3,no,N,12,,177321,30643,NLE
13,,SING,CG,CD,no,N,13,,177321,30643,NLE
14,,SING,CG,HG2,no,N,14,,177321,30643,NLE
15,,SING,CG,HG3,no,N,15,,177321,30643,NLE
16,,SING,CD,CE,no,N,16,,177321,30643,NLE
17,,SING,CD,HD2,no,N,17,,177321,30643,NLE
18,,SING,CD,HD3,no,N,18,,177321,30643,NLE
19,,SING,CE,HE1,no,N,19,,177321,30643,NLE
20,,SING,CE,HE2,no,N,20,,177321,30643,NLE
21,,SING,CE,HE3,no,N,21,,177321,30643,NLE
1,,SING,N,CA,no,N,1,,177322,30643,ORN
2,,SING,N,H,no,N,2,,177322,30643,ORN
3,,SING,N,H2,no,N,3,,177322,30643,ORN
4,,SING,CA,CB,no,N,4,,177322,30643,ORN
5,,SING,CA,C,no,N,5,,177322,30643,ORN
6,,SING,CA,HA,no,N,6,,177322,30643,ORN
7,,SING,CB,CG,no,N,7,,177322,30643,ORN
8,,SING,CB,HB2,no,N,8,,177322,30643,ORN
9,,SING,CB,HB3,no,N,9,,177322,30643,ORN
10,,SING,CG,CD,no,N,10,,177322,30643,ORN
11,,SING,CG,HG2,no,N,11,,177322,30643,ORN
12,,SING,CG,HG3,no,N,12,,177322,30643,ORN
13,,SING,CD,NE,no,N,13,,177322,30643,ORN
14,,SING,CD,HD2,no,N,14,,177322,30643,ORN
15,,SING,CD,HD3,no,N,15,,177322,30643,ORN
16,,SING,NE,HE1,no,N,16,,177322,30643,ORN
17,,SING,NE,HE2,no,N,17,,177322,30643,ORN
18,,DOUB,C,O,no,N,18,,177322,30643,ORN
19,,SING,C,OXT,no,N,19,,177322,30643,ORN
20,,SING,OXT,HXT,no,N,20,,177322,30643,ORN
1,,DOUB,O,C,no,N,1,,177341,30644,9KK
2,,SING,C,CA,no,N,2,,177341,30644,9KK
3,,SING,CD,CG,no,N,3,,177341,30644,9KK
4,,SING,CD,CE,no,N,4,,177341,30644,9KK
5,,SING,CB,CA,no,N,5,,177341,30644,9KK
6,,SING,CB,CG,no,N,6,,177341,30644,9KK
7,,SING,CA,N,no,N,7,,177341,30644,9KK
8,,SING,N,CM,no,N,8,,177341,30644,9KK
9,,SING,C,OXT,no,N,9,,177341,30644,9KK
10,,SING,N,H,no,N,10,,177341,30644,9KK
11,,SING,CE,HE3,no,N,11,,177341,30644,9KK
12,,SING,CE,HE2,no,N,12,,177341,30644,9KK
13,,SING,CE,HE1,no,N,13,,177341,30644,9KK
14,,SING,CD,HD2,no,N,14,,177341,30644,9KK
15,,SING,CD,HD3,no,N,15,,177341,30644,9KK
16,,SING,CG,HG2,no,N,16,,177341,30644,9KK
17,,SING,CG,HG3,no,N,17,,177341,30644,9KK
18,,SING,CB,HB2,no,N,18,,177341,30644,9KK
19,,SING,CB,HB3,no,N,19,,177341,30644,9KK
20,,SING,CA,HA,no,N,20,,177341,30644,9KK
21,,SING,CM,HM1,no,N,21,,177341,30644,9KK
22,,SING,CM,HM3,no,N,22,,177341,30644,9KK
23,,SING,CM,HM2,no,N,23,,177341,30644,9KK
24,,SING,OXT,HXT,no,N,24,,177341,30644,9KK
1,,SING,N,CA,no,N,1,,177342,30644,AIB
2,,SING,N,H,no,N,2,,177342,30644,AIB
3,,SING,N,H2,no,N,3,,177342,30644,AIB
4,,SING,CA,C,no,N,4,,177342,30644,AIB
5,,SING,CA,CB1,no,N,5,,177342,30644,AIB
6,,SING,CA,CB2,no,N,6,,177342,30644,AIB
7,,DOUB,C,O,no,N,7,,177342,30644,AIB
8,,SING,C,OXT,no,N,8,,177342,30644,AIB
9,,SING,OXT,HO2,no,N,9,,177342,30644,AIB
10,,SING,CB1,HB11,no,N,10,,177342,30644,AIB
11,,SING,CB1,HB12,no,N,11,,177342,30644,AIB
12,,SING,CB1,HB13,no,N,12,,177342,30644,AIB
13,,SING,CB2,HB21,no,N,13,,177342,30644,AIB
14,,SING,CB2,HB22,no,N,14,,177342,30644,AIB
15,,SING,CB2,HB23,no,N,15,,177342,30644,AIB
1,,SING,OE1,CD,no,N,1,,177343,30644,B3D
2,,SING,OE1,HE1,no,N,2,,177343,30644,B3D
3,,DOUB,CD,OE2,no,N,3,,177343,30644,B3D
4,,SING,CD,CG,no,N,4,,177343,30644,B3D
5,,SING,CG,CB,no,N,5,,177343,30644,B3D
6,,SING,CG,HG3,no,N,6,,177343,30644,B3D
7,,SING,CG,HG2,no,N,7,,177343,30644,B3D
8,,SING,CB,N,no,N,8,,177343,30644,B3D
9,,SING,CB,CA,no,N,9,,177343,30644,B3D
10,,SING,CB,HB,no,N,10,,177343,30644,B3D
11,,SING,N,H,no,N,11,,177343,30644,B3D
12,,SING,N,H2,no,N,12,,177343,30644,B3D
13,,SING,CA,C,no,N,13,,177343,30644,B3D
14,,SING,CA,HA1,no,N,14,,177343,30644,B3D
15,,SING,CA,HA2,no,N,15,,177343,30644,B3D
16,,SING,C,OXT,no,N,16,,177343,30644,B3D
17,,DOUB,C,O,no,N,17,,177343,30644,B3D
18,,SING,OXT,HXT,no,N,18,,177343,30644,B3D
1,,SING,CG,CD2,no,N,1,,177344,30644,B3T
2,,SING,OD1,CG,no,N,2,,177344,30644,B3T
3,,SING,CD2,H1D2,no,N,3,,177344,30644,B3T
4,,SING,CD2,H2D2,no,N,4,,177344,30644,B3T
5,,SING,CD2,H3D2,no,N,5,,177344,30644,B3T
6,,SING,CB,CG,no,N,6,,177344,30644,B3T
7,,SING,CB,N,no,N,7,,177344,30644,B3T
8,,SING,N,HNA,no,N,8,,177344,30644,B3T
9,,SING,CA,CB,no,N,9,,177344,30644,B3T
10,,SING,CA,HA,no,N,10,,177344,30644,B3T
11,,SING,CA,HAA,no,N,11,,177344,30644,B3T
12,,SING,C,CA,no,N,12,,177344,30644,B3T
13,,SING,C,OXT,no,N,13,,177344,30644,B3T
14,,DOUB,O,C,no,N,14,,177344,30644,B3T
15,,SING,HG,CG,no,N,15,,177344,30644,B3T
16,,SING,HOD1,OD1,no,N,16,,177344,30644,B3T
17,,SING,HB,CB,no,N,17,,177344,30644,B3T
18,,SING,HN,N,no,N,18,,177344,30644,B3T
19,,SING,OXT,HXT,no,N,19,,177344,30644,B3T
1,,SING,N,CA,no,N,1,,177345,30644,HMR
2,,SING,N,H,no,N,2,,177345,30644,HMR
3,,SING,N,H2,no,N,3,,177345,30644,HMR
4,,SING,CA,CB,no,N,4,,177345,30644,HMR
5,,SING,CA,CH2,no,N,5,,177345,30644,HMR
6,,SING,CA,HA,no,N,6,,177345,30644,HMR
7,,SING,CB,CG,no,N,7,,177345,30644,HMR
8,,SING,CB,HB2,no,N,8,,177345,30644,HMR
9,,SING,CB,HB3,no,N,9,,177345,30644,HMR
10,,SING,CG,CD,no,N,10,,177345,30644,HMR
11,,SING,CG,HG2,no,N,11,,177345,30644,HMR
12,,SING,CG,HG3,no,N,12,,177345,30644,HMR
13,,SING,CD,NE,no,N,13,,177345,30644,HMR
14,,SING,CD,HD2,no,N,14,,177345,30644,HMR
15,,SING,CD,HD3,no,N,15,,177345,30644,HMR
16,,SING,NE,CZ,no,N,16,,177345,30644,HMR
17,,SING,NE,HE,no,N,17,,177345,30644,HMR
18,,DOUB,CZ,NH1,no,N,18,,177345,30644,HMR
19,,SING,CZ,NH2,no,N,19,,177345,30644,HMR
20,,SING,NH1,HH1,no,N,20,,177345,30644,HMR
21,,SING,NH2,HH21,no,N,21,,177345,30644,HMR
22,,SING,NH2,HH22,no,N,22,,177345,30644,HMR
23,,DOUB,C,O,no,N,23,,177345,30644,HMR
24,,SING,C,CH2,no,N,24,,177345,30644,HMR
25,,SING,C,OXT,no,N,25,,177345,30644,HMR
26,,SING,CH2,HC1,no,N,26,,177345,30644,HMR
27,,SING,CH2,HC2,no,N,27,,177345,30644,HMR
28,,SING,OXT,HXT,no,N,28,,177345,30644,HMR
1,,SING,N,CA,no,N,1,,177346,30644,MMO
2,,SING,N,CN,no,N,2,,177346,30644,MMO
3,,SING,N,H2,no,N,3,,177346,30644,MMO
4,,SING,CA,C,no,N,4,,177346,30644,MMO
5,,SING,CA,CB,no,N,5,,177346,30644,MMO
6,,SING,CA,HA,no,N,6,,177346,30644,MMO
7,,DOUB,C,O,no,N,7,,177346,30644,MMO
8,,SING,CB,CG,no,N,8,,177346,30644,MMO
9,,SING,CB,HCB1,no,N,9,,177346,30644,MMO
10,,SING,CB,HCB2,no,N,10,,177346,30644,MMO
11,,SING,CG,CD,no,N,11,,177346,30644,MMO
12,,SING,CG,HCG1,no,N,12,,177346,30644,MMO
13,,SING,CG,HCG2,no,N,13,,177346,30644,MMO
14,,SING,CD,NE,no,N,14,,177346,30644,MMO
15,,SING,CD,HCD1,no,N,15,,177346,30644,MMO
16,,SING,CD,HCD2,no,N,16,,177346,30644,MMO
17,,SING,NE,CZ,no,N,17,,177346,30644,MMO
18,,SING,CZ,NH2,no,N,18,,177346,30644,MMO
19,,DOUB,CZ,NH1,no,N,19,,177346,30644,MMO
20,,SING,NH2,HH21,no,N,20,,177346,30644,MMO
21,,SING,NH2,HH22,no,N,21,,177346,30644,MMO
22,,SING,NH1,HH11,no,N,22,,177346,30644,MMO
23,,SING,CN,HC1,no,N,23,,177346,30644,MMO
24,,SING,CN,HC2,no,N,24,,177346,30644,MMO
25,,SING,CN,HC3,no,N,25,,177346,30644,MMO
26,,SING,C,OXT,no,N,26,,177346,30644,MMO
27,,SING,OXT,HXT,no,N,27,,177346,30644,MMO
28,,SING,NE,HE,no,N,28,,177346,30644,MMO
1,,SING,N,HN1,no,N,1,,177347,30644,NH2
2,,SING,N,HN2,no,N,2,,177347,30644,NH2
1,,SING,C,N,no,N,1,,177515,30654,WMH
2,,SING,N,N2,yes,N,2,,177515,30654,WMH
3,,SING,N,C1,yes,N,3,,177515,30654,WMH
4,,DOUB,N2,N1,yes,N,4,,177515,30654,WMH
5,,DOUB,C1,C2,yes,N,5,,177515,30654,WMH
6,,SING,N1,C2,yes,N,6,,177515,30654,WMH
7,,SING,C,H1,no,N,7,,177515,30654,WMH
8,,SING,C,H2,no,N,8,,177515,30654,WMH
9,,SING,C,H3,no,N,9,,177515,30654,WMH
10,,SING,C1,H4,no,N,10,,177515,30654,WMH
11,,SING,C2,H5,no,N,11,,177515,30654,WMH
1,,SING,C,N,no,N,1,,177840,30669,WMH
2,,SING,N,N2,yes,N,2,,177840,30669,WMH
3,,SING,N,C1,yes,N,3,,177840,30669,WMH
4,,DOUB,N2,N1,yes,N,4,,177840,30669,WMH
5,,DOUB,C1,C2,yes,N,5,,177840,30669,WMH
6,,SING,N1,C2,yes,N,6,,177840,30669,WMH
7,,SING,C,H1,no,N,7,,177840,30669,WMH
8,,SING,C,H2,no,N,8,,177840,30669,WMH
9,,SING,C,H3,no,N,9,,177840,30669,WMH
10,,SING,C1,H4,no,N,10,,177840,30669,WMH
11,,SING,C2,H5,no,N,11,,177840,30669,WMH
1,,SING,C,N,no,N,1,,177860,30670,WMH
2,,SING,N,N2,yes,N,2,,177860,30670,WMH
3,,SING,N,C1,yes,N,3,,177860,30670,WMH
4,,DOUB,N2,N1,yes,N,4,,177860,30670,WMH
5,,DOUB,C1,C2,yes,N,5,,177860,30670,WMH
6,,SING,N1,C2,yes,N,6,,177860,30670,WMH
7,,SING,C,H1,no,N,7,,177860,30670,WMH
8,,SING,C,H2,no,N,8,,177860,30670,WMH
9,,SING,C,H3,no,N,9,,177860,30670,WMH
10,,SING,C1,H4,no,N,10,,177860,30670,WMH
11,,SING,C2,H5,no,N,11,,177860,30670,WMH
1,,SING,C,N,no,N,1,,177880,30671,WMH
2,,SING,N,N2,yes,N,2,,177880,30671,WMH
3,,SING,N,C1,yes,N,3,,177880,30671,WMH
4,,DOUB,N2,N1,yes,N,4,,177880,30671,WMH
5,,DOUB,C1,C2,yes,N,5,,177880,30671,WMH
6,,SING,N1,C2,yes,N,6,,177880,30671,WMH
7,,SING,C,H1,no,N,7,,177880,30671,WMH
8,,SING,C,H2,no,N,8,,177880,30671,WMH
9,,SING,C,H3,no,N,9,,177880,30671,WMH
10,,SING,C1,H4,no,N,10,,177880,30671,WMH
11,,SING,C2,H5,no,N,11,,177880,30671,WMH
1,,SING,N,HN1,no,N,1,,177920,30673,NH2
2,,SING,N,HN2,no,N,2,,177920,30673,NH2
1,,SING,N,CA,no,N,1,,177921,30673,NLE
2,,SING,N,H,no,N,2,,177921,30673,NLE
3,,SING,N,HN2,no,N,3,,177921,30673,NLE
4,,SING,CA,C,no,N,4,,177921,30673,NLE
5,,SING,CA,CB,no,N,5,,177921,30673,NLE
6,,SING,CA,HA,no,N,6,,177921,30673,NLE
7,,DOUB,C,O,no,N,7,,177921,30673,NLE
8,,SING,C,OXT,no,N,8,,177921,30673,NLE
9,,SING,OXT,HXT,no,N,9,,177921,30673,NLE
10,,SING,CB,CG,no,N,10,,177921,30673,NLE
11,,SING,CB,HB2,no,N,11,,177921,30673,NLE
12,,SING,CB,HB3,no,N,12,,177921,30673,NLE
13,,SING,CG,CD,no,N,13,,177921,30673,NLE
14,,SING,CG,HG2,no,N,14,,177921,30673,NLE
15,,SING,CG,HG3,no,N,15,,177921,30673,NLE
16,,SING,CD,CE,no,N,16,,177921,30673,NLE
17,,SING,CD,HD2,no,N,17,,177921,30673,NLE
18,,SING,CD,HD3,no,N,18,,177921,30673,NLE
19,,SING,CE,HE1,no,N,19,,177921,30673,NLE
20,,SING,CE,HE2,no,N,20,,177921,30673,NLE
21,,SING,CE,HE3,no,N,21,,177921,30673,NLE
1,,SING,N,CA,no,N,1,,177922,30673,NVA
2,,SING,N,H,no,N,2,,177922,30673,NVA
3,,SING,N,H2,no,N,3,,177922,30673,NVA
4,,SING,CA,CB,no,N,4,,177922,30673,NVA
5,,SING,CA,C,no,N,5,,177922,30673,NVA
6,,SING,CA,HA,no,N,6,,177922,30673,NVA
7,,SING,CB,CG,no,N,7,,177922,30673,NVA
8,,SING,CB,HB2,no,N,8,,177922,30673,NVA
9,,SING,CB,HB3,no,N,9,,177922,30673,NVA
10,,SING,CG,CD,no,N,10,,177922,30673,NVA
11,,SING,CG,HG2,no,N,11,,177922,30673,NVA
12,,SING,CG,HG3,no,N,12,,177922,30673,NVA
13,,SING,CD,HD1,no,N,13,,177922,30673,NVA
14,,SING,CD,HD2,no,N,14,,177922,30673,NVA
15,,SING,CD,HD3,no,N,15,,177922,30673,NVA
16,,DOUB,C,O,no,N,16,,177922,30673,NVA
17,,SING,C,OXT,no,N,17,,177922,30673,NVA
18,,SING,OXT,HXT,no,N,18,,177922,30673,NVA
1,,SING,N,HN1,no,N,1,,177941,30674,NH2
2,,SING,N,HN2,no,N,2,,177941,30674,NH2
1,,SING,N,CA,no,N,1,,177942,30674,NLE
2,,SING,N,H,no,N,2,,177942,30674,NLE
3,,SING,N,HN2,no,N,3,,177942,30674,NLE
4,,SING,CA,C,no,N,4,,177942,30674,NLE
5,,SING,CA,CB,no,N,5,,177942,30674,NLE
6,,SING,CA,HA,no,N,6,,177942,30674,NLE
7,,DOUB,C,O,no,N,7,,177942,30674,NLE
8,,SING,C,OXT,no,N,8,,177942,30674,NLE
9,,SING,OXT,HXT,no,N,9,,177942,30674,NLE
10,,SING,CB,CG,no,N,10,,177942,30674,NLE
11,,SING,CB,HB2,no,N,11,,177942,30674,NLE
12,,SING,CB,HB3,no,N,12,,177942,30674,NLE
13,,SING,CG,CD,no,N,13,,177942,30674,NLE
14,,SING,CG,HG2,no,N,14,,177942,30674,NLE
15,,SING,CG,HG3,no,N,15,,177942,30674,NLE
16,,SING,CD,CE,no,N,16,,177942,30674,NLE
17,,SING,CD,HD2,no,N,17,,177942,30674,NLE
18,,SING,CD,HD3,no,N,18,,177942,30674,NLE
19,,SING,CE,HE1,no,N,19,,177942,30674,NLE
20,,SING,CE,HE2,no,N,20,,177942,30674,NLE
21,,SING,CE,HE3,no,N,21,,177942,30674,NLE
1,,SING,O5',C5',no,N,1,,178104,30688,3D1
2,,SING,O5',H5',no,N,2,,178104,30688,3D1
3,,SING,C5',C4',no,N,3,,178104,30688,3D1
4,,SING,C5',H5'1,no,N,4,,178104,30688,3D1
5,,SING,C5',H5'2,no,N,5,,178104,30688,3D1
6,,SING,C4',O4',no,N,6,,178104,30688,3D1
7,,SING,C4',C3',no,N,7,,178104,30688,3D1
8,,SING,C4',H4',no,N,8,,178104,30688,3D1
9,,SING,O4',C1',no,N,9,,178104,30688,3D1
10,,SING,C1',N9,no,N,10,,178104,30688,3D1
11,,SING,C1',C2',no,N,11,,178104,30688,3D1
12,,SING,C1',H1',no,N,12,,178104,30688,3D1
13,,SING,N9,C4,yes,N,13,,178104,30688,3D1
14,,SING,N9,C8,yes,N,14,,178104,30688,3D1
15,,DOUB,C4,N3,yes,N,15,,178104,30688,3D1
16,,SING,C4,C5,yes,N,16,,178104,30688,3D1
17,,SING,N3,C2,yes,N,17,,178104,30688,3D1
18,,DOUB,C2,N1,yes,N,18,,178104,30688,3D1
19,,SING,C2,H2,no,N,19,,178104,30688,3D1
20,,SING,N1,C6,yes,N,20,,178104,30688,3D1
21,,SING,C6,N6,no,N,21,,178104,30688,3D1
22,,DOUB,C6,C5,yes,N,22,,178104,30688,3D1
23,,SING,N6,HN61,no,N,23,,178104,30688,3D1
24,,SING,N6,HN62,no,N,24,,178104,30688,3D1
25,,SING,C5,N7,yes,N,25,,178104,30688,3D1
26,,DOUB,N7,C8,yes,N,26,,178104,30688,3D1
27,,SING,C8,H8,no,N,27,,178104,30688,3D1
28,,SING,C2',C3',no,N,28,,178104,30688,3D1
29,,SING,C2',H2'1,no,N,29,,178104,30688,3D1
30,,SING,C2',H2'2,no,N,30,,178104,30688,3D1
31,,SING,C3',O3',no,N,31,,178104,30688,3D1
32,,SING,C3',H3',no,N,32,,178104,30688,3D1
33,,SING,O3',H1,no,N,33,,178104,30688,3D1
1,,DOUB,P,OP1,no,N,1,,178105,30688,DGP
2,,SING,P,OP2,no,N,2,,178105,30688,DGP
3,,SING,P,OP3,no,N,3,,178105,30688,DGP
4,,SING,P,O5',no,N,4,,178105,30688,DGP
5,,SING,OP2,HOP2,no,N,5,,178105,30688,DGP
6,,SING,OP3,HOP3,no,N,6,,178105,30688,DGP
7,,SING,O5',C5',no,N,7,,178105,30688,DGP
8,,SING,C5',C4',no,N,8,,178105,30688,DGP
9,,SING,C5',H5',no,N,9,,178105,30688,DGP
10,,SING,C5',H5'',no,N,10,,178105,30688,DGP
11,,SING,C4',O4',no,N,11,,178105,30688,DGP
12,,SING,C4',C3',no,N,12,,178105,30688,DGP
13,,SING,C4',H4',no,N,13,,178105,30688,DGP
14,,SING,O4',C1',no,N,14,,178105,30688,DGP
15,,SING,C3',O3',no,N,15,,178105,30688,DGP
16,,SING,C3',C2',no,N,16,,178105,30688,DGP
17,,SING,C3',H3',no,N,17,,178105,30688,DGP
18,,SING,O3',HO3',no,N,18,,178105,30688,DGP
19,,SING,C2',C1',no,N,19,,178105,30688,DGP
20,,SING,C2',H2',no,N,20,,178105,30688,DGP
21,,SING,C2',H2'',no,N,21,,178105,30688,DGP
22,,SING,C1',N9,no,N,22,,178105,30688,DGP
23,,SING,C1',H1',no,N,23,,178105,30688,DGP
24,,SING,N9,C8,yes,N,24,,178105,30688,DGP
25,,SING,N9,C4,yes,N,25,,178105,30688,DGP
26,,DOUB,C8,N7,yes,N,26,,178105,30688,DGP
27,,SING,C8,H8,no,N,27,,178105,30688,DGP
28,,SING,N7,C5,yes,N,28,,178105,30688,DGP
29,,SING,C5,C6,no,N,29,,178105,30688,DGP
30,,DOUB,C5,C4,yes,N,30,,178105,30688,DGP
31,,DOUB,C6,O6,no,N,31,,178105,30688,DGP
32,,SING,C6,N1,no,N,32,,178105,30688,DGP
33,,SING,N1,C2,no,N,33,,178105,30688,DGP
34,,SING,N1,HN1,no,N,34,,178105,30688,DGP
35,,SING,C2,N2,no,N,35,,178105,30688,DGP
36,,DOUB,C2,N3,no,N,36,,178105,30688,DGP
37,,SING,N2,HN21,no,N,37,,178105,30688,DGP
38,,SING,N2,HN22,no,N,38,,178105,30688,DGP
39,,SING,N3,C4,no,N,39,,178105,30688,DGP
1,,SING,N,CA,no,N,1,,178125,30690,DPP
2,,SING,N,H,no,N,2,,178125,30690,DPP
3,,SING,N,H2,no,N,3,,178125,30690,DPP
4,,SING,CA,C,no,N,4,,178125,30690,DPP
5,,SING,CA,CB,no,N,5,,178125,30690,DPP
6,,SING,CA,HA,no,N,6,,178125,30690,DPP
7,,DOUB,C,O,no,N,7,,178125,30690,DPP
8,,SING,C,OXT,no,N,8,,178125,30690,DPP
9,,SING,CB,NG,no,N,9,,178125,30690,DPP
10,,SING,CB,HB2,no,N,10,,178125,30690,DPP
11,,SING,CB,HB3,no,N,11,,178125,30690,DPP
12,,SING,NG,HG1,no,N,12,,178125,30690,DPP
13,,SING,NG,HG2,no,N,13,,178125,30690,DPP
14,,SING,OXT,HXT,no,N,14,,178125,30690,DPP
1,,DOUB,PB,O1B,no,N,1,,178185,30694,GDP
2,,SING,PB,O2B,no,N,2,,178185,30694,GDP
3,,SING,PB,O3B,no,N,3,,178185,30694,GDP
4,,SING,PB,O3A,no,N,4,,178185,30694,GDP
5,,SING,O2B,HOB2,no,N,5,,178185,30694,GDP
6,,SING,O3B,HOB3,no,N,6,,178185,30694,GDP
7,,SING,O3A,PA,no,N,7,,178185,30694,GDP
8,,DOUB,PA,O1A,no,N,8,,178185,30694,GDP
9,,SING,PA,O2A,no,N,9,,178185,30694,GDP
10,,SING,PA,O5',no,N,10,,178185,30694,GDP
11,,SING,O2A,HOA2,no,N,11,,178185,30694,GDP
12,,SING,O5',C5',no,N,12,,178185,30694,GDP
13,,SING,C5',C4',no,N,13,,178185,30694,GDP
14,,SING,C5',H5',no,N,14,,178185,30694,GDP
15,,SING,C5',H5'',no,N,15,,178185,30694,GDP
16,,SING,C4',O4',no,N,16,,178185,30694,GDP
17,,SING,C4',C3',no,N,17,,178185,30694,GDP
18,,SING,C4',H4',no,N,18,,178185,30694,GDP
19,,SING,O4',C1',no,N,19,,178185,30694,GDP
20,,SING,C3',O3',no,N,20,,178185,30694,GDP
21,,SING,C3',C2',no,N,21,,178185,30694,GDP
22,,SING,C3',H3',no,N,22,,178185,30694,GDP
23,,SING,O3',HO3',no,N,23,,178185,30694,GDP
24,,SING,C2',O2',no,N,24,,178185,30694,GDP
25,,SING,C2',C1',no,N,25,,178185,30694,GDP
26,,SING,C2',H2',no,N,26,,178185,30694,GDP
27,,SING,O2',HO2',no,N,27,,178185,30694,GDP
28,,SING,C1',N9,no,N,28,,178185,30694,GDP
29,,SING,C1',H1',no,N,29,,178185,30694,GDP
30,,SING,N9,C8,yes,N,30,,178185,30694,GDP
31,,SING,N9,C4,yes,N,31,,178185,30694,GDP
32,,DOUB,C8,N7,yes,N,32,,178185,30694,GDP
33,,SING,C8,H8,no,N,33,,178185,30694,GDP
34,,SING,N7,C5,yes,N,34,,178185,30694,GDP
35,,SING,C5,C6,no,N,35,,178185,30694,GDP
36,,DOUB,C5,C4,yes,N,36,,178185,30694,GDP
37,,DOUB,C6,O6,no,N,37,,178185,30694,GDP
38,,SING,C6,N1,no,N,38,,178185,30694,GDP
39,,SING,N1,C2,no,N,39,,178185,30694,GDP
40,,SING,N1,HN1,no,N,40,,178185,30694,GDP
41,,SING,C2,N2,no,N,41,,178185,30694,GDP
42,,DOUB,C2,N3,no,N,42,,178185,30694,GDP
43,,SING,N2,HN21,no,N,43,,178185,30694,GDP
44,,SING,N2,HN22,no,N,44,,178185,30694,GDP
45,,SING,N3,C4,no,N,45,,178185,30694,GDP
1,,DOUB,C17,C16,yes,N,1,,178187,30694,QPD
2,,SING,C17,C18,yes,N,2,,178187,30694,QPD
3,,SING,C16,C15,yes,N,3,,178187,30694,QPD
4,,DOUB,C18,C19,yes,N,4,,178187,30694,QPD
5,,DOUB,C15,C14,yes,N,5,,178187,30694,QPD
6,,SING,C19,C14,yes,N,6,,178187,30694,QPD
7,,SING,C14,C11,no,N,7,,178187,30694,QPD
8,,SING,N13,C12,no,N,8,,178187,30694,QPD
9,,SING,C11,C12,no,N,9,,178187,30694,QPD
10,,SING,C11,N10,no,N,10,,178187,30694,QPD
11,,DOUB,C12,O2,no,N,11,,178187,30694,QPD
12,,SING,N10,N9,no,N,12,,178187,30694,QPD
13,,SING,N9,C8,no,N,13,,178187,30694,QPD
14,,DOUB,O1,C8,no,N,14,,178187,30694,QPD
15,,SING,C8,C3,no,N,15,,178187,30694,QPD
16,,DOUB,C3,C2,yes,N,16,,178187,30694,QPD
17,,SING,C3,C4A,yes,N,17,,178187,30694,QPD
18,,SING,C2,N1,yes,N,18,,178187,30694,QPD
19,,DOUB,C4A,C4,yes,N,19,,178187,30694,QPD
20,,SING,C4A,C7A,yes,N,20,,178187,30694,QPD
21,,SING,C4,C5,yes,N,21,,178187,30694,QPD
22,,SING,N1,C7A,yes,N,22,,178187,30694,QPD
23,,DOUB,C7A,C7,yes,N,23,,178187,30694,QPD
24,,DOUB,C5,C6,yes,N,24,,178187,30694,QPD
25,,SING,C7,C6,yes,N,25,,178187,30694,QPD
26,,SING,C5,H5,no,N,26,,178187,30694,QPD
27,,SING,C16,H16,no,N,27,,178187,30694,QPD
28,,SING,C4,H4,no,N,28,,178187,30694,QPD
29,,SING,N1,H12,no,N,29,,178187,30694,QPD
30,,SING,C2,H2,no,N,30,,178187,30694,QPD
31,,SING,C7,H7,no,N,31,,178187,30694,QPD
32,,SING,C18,H18,no,N,32,,178187,30694,QPD
33,,SING,C6,H6,no,N,33,,178187,30694,QPD
34,,SING,C11,H11,no,N,34,,178187,30694,QPD
35,,SING,C15,H15,no,N,35,,178187,30694,QPD
36,,SING,C17,H17,no,N,36,,178187,30694,QPD
37,,SING,C19,H19,no,N,37,,178187,30694,QPD
38,,SING,N9,H9,no,N,38,,178187,30694,QPD
39,,SING,N10,H10,no,N,39,,178187,30694,QPD
40,,SING,N13,H9L,no,N,40,,178187,30694,QPD
41,,SING,N13,H13,no,N,41,,178187,30694,QPD
1,,SING,S0,C0',yes,N,1,,178273,30698,QSV
2,,SING,S0,C0,yes,N,2,,178273,30698,QSV
3,,DOUB,C5',C0',yes,N,3,,178273,30698,QSV
4,,SING,C5',C4',yes,N,4,,178273,30698,QSV
5,,SING,C0',C1',yes,N,5,,178273,30698,QSV
6,,DOUB,C4',C3',yes,N,6,,178273,30698,QSV
7,,DOUB,C0,C5,yes,N,7,,178273,30698,QSV
8,,SING,C0,C1,yes,N,8,,178273,30698,QSV
9,,SING,C5,C4,yes,N,9,,178273,30698,QSV
10,,SING,C1',C1,yes,N,10,,178273,30698,QSV
11,,DOUB,C1',C2',yes,N,11,,178273,30698,QSV
12,,DOUB,C1,C2,yes,N,12,,178273,30698,QSV
13,,DOUB,C4,C3,yes,N,13,,178273,30698,QSV
14,,SING,C3',C2',yes,N,14,,178273,30698,QSV
15,,SING,C3',C6',no,N,15,,178273,30698,QSV
16,,SING,C7',C6',no,N,16,,178273,30698,QSV
17,,DOUB,C6',N1',no,E,17,,178273,30698,QSV
18,,SING,C2,C3,yes,N,18,,178273,30698,QSV
19,,SING,C3,C6,no,N,19,,178273,30698,QSV
20,,SING,N1',N2',no,N,20,,178273,30698,QSV
21,,SING,C6,C7,no,N,21,,178273,30698,QSV
22,,DOUB,C6,N1,no,E,22,,178273,30698,QSV
23,,SING,N2',C8',no,N,23,,178273,30698,QSV
24,,SING,N1,N2,no,N,24,,178273,30698,QSV
25,,SING,C8',N4',no,N,25,,178273,30698,QSV
26,,DOUB,C8',N3',no,N,26,,178273,30698,QSV
27,,SING,N2,C8,no,N,27,,178273,30698,QSV
28,,SING,N4',C9',no,N,28,,178273,30698,QSV
29,,DOUB,N3,C8,no,N,29,,178273,30698,QSV
30,,SING,C8,N4,no,N,30,,178273,30698,QSV
31,,SING,N4,C9,no,N,31,,178273,30698,QSV
32,,SING,C4,H4,no,N,32,,178273,30698,QSV
33,,SING,C5,H5,no,N,33,,178273,30698,QSV
34,,SING,C7,H72,no,N,34,,178273,30698,QSV
35,,SING,C7,H71,no,N,35,,178273,30698,QSV
36,,SING,C7,H73,no,N,36,,178273,30698,QSV
37,,SING,C2,H2,no,N,37,,178273,30698,QSV
38,,SING,C9,H92,no,N,38,,178273,30698,QSV
39,,SING,C9,H93,no,N,39,,178273,30698,QSV
40,,SING,C9,H91,no,N,40,,178273,30698,QSV
41,,SING,C4',H4',no,N,41,,178273,30698,QSV
42,,SING,C2',H2',no,N,42,,178273,30698,QSV
43,,SING,C5',H5',no,N,43,,178273,30698,QSV
44,,SING,N2,H01,no,N,44,,178273,30698,QSV
45,,SING,N3,H02,no,N,45,,178273,30698,QSV
46,,SING,N4,H03,no,N,46,,178273,30698,QSV
47,,SING,C7',H75,no,N,47,,178273,30698,QSV
48,,SING,C7',H74,no,N,48,,178273,30698,QSV
49,,SING,C7',H76,no,N,49,,178273,30698,QSV
50,,SING,N2',H04,no,N,50,,178273,30698,QSV
51,,SING,N3',H05,no,N,51,,178273,30698,QSV
52,,SING,N4',H06,no,N,52,,178273,30698,QSV
53,,SING,C9',H95,no,N,53,,178273,30698,QSV
54,,SING,C9',H96,no,N,54,,178273,30698,QSV
55,,SING,C9',H94,no,N,55,,178273,30698,QSV
1,,SING,C7,C6,no,N,1,,178298,30699,MQC
2,,DOUB,N2,C6,yes,N,2,,178298,30699,MQC
3,,SING,N2,C5,yes,N,3,,178298,30699,MQC
4,,SING,C6,C8,yes,N,4,,178298,30699,MQC
5,,DOUB,C4,C5,yes,N,5,,178298,30699,MQC
6,,SING,C4,C3,yes,N,6,,178298,30699,MQC
7,,SING,C5,C17,yes,N,7,,178298,30699,MQC
8,,DOUB,C8,C9,yes,N,8,,178298,30699,MQC
9,,DOUB,C3,C2,yes,N,9,,178298,30699,MQC
10,,SING,C17,C9,yes,N,10,,178298,30699,MQC
11,,DOUB,C17,C18,yes,N,11,,178298,30699,MQC
12,,SING,C9,N3,no,N,12,,178298,30699,MQC
13,,SING,C2,C18,yes,N,13,,178298,30699,MQC
14,,SING,C2,C1,no,N,14,,178298,30699,MQC
15,,SING,N3,C10,no,N,15,,178298,30699,MQC
16,,SING,C15,O1,no,N,16,,178298,30699,MQC
17,,DOUB,C16,C10,yes,N,17,,178298,30699,MQC
18,,SING,C16,C14,yes,N,18,,178298,30699,MQC
19,,SING,O1,C14,no,N,19,,178298,30699,MQC
20,,DOUB,N1,C1,no,N,20,,178298,30699,MQC
21,,SING,C10,C11,yes,N,21,,178298,30699,MQC
22,,SING,C1,N4,no,N,22,,178298,30699,MQC
23,,DOUB,C14,C13,yes,N,23,,178298,30699,MQC
24,,DOUB,C11,C12,yes,N,24,,178298,30699,MQC
25,,SING,C13,C12,yes,N,25,,178298,30699,MQC
26,,SING,N1,H11,no,N,26,,178298,30699,MQC
27,,SING,N4,H10,no,N,27,,178298,30699,MQC
28,,SING,N4,H9,no,N,28,,178298,30699,MQC
29,,SING,C18,H1,no,N,29,,178298,30699,MQC
30,,SING,C3,H2,no,N,30,,178298,30699,MQC
31,,SING,C4,H3,no,N,31,,178298,30699,MQC
32,,SING,C7,H15,no,N,32,,178298,30699,MQC
33,,SING,C7,H17,no,N,33,,178298,30699,MQC
34,,SING,C7,H16,no,N,34,,178298,30699,MQC
35,,SING,C8,H4,no,N,35,,178298,30699,MQC
36,,SING,N3,H14,no,N,36,,178298,30699,MQC
37,,SING,C16,H5,no,N,37,,178298,30699,MQC
38,,SING,C11,H8,no,N,38,,178298,30699,MQC
39,,SING,C12,H7,no,N,39,,178298,30699,MQC
40,,SING,C13,H6,no,N,40,,178298,30699,MQC
41,,SING,C15,H18,no,N,41,,178298,30699,MQC
42,,SING,C15,H20,no,N,42,,178298,30699,MQC
43,,SING,C15,H19,no,N,43,,178298,30699,MQC
1,,SING,C20,C21,no,N,1,,178335,30700,QSY
2,,SING,C20,C19,no,N,2,,178335,30700,QSY
3,,SING,C21,C15,no,N,3,,178335,30700,QSY
4,,SING,C19,C18,no,N,4,,178335,30700,QSY
5,,SING,C14,C13,no,N,5,,178335,30700,QSY
6,,SING,C14,N4,no,N,6,,178335,30700,QSY
7,,SING,C15,N4,no,N,7,,178335,30700,QSY
8,,SING,C15,C17,no,N,8,,178335,30700,QSY
9,,SING,C16,N4,no,N,9,,178335,30700,QSY
10,,SING,C13,C12,no,N,10,,178335,30700,QSY
11,,SING,C18,C17,no,N,11,,178335,30700,QSY
12,,SING,C12,N2,no,N,12,,178335,30700,QSY
13,,SING,N2,C11,no,N,13,,178335,30700,QSY
14,,SING,N2,C10,no,N,14,,178335,30700,QSY
15,,DOUB,O2,C10,no,N,15,,178335,30700,QSY
16,,DOUB,C11,N3,no,N,16,,178335,30700,QSY
17,,SING,C10,C8,no,N,17,,178335,30700,QSY
18,,SING,N3,C9,no,N,18,,178335,30700,QSY
19,,DOUB,C8,C9,yes,N,19,,178335,30700,QSY
20,,SING,C8,N1,yes,N,20,,178335,30700,QSY
21,,SING,C9,C5,yes,N,21,,178335,30700,QSY
22,,SING,N1,C4,yes,N,22,,178335,30700,QSY
23,,DOUB,C5,C4,yes,N,23,,178335,30700,QSY
24,,SING,C5,C6,yes,N,24,,178335,30700,QSY
25,,SING,C4,C3,yes,N,25,,178335,30700,QSY
26,,DOUB,C6,C1,yes,N,26,,178335,30700,QSY
27,,DOUB,C3,C2,yes,N,27,,178335,30700,QSY
28,,SING,C1,C2,yes,N,28,,178335,30700,QSY
29,,SING,C1,O1,no,N,29,,178335,30700,QSY
30,,SING,O1,C7,no,N,30,,178335,30700,QSY
31,,SING,N1,H7,no,N,31,,178335,30700,QSY
32,,SING,C2,H1,no,N,32,,178335,30700,QSY
33,,SING,C3,H2,no,N,33,,178335,30700,QSY
34,,SING,N4,H29,no,N,34,,178335,30700,QSY
35,,SING,C6,H3,no,N,35,,178335,30700,QSY
36,,SING,C7,H4,no,N,36,,178335,30700,QSY
37,,SING,C7,H5,no,N,37,,178335,30700,QSY
38,,SING,C7,H6,no,N,38,,178335,30700,QSY
39,,SING,C11,H8,no,N,39,,178335,30700,QSY
40,,SING,C12,H10,no,N,40,,178335,30700,QSY
41,,SING,C12,H9,no,N,41,,178335,30700,QSY
42,,SING,C13,H12,no,N,42,,178335,30700,QSY
43,,SING,C13,H11,no,N,43,,178335,30700,QSY
44,,SING,C14,H13,no,N,44,,178335,30700,QSY
45,,SING,C14,H14,no,N,45,,178335,30700,QSY
46,,SING,C15,H15,no,N,46,,178335,30700,QSY
47,,SING,C16,H17,no,N,47,,178335,30700,QSY
48,,SING,C16,H18,no,N,48,,178335,30700,QSY
49,,SING,C16,H16,no,N,49,,178335,30700,QSY
50,,SING,C17,H19,no,N,50,,178335,30700,QSY
51,,SING,C17,H20,no,N,51,,178335,30700,QSY
52,,SING,C18,H22,no,N,52,,178335,30700,QSY
53,,SING,C18,H21,no,N,53,,178335,30700,QSY
54,,SING,C19,H24,no,N,54,,178335,30700,QSY
55,,SING,C19,H23,no,N,55,,178335,30700,QSY
56,,SING,C20,H26,no,N,56,,178335,30700,QSY
57,,SING,C20,H25,no,N,57,,178335,30700,QSY
58,,SING,C21,H27,no,N,58,,178335,30700,QSY
59,,SING,C21,H28,no,N,59,,178335,30700,QSY
1,,SING,N,CA,no,N,1,,178356,30702,ABA
2,,SING,N,H,no,N,2,,178356,30702,ABA
3,,SING,N,HN2,no,N,3,,178356,30702,ABA
4,,SING,CA,C,no,N,4,,178356,30702,ABA
5,,SING,CA,CB,no,N,5,,178356,30702,ABA
6,,SING,CA,HA,no,N,6,,178356,30702,ABA
7,,DOUB,C,O,no,N,7,,178356,30702,ABA
8,,SING,C,OXT,no,N,8,,178356,30702,ABA
9,,SING,CB,CG,no,N,9,,178356,30702,ABA
10,,SING,CB,HB3,no,N,10,,178356,30702,ABA
11,,SING,CB,HB2,no,N,11,,178356,30702,ABA
12,,SING,CG,HG1,no,N,12,,178356,30702,ABA
13,,SING,CG,HG3,no,N,13,,178356,30702,ABA
14,,SING,CG,HG2,no,N,14,,178356,30702,ABA
15,,SING,OXT,HXT,no,N,15,,178356,30702,ABA
1,,SING,N,CA,no,N,1,,178357,30702,DAL
2,,SING,N,H,no,N,2,,178357,30702,DAL
3,,SING,N,H2,no,N,3,,178357,30702,DAL
4,,SING,CA,CB,no,N,4,,178357,30702,DAL
5,,SING,CA,C,no,N,5,,178357,30702,DAL
6,,SING,CA,HA,no,N,6,,178357,30702,DAL
7,,SING,CB,HB1,no,N,7,,178357,30702,DAL
8,,SING,CB,HB2,no,N,8,,178357,30702,DAL
9,,SING,CB,HB3,no,N,9,,178357,30702,DAL
10,,DOUB,C,O,no,N,10,,178357,30702,DAL
11,,SING,C,OXT,no,N,11,,178357,30702,DAL
12,,SING,OXT,HXT,no,N,12,,178357,30702,DAL
1,,SING,N,CA,no,N,1,,178358,30702,DBU
2,,SING,N,H,no,N,2,,178358,30702,DBU
3,,SING,N,H2,no,N,3,,178358,30702,DBU
4,,DOUB,CA,CB,no,Z,4,,178358,30702,DBU
5,,SING,CA,C,no,N,5,,178358,30702,DBU
6,,SING,CB,CG,no,N,6,,178358,30702,DBU
7,,SING,CB,HB,no,N,7,,178358,30702,DBU
8,,SING,CG,HG1,no,N,8,,178358,30702,DBU
9,,SING,CG,HG2,no,N,9,,178358,30702,DBU
10,,SING,CG,HG3,no,N,10,,178358,30702,DBU
11,,DOUB,C,O,no,N,11,,178358,30702,DBU
12,,SING,C,OXT,no,N,12,,178358,30702,DBU
13,,SING,OXT,HXT,no,N,13,,178358,30702,DBU
1,,SING,N,CA,no,N,1,,178500,30710,ABA
2,,SING,N,H,no,N,2,,178500,30710,ABA
3,,SING,N,HN2,no,N,3,,178500,30710,ABA
4,,SING,CA,C,no,N,4,,178500,30710,ABA
5,,SING,CA,CB,no,N,5,,178500,30710,ABA
6,,SING,CA,HA,no,N,6,,178500,30710,ABA
7,,DOUB,C,O,no,N,7,,178500,30710,ABA
8,,SING,C,OXT,no,N,8,,178500,30710,ABA
9,,SING,CB,CG,no,N,9,,178500,30710,ABA
10,,SING,CB,HB3,no,N,10,,178500,30710,ABA
11,,SING,CB,HB2,no,N,11,,178500,30710,ABA
12,,SING,CG,HG1,no,N,12,,178500,30710,ABA
13,,SING,CG,HG3,no,N,13,,178500,30710,ABA
14,,SING,CG,HG2,no,N,14,,178500,30710,ABA
15,,SING,OXT,HXT,no,N,15,,178500,30710,ABA
1,,SING,N,CA,no,N,1,,178501,30710,DAL
2,,SING,N,H,no,N,2,,178501,30710,DAL
3,,SING,N,H2,no,N,3,,178501,30710,DAL
4,,SING,CA,CB,no,N,4,,178501,30710,DAL
5,,SING,CA,C,no,N,5,,178501,30710,DAL
6,,SING,CA,HA,no,N,6,,178501,30710,DAL
7,,SING,CB,HB1,no,N,7,,178501,30710,DAL
8,,SING,CB,HB2,no,N,8,,178501,30710,DAL
9,,SING,CB,HB3,no,N,9,,178501,30710,DAL
10,,DOUB,C,O,no,N,10,,178501,30710,DAL
11,,SING,C,OXT,no,N,11,,178501,30710,DAL
12,,SING,OXT,HXT,no,N,12,,178501,30710,DAL
1,,SING,N,CA,no,N,1,,178502,30710,DBU
2,,SING,N,H,no,N,2,,178502,30710,DBU
3,,SING,N,H2,no,N,3,,178502,30710,DBU
4,,DOUB,CA,CB,no,Z,4,,178502,30710,DBU
5,,SING,CA,C,no,N,5,,178502,30710,DBU
6,,SING,CB,CG,no,N,6,,178502,30710,DBU
7,,SING,CB,HB,no,N,7,,178502,30710,DBU
8,,SING,CG,HG1,no,N,8,,178502,30710,DBU
9,,SING,CG,HG2,no,N,9,,178502,30710,DBU
10,,SING,CG,HG3,no,N,10,,178502,30710,DBU
11,,DOUB,C,O,no,N,11,,178502,30710,DBU
12,,SING,C,OXT,no,N,12,,178502,30710,DBU
13,,SING,OXT,HXT,no,N,13,,178502,30710,DBU
1,,SING,N,CA,no,N,1,,178503,30710,DHA
2,,SING,N,H,no,N,2,,178503,30710,DHA
3,,SING,N,H2,no,N,3,,178503,30710,DHA
4,,DOUB,CA,CB,no,N,4,,178503,30710,DHA
5,,SING,CA,C,no,N,5,,178503,30710,DHA
6,,SING,CB,HB1,no,N,6,,178503,30710,DHA
7,,SING,CB,HB2,no,N,7,,178503,30710,DHA
8,,DOUB,C,O,no,N,8,,178503,30710,DHA
9,,SING,C,OXT,no,N,9,,178503,30710,DHA
10,,SING,OXT,HXT,no,N,10,,178503,30710,DHA
1,,SING,N,CA,no,N,1,,178542,30712,DBB
2,,SING,CA,C,no,N,2,,178542,30712,DBB
3,,SING,CA,CB,no,N,3,,178542,30712,DBB
4,,DOUB,C,O,no,N,4,,178542,30712,DBB
5,,SING,CB,CG,no,N,5,,178542,30712,DBB
6,,SING,C,OXT,no,N,6,,178542,30712,DBB
7,,SING,N,H,no,N,7,,178542,30712,DBB
8,,SING,N,H1,no,N,8,,178542,30712,DBB
9,,SING,CA,HA,no,N,9,,178542,30712,DBB
10,,SING,CB,HB2,no,N,10,,178542,30712,DBB
11,,SING,CB,HB3,no,N,11,,178542,30712,DBB
12,,SING,CG,HG1,no,N,12,,178542,30712,DBB
13,,SING,CG,HG2,no,N,13,,178542,30712,DBB
14,,SING,CG,HG3,no,N,14,,178542,30712,DBB
15,,SING,OXT,HXT,no,N,15,,178542,30712,DBB
1,,SING,N,CA,no,N,1,,178563,30713,DAL
2,,SING,N,H,no,N,2,,178563,30713,DAL
3,,SING,N,H2,no,N,3,,178563,30713,DAL
4,,SING,CA,CB,no,N,4,,178563,30713,DAL
5,,SING,CA,C,no,N,5,,178563,30713,DAL
6,,SING,CA,HA,no,N,6,,178563,30713,DAL
7,,SING,CB,HB1,no,N,7,,178563,30713,DAL
8,,SING,CB,HB2,no,N,8,,178563,30713,DAL
9,,SING,CB,HB3,no,N,9,,178563,30713,DAL
10,,DOUB,C,O,no,N,10,,178563,30713,DAL
11,,SING,C,OXT,no,N,11,,178563,30713,DAL
12,,SING,OXT,HXT,no,N,12,,178563,30713,DAL
1,,SING,N,CA,no,N,1,,178564,30713,DBB
2,,SING,CA,C,no,N,2,,178564,30713,DBB
3,,SING,CA,CB,no,N,3,,178564,30713,DBB
4,,DOUB,C,O,no,N,4,,178564,30713,DBB
5,,SING,CB,CG,no,N,5,,178564,30713,DBB
6,,SING,C,OXT,no,N,6,,178564,30713,DBB
7,,SING,N,H,no,N,7,,178564,30713,DBB
8,,SING,N,H1,no,N,8,,178564,30713,DBB
9,,SING,CA,HA,no,N,9,,178564,30713,DBB
10,,SING,CB,HB2,no,N,10,,178564,30713,DBB
11,,SING,CB,HB3,no,N,11,,178564,30713,DBB
12,,SING,CG,HG1,no,N,12,,178564,30713,DBB
13,,SING,CG,HG2,no,N,13,,178564,30713,DBB
14,,SING,CG,HG3,no,N,14,,178564,30713,DBB
15,,SING,OXT,HXT,no,N,15,,178564,30713,DBB
1,,SING,N,CA,no,N,1,,178565,30713,DBU
2,,SING,N,H,no,N,2,,178565,30713,DBU
3,,SING,N,H2,no,N,3,,178565,30713,DBU
4,,DOUB,CA,CB,no,Z,4,,178565,30713,DBU
5,,SING,CA,C,no,N,5,,178565,30713,DBU
6,,SING,CB,CG,no,N,6,,178565,30713,DBU
7,,SING,CB,HB,no,N,7,,178565,30713,DBU
8,,SING,CG,HG1,no,N,8,,178565,30713,DBU
9,,SING,CG,HG2,no,N,9,,178565,30713,DBU
10,,SING,CG,HG3,no,N,10,,178565,30713,DBU
11,,DOUB,C,O,no,N,11,,178565,30713,DBU
12,,SING,C,OXT,no,N,12,,178565,30713,DBU
13,,SING,OXT,HXT,no,N,13,,178565,30713,DBU
1,,SING,N,CA,no,N,1,,178586,30714,DAL
2,,SING,N,H,no,N,2,,178586,30714,DAL
3,,SING,N,H2,no,N,3,,178586,30714,DAL
4,,SING,CA,CB,no,N,4,,178586,30714,DAL
5,,SING,CA,C,no,N,5,,178586,30714,DAL
6,,SING,CA,HA,no,N,6,,178586,30714,DAL
7,,SING,CB,HB1,no,N,7,,178586,30714,DAL
8,,SING,CB,HB2,no,N,8,,178586,30714,DAL
9,,SING,CB,HB3,no,N,9,,178586,30714,DAL
10,,DOUB,C,O,no,N,10,,178586,30714,DAL
11,,SING,C,OXT,no,N,11,,178586,30714,DAL
12,,SING,OXT,HXT,no,N,12,,178586,30714,DAL
1,,SING,N,CA,no,N,1,,178587,30714,DBB
2,,SING,CA,C,no,N,2,,178587,30714,DBB
3,,SING,CA,CB,no,N,3,,178587,30714,DBB
4,,DOUB,C,O,no,N,4,,178587,30714,DBB
5,,SING,CB,CG,no,N,5,,178587,30714,DBB
6,,SING,C,OXT,no,N,6,,178587,30714,DBB
7,,SING,N,H,no,N,7,,178587,30714,DBB
8,,SING,N,H1,no,N,8,,178587,30714,DBB
9,,SING,CA,HA,no,N,9,,178587,30714,DBB
10,,SING,CB,HB2,no,N,10,,178587,30714,DBB
11,,SING,CB,HB3,no,N,11,,178587,30714,DBB
12,,SING,CG,HG1,no,N,12,,178587,30714,DBB
13,,SING,CG,HG2,no,N,13,,178587,30714,DBB
14,,SING,CG,HG3,no,N,14,,178587,30714,DBB
15,,SING,OXT,HXT,no,N,15,,178587,30714,DBB
1,,SING,N,CA,no,N,1,,178609,30718,DAL
2,,SING,N,H,no,N,2,,178609,30718,DAL
3,,SING,N,H2,no,N,3,,178609,30718,DAL
4,,SING,CA,CB,no,N,4,,178609,30718,DAL
5,,SING,CA,C,no,N,5,,178609,30718,DAL
6,,SING,CA,HA,no,N,6,,178609,30718,DAL
7,,SING,CB,HB1,no,N,7,,178609,30718,DAL
8,,SING,CB,HB2,no,N,8,,178609,30718,DAL
9,,SING,CB,HB3,no,N,9,,178609,30718,DAL
10,,DOUB,C,O,no,N,10,,178609,30718,DAL
11,,SING,C,OXT,no,N,11,,178609,30718,DAL
12,,SING,OXT,HXT,no,N,12,,178609,30718,DAL
1,,SING,O2',C2',no,N,1,,178684,30723,8NK
2,,SING,O3',C3',no,N,2,,178684,30723,8NK
3,,SING,N2,C2,no,N,3,,178684,30723,8NK
4,,SING,C2',C3',no,N,4,,178684,30723,8NK
5,,SING,C2',C1',no,N,5,,178684,30723,8NK
6,,DOUB,N3,C2,no,N,6,,178684,30723,8NK
7,,SING,N3,C4,no,N,7,,178684,30723,8NK
8,,SING,C2,N1,no,N,8,,178684,30723,8NK
9,,SING,C3',C4',no,N,9,,178684,30723,8NK
10,,SING,C1',O4',no,N,10,,178684,30723,8NK
11,,SING,C1',N9,no,N,11,,178684,30723,8NK
12,,SING,C4',O4',no,N,12,,178684,30723,8NK
13,,SING,C4',C5',no,N,13,,178684,30723,8NK
14,,SING,N1,C6,no,N,14,,178684,30723,8NK
15,,SING,C4,N9,yes,N,15,,178684,30723,8NK
16,,DOUB,C4,C5,yes,N,16,,178684,30723,8NK
17,,SING,N9,C8,yes,N,17,,178684,30723,8NK
18,,SING,C5',O5',no,N,18,,178684,30723,8NK
19,,SING,C5,C6,no,N,19,,178684,30723,8NK
20,,SING,C5,N7,yes,N,20,,178684,30723,8NK
21,,DOUB,C6,O6,no,N,21,,178684,30723,8NK
22,,DOUB,C8,N7,yes,N,22,,178684,30723,8NK
23,,SING,O5',PA,no,N,23,,178684,30723,8NK
24,,SING,N7,CM7,no,N,24,,178684,30723,8NK
25,,SING,PA,O3A,no,N,25,,178684,30723,8NK
26,,DOUB,PA,O1A,no,N,26,,178684,30723,8NK
27,,SING,PA,O2A,no,N,27,,178684,30723,8NK
28,,SING,O3A,PB,no,N,28,,178684,30723,8NK
29,,DOUB,O1B,PB,no,N,29,,178684,30723,8NK
30,,SING,PB,O2B,no,N,30,,178684,30723,8NK
31,,SING,PB,O3B,no,N,31,,178684,30723,8NK
32,,SING,O2A,H1,no,N,32,,178684,30723,8NK
33,,SING,O2B,H2,no,N,33,,178684,30723,8NK
34,,SING,O3B,H3,no,N,34,,178684,30723,8NK
35,,SING,C5',H4,no,N,35,,178684,30723,8NK
36,,SING,C5',H5,no,N,36,,178684,30723,8NK
37,,SING,C4',H6,no,N,37,,178684,30723,8NK
38,,SING,C3',H7,no,N,38,,178684,30723,8NK
39,,SING,O3',H8,no,N,39,,178684,30723,8NK
40,,SING,C2',H9,no,N,40,,178684,30723,8NK
41,,SING,O2',H10,no,N,41,,178684,30723,8NK
42,,SING,C1',H11,no,N,42,,178684,30723,8NK
43,,SING,C8,H12,no,N,43,,178684,30723,8NK
44,,SING,CM7,H13,no,N,44,,178684,30723,8NK
45,,SING,CM7,H14,no,N,45,,178684,30723,8NK
46,,SING,CM7,H15,no,N,46,,178684,30723,8NK
47,,SING,N1,H16,no,N,47,,178684,30723,8NK
48,,SING,N2,H17,no,N,48,,178684,30723,8NK
49,,SING,N2,H18,no,N,49,,178684,30723,8NK
1,,DOUB,PA,O1A,no,N,1,,178703,30724,M7G
2,,SING,PA,O2A,no,N,2,,178703,30724,M7G
3,,SING,PA,O3A,no,N,3,,178703,30724,M7G
4,,SING,PA,O5',no,N,4,,178703,30724,M7G
5,,SING,O2A,HOA2,no,N,5,,178703,30724,M7G
6,,SING,O3A,PB,no,N,6,,178703,30724,M7G
7,,SING,O5',C5',no,N,7,,178703,30724,M7G
8,,DOUB,PB,O1B,no,N,8,,178703,30724,M7G
9,,SING,PB,O2B,no,N,9,,178703,30724,M7G
10,,SING,PB,O3B,no,N,10,,178703,30724,M7G
11,,SING,O2B,HOB2,no,N,11,,178703,30724,M7G
12,,SING,O3B,HOB3,no,N,12,,178703,30724,M7G
13,,SING,C5',C4',no,N,13,,178703,30724,M7G
14,,SING,C5',H5'1,no,N,14,,178703,30724,M7G
15,,SING,C5',H5'2,no,N,15,,178703,30724,M7G
16,,SING,C4',O4',no,N,16,,178703,30724,M7G
17,,SING,C4',C3',no,N,17,,178703,30724,M7G
18,,SING,C4',H4',no,N,18,,178703,30724,M7G
19,,SING,O4',C1',no,N,19,,178703,30724,M7G
20,,SING,C3',O3',no,N,20,,178703,30724,M7G
21,,SING,C3',C2',no,N,21,,178703,30724,M7G
22,,SING,C3',H3',no,N,22,,178703,30724,M7G
23,,SING,O3',HO3',no,N,23,,178703,30724,M7G
24,,SING,C2',O2',no,N,24,,178703,30724,M7G
25,,SING,C2',C1',no,N,25,,178703,30724,M7G
26,,SING,C2',H2',no,N,26,,178703,30724,M7G
27,,SING,O2',HO2',no,N,27,,178703,30724,M7G
28,,SING,C1',N9,no,N,28,,178703,30724,M7G
29,,SING,C1',H1',no,N,29,,178703,30724,M7G
30,,SING,N9,C8,no,N,30,,178703,30724,M7G
31,,SING,N9,C4,no,N,31,,178703,30724,M7G
32,,SING,C8,N7,no,N,32,,178703,30724,M7G
33,,SING,C8,H81,no,N,33,,178703,30724,M7G
34,,SING,C8,H82,no,N,34,,178703,30724,M7G
35,,SING,N7,CM7,no,N,35,,178703,30724,M7G
36,,SING,N7,C5,no,N,36,,178703,30724,M7G
37,,SING,CM7,HM71,no,N,37,,178703,30724,M7G
38,,SING,CM7,HM72,no,N,38,,178703,30724,M7G
39,,SING,CM7,HM73,no,N,39,,178703,30724,M7G
40,,SING,C5,C6,no,N,40,,178703,30724,M7G
41,,DOUB,C5,C4,no,N,41,,178703,30724,M7G
42,,DOUB,C6,O6,no,N,42,,178703,30724,M7G
43,,SING,C6,N1,no,N,43,,178703,30724,M7G
44,,SING,N1,C2,no,N,44,,178703,30724,M7G
45,,SING,N1,HN1,no,N,45,,178703,30724,M7G
46,,SING,C2,N2,no,N,46,,178703,30724,M7G
47,,DOUB,C2,N3,no,N,47,,178703,30724,M7G
48,,SING,N2,HN21,no,N,48,,178703,30724,M7G
49,,SING,N2,HN22,no,N,49,,178703,30724,M7G
50,,SING,N3,C4,no,N,50,,178703,30724,M7G
1,,SING,N,HN1,no,N,1,,178744,30727,NH2
2,,SING,N,HN2,no,N,2,,178744,30727,NH2
1,,SING,N,CA,no,N,1,,178770,30729,RVJ
2,,SING,C,CA,no,N,2,,178770,30729,RVJ
3,,DOUB,C,O,no,N,3,,178770,30729,RVJ
4,,SING,CA,CB,no,N,4,,178770,30729,RVJ
5,,SING,CB,NG,no,N,5,,178770,30729,RVJ
6,,SING,NG,ND,no,N,6,,178770,30729,RVJ
7,,SING,ND,NE,no,N,7,,178770,30729,RVJ
8,,SING,N,H1,no,N,8,,178770,30729,RVJ
9,,SING,N,H2,no,N,9,,178770,30729,RVJ
10,,SING,CA,HA,no,N,10,,178770,30729,RVJ
11,,SING,CB,HB3,no,N,11,,178770,30729,RVJ
12,,SING,CB,HB2,no,N,12,,178770,30729,RVJ
13,,SING,NG,H3,no,N,13,,178770,30729,RVJ
14,,SING,ND,H4,no,N,14,,178770,30729,RVJ
15,,SING,NE,H5,no,N,15,,178770,30729,RVJ
16,,SING,NE,H6,no,N,16,,178770,30729,RVJ
17,,SING,C,OXT,no,N,17,,178770,30729,RVJ
18,,SING,OXT,HXT,no,N,18,,178770,30729,RVJ
1,,DOUB,C1E,C1A,no,N,1,,178771,30729,2AG
2,,SING,C1A,H1A,no,N,2,,178771,30729,2AG
3,,SING,C1A,H1AA,no,N,3,,178771,30729,2AG
4,,SING,CB,C1E,no,N,4,,178771,30729,2AG
5,,SING,C1E,H1E,no,N,5,,178771,30729,2AG
6,,SING,CA,CB,no,N,6,,178771,30729,2AG
7,,SING,CB,HB2,no,N,7,,178771,30729,2AG
8,,SING,CB,HB3,no,N,8,,178771,30729,2AG
9,,SING,C,CA,no,N,9,,178771,30729,2AG
10,,SING,CA,N,no,N,10,,178771,30729,2AG
11,,SING,CA,HA,no,N,11,,178771,30729,2AG
12,,DOUB,O,C,no,N,12,,178771,30729,2AG
13,,SING,C,OXT,no,N,13,,178771,30729,2AG
14,,SING,OXT,HXT,no,N,14,,178771,30729,2AG
15,,SING,N,H,no,N,15,,178771,30729,2AG
16,,SING,N,H2,no,N,16,,178771,30729,2AG
1,,SING,C1,C2,no,N,1,,178815,30734,PCW
2,,SING,C1,O3P,no,N,2,,178815,30734,PCW
3,,SING,C1,H11,no,N,3,,178815,30734,PCW
4,,SING,C1,H12,no,N,4,,178815,30734,PCW
5,,SING,C2,C3,no,N,5,,178815,30734,PCW
6,,SING,C2,O2,no,N,6,,178815,30734,PCW
7,,SING,C2,H2,no,N,7,,178815,30734,PCW
8,,SING,C3,O3,no,N,8,,178815,30734,PCW
9,,SING,C3,H31,no,N,9,,178815,30734,PCW
10,,SING,C3,H32,no,N,10,,178815,30734,PCW
11,,SING,C4,C5,no,N,11,,178815,30734,PCW
12,,SING,C4,O4P,no,N,12,,178815,30734,PCW
13,,SING,C4,H41,no,N,13,,178815,30734,PCW
14,,SING,C4,H42,no,N,14,,178815,30734,PCW
15,,SING,C5,N,no,N,15,,178815,30734,PCW
16,,SING,C5,H51,no,N,16,,178815,30734,PCW
17,,SING,C5,H52,no,N,17,,178815,30734,PCW
18,,SING,C6,N,no,N,18,,178815,30734,PCW
19,,SING,C6,H61,no,N,19,,178815,30734,PCW
20,,SING,C6,H62,no,N,20,,178815,30734,PCW
21,,SING,C6,H63,no,N,21,,178815,30734,PCW
22,,SING,C7,N,no,N,22,,178815,30734,PCW
23,,SING,C7,H71,no,N,23,,178815,30734,PCW
24,,SING,C7,H72,no,N,24,,178815,30734,PCW
25,,SING,C7,H73,no,N,25,,178815,30734,PCW
26,,SING,C8,N,no,N,26,,178815,30734,PCW
27,,SING,C8,H81,no,N,27,,178815,30734,PCW
28,,SING,C8,H82,no,N,28,,178815,30734,PCW
29,,SING,C8,H83,no,N,29,,178815,30734,PCW
30,,SING,C11,C12,no,N,30,,178815,30734,PCW
31,,SING,C11,O3,no,N,31,,178815,30734,PCW
32,,DOUB,C11,O11,no,N,32,,178815,30734,PCW
33,,SING,C12,C13,no,N,33,,178815,30734,PCW
34,,SING,C12,H121,no,N,34,,178815,30734,PCW
35,,SING,C12,H122,no,N,35,,178815,30734,PCW
36,,SING,C13,C14,no,N,36,,178815,30734,PCW
37,,SING,C13,H131,no,N,37,,178815,30734,PCW
38,,SING,C13,H132,no,N,38,,178815,30734,PCW
39,,SING,C14,C15,no,N,39,,178815,30734,PCW
40,,SING,C14,H141,no,N,40,,178815,30734,PCW
41,,SING,C14,H142,no,N,41,,178815,30734,PCW
42,,SING,C15,C16,no,N,42,,178815,30734,PCW
43,,SING,C15,H151,no,N,43,,178815,30734,PCW
44,,SING,C15,H152,no,N,44,,178815,30734,PCW
45,,SING,C16,C17,no,N,45,,178815,30734,PCW
46,,SING,C16,H161,no,N,46,,178815,30734,PCW
47,,SING,C16,H162,no,N,47,,178815,30734,PCW
48,,SING,C17,C18,no,N,48,,178815,30734,PCW
49,,SING,C17,H171,no,N,49,,178815,30734,PCW
50,,SING,C17,H172,no,N,50,,178815,30734,PCW
51,,SING,C18,C19,no,N,51,,178815,30734,PCW
52,,SING,C18,H181,no,N,52,,178815,30734,PCW
53,,SING,C18,H182,no,N,53,,178815,30734,PCW
54,,DOUB,C19,C20,no,Z,54,,178815,30734,PCW
55,,SING,C19,H19,no,N,55,,178815,30734,PCW
56,,SING,C20,C21,no,N,56,,178815,30734,PCW
57,,SING,C20,H20,no,N,57,,178815,30734,PCW
58,,SING,C21,C22,no,N,58,,178815,30734,PCW
59,,SING,C21,H211,no,N,59,,178815,30734,PCW
60,,SING,C21,H212,no,N,60,,178815,30734,PCW
61,,SING,C22,C23,no,N,61,,178815,30734,PCW
62,,SING,C22,H221,no,N,62,,178815,30734,PCW
63,,SING,C22,H222,no,N,63,,178815,30734,PCW
64,,SING,C23,C24,no,N,64,,178815,30734,PCW
65,,SING,C23,H231,no,N,65,,178815,30734,PCW
66,,SING,C23,H232,no,N,66,,178815,30734,PCW
67,,SING,C24,C25,no,N,67,,178815,30734,PCW
68,,SING,C24,H241,no,N,68,,178815,30734,PCW
69,,SING,C24,H242,no,N,69,,178815,30734,PCW
70,,SING,C25,C26,no,N,70,,178815,30734,PCW
71,,SING,C25,H251,no,N,71,,178815,30734,PCW
72,,SING,C25,H252,no,N,72,,178815,30734,PCW
73,,SING,C26,C27,no,N,73,,178815,30734,PCW
74,,SING,C26,H261,no,N,74,,178815,30734,PCW
75,,SING,C26,H262,no,N,75,,178815,30734,PCW
76,,SING,C27,C28,no,N,76,,178815,30734,PCW
77,,SING,C27,H271,no,N,77,,178815,30734,PCW
78,,SING,C27,H272,no,N,78,,178815,30734,PCW
79,,SING,C28,H281,no,N,79,,178815,30734,PCW
80,,SING,C28,H282,no,N,80,,178815,30734,PCW
81,,SING,C28,H283,no,N,81,,178815,30734,PCW
82,,SING,C31,C32,no,N,82,,178815,30734,PCW
83,,SING,C31,O2,no,N,83,,178815,30734,PCW
84,,DOUB,C31,O31,no,N,84,,178815,30734,PCW
85,,SING,C32,C33,no,N,85,,178815,30734,PCW
86,,SING,C32,H321,no,N,86,,178815,30734,PCW
87,,SING,C32,H322,no,N,87,,178815,30734,PCW
88,,SING,C33,C34,no,N,88,,178815,30734,PCW
89,,SING,C33,H331,no,N,89,,178815,30734,PCW
90,,SING,C33,H332,no,N,90,,178815,30734,PCW
91,,SING,C34,C35,no,N,91,,178815,30734,PCW
92,,SING,C34,H341,no,N,92,,178815,30734,PCW
93,,SING,C34,H342,no,N,93,,178815,30734,PCW
94,,SING,C35,C36,no,N,94,,178815,30734,PCW
95,,SING,C35,H351,no,N,95,,178815,30734,PCW
96,,SING,C35,H352,no,N,96,,178815,30734,PCW
97,,SING,C36,C37,no,N,97,,178815,30734,PCW
98,,SING,C36,H361,no,N,98,,178815,30734,PCW
99,,SING,C36,H362,no,N,99,,178815,30734,PCW
100,,SING,C37,C38,no,N,100,,178815,30734,PCW
101,,SING,C37,H371,no,N,101,,178815,30734,PCW
102,,SING,C37,H372,no,N,102,,178815,30734,PCW
103,,SING,C38,C39,no,N,103,,178815,30734,PCW
104,,SING,C38,H381,no,N,104,,178815,30734,PCW
105,,SING,C38,H382,no,N,105,,178815,30734,PCW
106,,DOUB,C39,C40,no,Z,106,,178815,30734,PCW
107,,SING,C39,H39,no,N,107,,178815,30734,PCW
108,,SING,C40,C41,no,N,108,,178815,30734,PCW
109,,SING,C40,H40,no,N,109,,178815,30734,PCW
110,,SING,C41,C42,no,N,110,,178815,30734,PCW
111,,SING,C41,H411,no,N,111,,178815,30734,PCW
112,,SING,C41,H412,no,N,112,,178815,30734,PCW
113,,SING,C42,C43,no,N,113,,178815,30734,PCW
114,,SING,C42,H421,no,N,114,,178815,30734,PCW
115,,SING,C42,H422,no,N,115,,178815,30734,PCW
116,,SING,C43,C44,no,N,116,,178815,30734,PCW
117,,SING,C43,H431,no,N,117,,178815,30734,PCW
118,,SING,C43,H432,no,N,118,,178815,30734,PCW
119,,SING,C44,C45,no,N,119,,178815,30734,PCW
120,,SING,C44,H441,no,N,120,,178815,30734,PCW
121,,SING,C44,H442,no,N,121,,178815,30734,PCW
122,,SING,C45,C46,no,N,122,,178815,30734,PCW
123,,SING,C45,H451,no,N,123,,178815,30734,PCW
124,,SING,C45,H452,no,N,124,,178815,30734,PCW
125,,SING,C46,C47,no,N,125,,178815,30734,PCW
126,,SING,C46,H461,no,N,126,,178815,30734,PCW
127,,SING,C46,H462,no,N,127,,178815,30734,PCW
128,,SING,C47,C48,no,N,128,,178815,30734,PCW
129,,SING,C47,H471,no,N,129,,178815,30734,PCW
130,,SING,C47,H472,no,N,130,,178815,30734,PCW
131,,SING,C48,H481,no,N,131,,178815,30734,PCW
132,,SING,C48,H482,no,N,132,,178815,30734,PCW
133,,SING,C48,H483,no,N,133,,178815,30734,PCW
134,,SING,O1P,P,no,N,134,,178815,30734,PCW
135,,SING,O1P,H1P,no,N,135,,178815,30734,PCW
136,,DOUB,O2P,P,no,N,136,,178815,30734,PCW
137,,SING,O3P,P,no,N,137,,178815,30734,PCW
138,,SING,O4P,P,no,N,138,,178815,30734,PCW
1,,SING,C1,O3,no,N,1,,178816,30734,17F
2,,SING,N1,C2,no,N,2,,178816,30734,17F
3,,DOUB,O1,P1,no,N,3,,178816,30734,17F
4,,SING,P1,O6,no,N,4,,178816,30734,17F
5,,SING,C2,C1,no,N,5,,178816,30734,17F
6,,SING,O2,P1,no,N,6,,178816,30734,17F
7,,SING,C3,C2,no,N,7,,178816,30734,17F
8,,SING,C3,O5,no,N,8,,178816,30734,17F
9,,SING,O3,P1,no,N,9,,178816,30734,17F
10,,SING,C4,C5,no,N,10,,178816,30734,17F
11,,DOUB,O4,C3,no,N,11,,178816,30734,17F
12,,SING,C5,C6,no,N,12,,178816,30734,17F
13,,SING,C5,O9,no,N,13,,178816,30734,17F
14,,SING,C6,O7,no,N,14,,178816,30734,17F
15,,SING,O6,C4,no,N,15,,178816,30734,17F
16,,SING,C7,C8,no,N,16,,178816,30734,17F
17,,SING,O7,C7,no,N,17,,178816,30734,17F
18,,SING,C8,C9,no,N,18,,178816,30734,17F
19,,DOUB,O8,C7,no,N,19,,178816,30734,17F
20,,SING,C9,C10,no,N,20,,178816,30734,17F
21,,SING,O9,C17,no,N,21,,178816,30734,17F
22,,SING,C10,C11,no,N,22,,178816,30734,17F
23,,SING,C11,C12,no,N,23,,178816,30734,17F
24,,SING,C12,C1X,no,N,24,,178816,30734,17F
25,,DOUB,C17,O10,no,N,25,,178816,30734,17F
26,,SING,C17,C18,no,N,26,,178816,30734,17F
27,,SING,C18,C19,no,N,27,,178816,30734,17F
28,,SING,C19,C20,no,N,28,,178816,30734,17F
29,,SING,C20,C1Y,no,N,29,,178816,30734,17F
30,,SING,C1Y,C1Z,no,N,30,,178816,30734,17F
31,,SING,C1X,C2X,no,N,31,,178816,30734,17F
32,,SING,C2X,C21,no,N,32,,178816,30734,17F
33,,DOUB,C21,C22,no,Z,33,,178816,30734,17F
34,,SING,C22,C23,no,N,34,,178816,30734,17F
35,,SING,C23,C24,no,N,35,,178816,30734,17F
36,,SING,C24,C25,no,N,36,,178816,30734,17F
37,,SING,C25,C26,no,N,37,,178816,30734,17F
38,,SING,C26,C27,no,N,38,,178816,30734,17F
39,,SING,C27,C28,no,N,39,,178816,30734,17F
40,,SING,C28,C29,no,N,40,,178816,30734,17F
41,,SING,C29,C30,no,N,41,,178816,30734,17F
42,,SING,C1Z,C31,no,N,42,,178816,30734,17F
43,,SING,C31,C32,no,N,43,,178816,30734,17F
44,,SING,C32,C33,no,N,44,,178816,30734,17F
45,,DOUB,C33,C34,no,Z,45,,178816,30734,17F
46,,SING,C34,C35,no,N,46,,178816,30734,17F
47,,SING,C35,C36,no,N,47,,178816,30734,17F
48,,SING,C36,C37,no,N,48,,178816,30734,17F
49,,SING,C37,C38,no,N,49,,178816,30734,17F
50,,SING,C38,C39,no,N,50,,178816,30734,17F
51,,SING,C39,C40,no,N,51,,178816,30734,17F
52,,SING,C40,C41,no,N,52,,178816,30734,17F
53,,SING,C41,C42,no,N,53,,178816,30734,17F
54,,SING,C1,H1,no,N,54,,178816,30734,17F
55,,SING,C1,H1A,no,N,55,,178816,30734,17F
56,,SING,N1,HN1,no,N,56,,178816,30734,17F
57,,SING,N1,HN1A,no,N,57,,178816,30734,17F
58,,SING,C2,H2,no,N,58,,178816,30734,17F
59,,SING,O2,HO2,no,N,59,,178816,30734,17F
60,,SING,C4,H4,no,N,60,,178816,30734,17F
61,,SING,C4,H4A,no,N,61,,178816,30734,17F
62,,SING,C5,H5,no,N,62,,178816,30734,17F
63,,SING,O5,HO5,no,N,63,,178816,30734,17F
64,,SING,C6,H6,no,N,64,,178816,30734,17F
65,,SING,C6,H6A,no,N,65,,178816,30734,17F
66,,SING,C8,H8,no,N,66,,178816,30734,17F
67,,SING,C8,H8A,no,N,67,,178816,30734,17F
68,,SING,C9,H9,no,N,68,,178816,30734,17F
69,,SING,C9,H9A,no,N,69,,178816,30734,17F
70,,SING,C10,H10,no,N,70,,178816,30734,17F
71,,SING,C10,H10A,no,N,71,,178816,30734,17F
72,,SING,C11,H11,no,N,72,,178816,30734,17F
73,,SING,C11,H11A,no,N,73,,178816,30734,17F
74,,SING,C12,H12,no,N,74,,178816,30734,17F
75,,SING,C12,H12A,no,N,75,,178816,30734,17F
76,,SING,C18,H18,no,N,76,,178816,30734,17F
77,,SING,C18,H18A,no,N,77,,178816,30734,17F
78,,SING,C19,H19,no,N,78,,178816,30734,17F
79,,SING,C19,H19A,no,N,79,,178816,30734,17F
80,,SING,C20,H20,no,N,80,,178816,30734,17F
81,,SING,C20,H20A,no,N,81,,178816,30734,17F
82,,SING,C1X,H29,no,N,82,,178816,30734,17F
83,,SING,C1X,H30,no,N,83,,178816,30734,17F
84,,SING,C1Y,H31,no,N,84,,178816,30734,17F
85,,SING,C1Y,H32,no,N,85,,178816,30734,17F
86,,SING,C1Z,H33,no,N,86,,178816,30734,17F
87,,SING,C1Z,H34,no,N,87,,178816,30734,17F
88,,SING,C2X,H35,no,N,88,,178816,30734,17F
89,,SING,C2X,H36,no,N,89,,178816,30734,17F
90,,SING,C21,H37,no,N,90,,178816,30734,17F
91,,SING,C22,H38,no,N,91,,178816,30734,17F
92,,SING,C23,H39,no,N,92,,178816,30734,17F
93,,SING,C23,H40,no,N,93,,178816,30734,17F
94,,SING,C24,H41,no,N,94,,178816,30734,17F
95,,SING,C24,H42,no,N,95,,178816,30734,17F
96,,SING,C25,H43,no,N,96,,178816,30734,17F
97,,SING,C25,H44,no,N,97,,178816,30734,17F
98,,SING,C26,H45,no,N,98,,178816,30734,17F
99,,SING,C26,H46,no,N,99,,178816,30734,17F
100,,SING,C27,H47,no,N,100,,178816,30734,17F
101,,SING,C27,H48,no,N,101,,178816,30734,17F
102,,SING,C28,H49,no,N,102,,178816,30734,17F
103,,SING,C28,H50,no,N,103,,178816,30734,17F
104,,SING,C29,H51,no,N,104,,178816,30734,17F
105,,SING,C29,H52,no,N,105,,178816,30734,17F
106,,SING,C30,H53,no,N,106,,178816,30734,17F
107,,SING,C30,H54,no,N,107,,178816,30734,17F
108,,SING,C30,H55,no,N,108,,178816,30734,17F
109,,SING,C31,H56,no,N,109,,178816,30734,17F
110,,SING,C31,H57,no,N,110,,178816,30734,17F
111,,SING,C32,H58,no,N,111,,178816,30734,17F
112,,SING,C32,H59,no,N,112,,178816,30734,17F
113,,SING,C33,H60,no,N,113,,178816,30734,17F
114,,SING,C34,H61,no,N,114,,178816,30734,17F
115,,SING,C35,H62,no,N,115,,178816,30734,17F
116,,SING,C35,H63,no,N,116,,178816,30734,17F
117,,SING,C36,H64,no,N,117,,178816,30734,17F
118,,SING,C36,H65,no,N,118,,178816,30734,17F
119,,SING,C37,H66,no,N,119,,178816,30734,17F
120,,SING,C37,H67,no,N,120,,178816,30734,17F
121,,SING,C38,H68,no,N,121,,178816,30734,17F
122,,SING,C38,H69,no,N,122,,178816,30734,17F
123,,SING,C39,H70,no,N,123,,178816,30734,17F
124,,SING,C39,H71,no,N,124,,178816,30734,17F
125,,SING,C40,H72,no,N,125,,178816,30734,17F
126,,SING,C40,H73,no,N,126,,178816,30734,17F
127,,SING,C41,H74,no,N,127,,178816,30734,17F
128,,SING,C41,H75,no,N,128,,178816,30734,17F
129,,SING,C42,H76,no,N,129,,178816,30734,17F
130,,SING,C42,H77,no,N,130,,178816,30734,17F
131,,SING,C42,H78,no,N,131,,178816,30734,17F
1,,SING,PG,O3B,no,N,1,,178817,30734,GSP
2,,DOUB,PG,S1G,no,N,2,,178817,30734,GSP
3,,SING,PG,O2G,no,N,3,,178817,30734,GSP
4,,SING,PG,O3G,no,N,4,,178817,30734,GSP
5,,SING,O3B,PB,no,N,5,,178817,30734,GSP
6,,SING,O2G,HOG2,no,N,6,,178817,30734,GSP
7,,SING,O3G,HOG3,no,N,7,,178817,30734,GSP
8,,DOUB,PB,O1B,no,N,8,,178817,30734,GSP
9,,SING,PB,O2B,no,N,9,,178817,30734,GSP
10,,SING,PB,O3A,no,N,10,,178817,30734,GSP
11,,SING,O2B,HOB2,no,N,11,,178817,30734,GSP
12,,DOUB,PA,O1A,no,N,12,,178817,30734,GSP
13,,SING,PA,O2A,no,N,13,,178817,30734,GSP
14,,SING,PA,O3A,no,N,14,,178817,30734,GSP
15,,SING,PA,O5',no,N,15,,178817,30734,GSP
16,,SING,O2A,HOA2,no,N,16,,178817,30734,GSP
17,,SING,O5',C5',no,N,17,,178817,30734,GSP
18,,SING,C5',C4',no,N,18,,178817,30734,GSP
19,,SING,C5',H5'1,no,N,19,,178817,30734,GSP
20,,SING,C5',H5'2,no,N,20,,178817,30734,GSP
21,,SING,C4',O4',no,N,21,,178817,30734,GSP
22,,SING,C4',C3',no,N,22,,178817,30734,GSP
23,,SING,C4',H4',no,N,23,,178817,30734,GSP
24,,SING,O4',C1',no,N,24,,178817,30734,GSP
25,,SING,C3',O3',no,N,25,,178817,30734,GSP
26,,SING,C3',C2',no,N,26,,178817,30734,GSP
27,,SING,C3',H3',no,N,27,,178817,30734,GSP
28,,SING,O3',HO3',no,N,28,,178817,30734,GSP
29,,SING,C2',O2',no,N,29,,178817,30734,GSP
30,,SING,C2',C1',no,N,30,,178817,30734,GSP
31,,SING,C2',H2',no,N,31,,178817,30734,GSP
32,,SING,O2',HO2',no,N,32,,178817,30734,GSP
33,,SING,C1',N9,no,N,33,,178817,30734,GSP
34,,SING,C1',H1',no,N,34,,178817,30734,GSP
35,,SING,N9,C8,yes,N,35,,178817,30734,GSP
36,,SING,N9,C4,yes,N,36,,178817,30734,GSP
37,,DOUB,C8,N7,yes,N,37,,178817,30734,GSP
38,,SING,C8,H8,no,N,38,,178817,30734,GSP
39,,SING,N7,C5,yes,N,39,,178817,30734,GSP
40,,SING,C5,C6,no,N,40,,178817,30734,GSP
41,,DOUB,C5,C4,yes,N,41,,178817,30734,GSP
42,,DOUB,C6,O6,no,N,42,,178817,30734,GSP
43,,SING,C6,N1,no,N,43,,178817,30734,GSP
44,,SING,N1,C2,no,N,44,,178817,30734,GSP
45,,SING,N1,HN1,no,N,45,,178817,30734,GSP
46,,SING,C2,N2,no,N,46,,178817,30734,GSP
47,,DOUB,C2,N3,no,N,47,,178817,30734,GSP
48,,SING,N2,HN21,no,N,48,,178817,30734,GSP
49,,SING,N2,HN22,no,N,49,,178817,30734,GSP
50,,SING,N3,C4,no,N,50,,178817,30734,GSP
1,,SING,C1,C2,no,N,1,,178841,30735,PCW
2,,SING,C1,O3P,no,N,2,,178841,30735,PCW
3,,SING,C1,H11,no,N,3,,178841,30735,PCW
4,,SING,C1,H12,no,N,4,,178841,30735,PCW
5,,SING,C2,C3,no,N,5,,178841,30735,PCW
6,,SING,C2,O2,no,N,6,,178841,30735,PCW
7,,SING,C2,H2,no,N,7,,178841,30735,PCW
8,,SING,C3,O3,no,N,8,,178841,30735,PCW
9,,SING,C3,H31,no,N,9,,178841,30735,PCW
10,,SING,C3,H32,no,N,10,,178841,30735,PCW
11,,SING,C4,C5,no,N,11,,178841,30735,PCW
12,,SING,C4,O4P,no,N,12,,178841,30735,PCW
13,,SING,C4,H41,no,N,13,,178841,30735,PCW
14,,SING,C4,H42,no,N,14,,178841,30735,PCW
15,,SING,C5,N,no,N,15,,178841,30735,PCW
16,,SING,C5,H51,no,N,16,,178841,30735,PCW
17,,SING,C5,H52,no,N,17,,178841,30735,PCW
18,,SING,C6,N,no,N,18,,178841,30735,PCW
19,,SING,C6,H61,no,N,19,,178841,30735,PCW
20,,SING,C6,H62,no,N,20,,178841,30735,PCW
21,,SING,C6,H63,no,N,21,,178841,30735,PCW
22,,SING,C7,N,no,N,22,,178841,30735,PCW
23,,SING,C7,H71,no,N,23,,178841,30735,PCW
24,,SING,C7,H72,no,N,24,,178841,30735,PCW
25,,SING,C7,H73,no,N,25,,178841,30735,PCW
26,,SING,C8,N,no,N,26,,178841,30735,PCW
27,,SING,C8,H81,no,N,27,,178841,30735,PCW
28,,SING,C8,H82,no,N,28,,178841,30735,PCW
29,,SING,C8,H83,no,N,29,,178841,30735,PCW
30,,SING,C11,C12,no,N,30,,178841,30735,PCW
31,,SING,C11,O3,no,N,31,,178841,30735,PCW
32,,DOUB,C11,O11,no,N,32,,178841,30735,PCW
33,,SING,C12,C13,no,N,33,,178841,30735,PCW
34,,SING,C12,H121,no,N,34,,178841,30735,PCW
35,,SING,C12,H122,no,N,35,,178841,30735,PCW
36,,SING,C13,C14,no,N,36,,178841,30735,PCW
37,,SING,C13,H131,no,N,37,,178841,30735,PCW
38,,SING,C13,H132,no,N,38,,178841,30735,PCW
39,,SING,C14,C15,no,N,39,,178841,30735,PCW
40,,SING,C14,H141,no,N,40,,178841,30735,PCW
41,,SING,C14,H142,no,N,41,,178841,30735,PCW
42,,SING,C15,C16,no,N,42,,178841,30735,PCW
43,,SING,C15,H151,no,N,43,,178841,30735,PCW
44,,SING,C15,H152,no,N,44,,178841,30735,PCW
45,,SING,C16,C17,no,N,45,,178841,30735,PCW
46,,SING,C16,H161,no,N,46,,178841,30735,PCW
47,,SING,C16,H162,no,N,47,,178841,30735,PCW
48,,SING,C17,C18,no,N,48,,178841,30735,PCW
49,,SING,C17,H171,no,N,49,,178841,30735,PCW
50,,SING,C17,H172,no,N,50,,178841,30735,PCW
51,,SING,C18,C19,no,N,51,,178841,30735,PCW
52,,SING,C18,H181,no,N,52,,178841,30735,PCW
53,,SING,C18,H182,no,N,53,,178841,30735,PCW
54,,DOUB,C19,C20,no,Z,54,,178841,30735,PCW
55,,SING,C19,H19,no,N,55,,178841,30735,PCW
56,,SING,C20,C21,no,N,56,,178841,30735,PCW
57,,SING,C20,H20,no,N,57,,178841,30735,PCW
58,,SING,C21,C22,no,N,58,,178841,30735,PCW
59,,SING,C21,H211,no,N,59,,178841,30735,PCW
60,,SING,C21,H212,no,N,60,,178841,30735,PCW
61,,SING,C22,C23,no,N,61,,178841,30735,PCW
62,,SING,C22,H221,no,N,62,,178841,30735,PCW
63,,SING,C22,H222,no,N,63,,178841,30735,PCW
64,,SING,C23,C24,no,N,64,,178841,30735,PCW
65,,SING,C23,H231,no,N,65,,178841,30735,PCW
66,,SING,C23,H232,no,N,66,,178841,30735,PCW
67,,SING,C24,C25,no,N,67,,178841,30735,PCW
68,,SING,C24,H241,no,N,68,,178841,30735,PCW
69,,SING,C24,H242,no,N,69,,178841,30735,PCW
70,,SING,C25,C26,no,N,70,,178841,30735,PCW
71,,SING,C25,H251,no,N,71,,178841,30735,PCW
72,,SING,C25,H252,no,N,72,,178841,30735,PCW
73,,SING,C26,C27,no,N,73,,178841,30735,PCW
74,,SING,C26,H261,no,N,74,,178841,30735,PCW
75,,SING,C26,H262,no,N,75,,178841,30735,PCW
76,,SING,C27,C28,no,N,76,,178841,30735,PCW
77,,SING,C27,H271,no,N,77,,178841,30735,PCW
78,,SING,C27,H272,no,N,78,,178841,30735,PCW
79,,SING,C28,H281,no,N,79,,178841,30735,PCW
80,,SING,C28,H282,no,N,80,,178841,30735,PCW
81,,SING,C28,H283,no,N,81,,178841,30735,PCW
82,,SING,C31,C32,no,N,82,,178841,30735,PCW
83,,SING,C31,O2,no,N,83,,178841,30735,PCW
84,,DOUB,C31,O31,no,N,84,,178841,30735,PCW
85,,SING,C32,C33,no,N,85,,178841,30735,PCW
86,,SING,C32,H321,no,N,86,,178841,30735,PCW
87,,SING,C32,H322,no,N,87,,178841,30735,PCW
88,,SING,C33,C34,no,N,88,,178841,30735,PCW
89,,SING,C33,H331,no,N,89,,178841,30735,PCW
90,,SING,C33,H332,no,N,90,,178841,30735,PCW
91,,SING,C34,C35,no,N,91,,178841,30735,PCW
92,,SING,C34,H341,no,N,92,,178841,30735,PCW
93,,SING,C34,H342,no,N,93,,178841,30735,PCW
94,,SING,C35,C36,no,N,94,,178841,30735,PCW
95,,SING,C35,H351,no,N,95,,178841,30735,PCW
96,,SING,C35,H352,no,N,96,,178841,30735,PCW
97,,SING,C36,C37,no,N,97,,178841,30735,PCW
98,,SING,C36,H361,no,N,98,,178841,30735,PCW
99,,SING,C36,H362,no,N,99,,178841,30735,PCW
100,,SING,C37,C38,no,N,100,,178841,30735,PCW
101,,SING,C37,H371,no,N,101,,178841,30735,PCW
102,,SING,C37,H372,no,N,102,,178841,30735,PCW
103,,SING,C38,C39,no,N,103,,178841,30735,PCW
104,,SING,C38,H381,no,N,104,,178841,30735,PCW
105,,SING,C38,H382,no,N,105,,178841,30735,PCW
106,,DOUB,C39,C40,no,Z,106,,178841,30735,PCW
107,,SING,C39,H39,no,N,107,,178841,30735,PCW
108,,SING,C40,C41,no,N,108,,178841,30735,PCW
109,,SING,C40,H40,no,N,109,,178841,30735,PCW
110,,SING,C41,C42,no,N,110,,178841,30735,PCW
111,,SING,C41,H411,no,N,111,,178841,30735,PCW
112,,SING,C41,H412,no,N,112,,178841,30735,PCW
113,,SING,C42,C43,no,N,113,,178841,30735,PCW
114,,SING,C42,H421,no,N,114,,178841,30735,PCW
115,,SING,C42,H422,no,N,115,,178841,30735,PCW
116,,SING,C43,C44,no,N,116,,178841,30735,PCW
117,,SING,C43,H431,no,N,117,,178841,30735,PCW
118,,SING,C43,H432,no,N,118,,178841,30735,PCW
119,,SING,C44,C45,no,N,119,,178841,30735,PCW
120,,SING,C44,H441,no,N,120,,178841,30735,PCW
121,,SING,C44,H442,no,N,121,,178841,30735,PCW
122,,SING,C45,C46,no,N,122,,178841,30735,PCW
123,,SING,C45,H451,no,N,123,,178841,30735,PCW
124,,SING,C45,H452,no,N,124,,178841,30735,PCW
125,,SING,C46,C47,no,N,125,,178841,30735,PCW
126,,SING,C46,H461,no,N,126,,178841,30735,PCW
127,,SING,C46,H462,no,N,127,,178841,30735,PCW
128,,SING,C47,C48,no,N,128,,178841,30735,PCW
129,,SING,C47,H471,no,N,129,,178841,30735,PCW
130,,SING,C47,H472,no,N,130,,178841,30735,PCW
131,,SING,C48,H481,no,N,131,,178841,30735,PCW
132,,SING,C48,H482,no,N,132,,178841,30735,PCW
133,,SING,C48,H483,no,N,133,,178841,30735,PCW
134,,SING,O1P,P,no,N,134,,178841,30735,PCW
135,,SING,O1P,H1P,no,N,135,,178841,30735,PCW
136,,DOUB,O2P,P,no,N,136,,178841,30735,PCW
137,,SING,O3P,P,no,N,137,,178841,30735,PCW
138,,SING,O4P,P,no,N,138,,178841,30735,PCW
1,,SING,C1,O3,no,N,1,,178842,30735,17F
2,,SING,N1,C2,no,N,2,,178842,30735,17F
3,,DOUB,O1,P1,no,N,3,,178842,30735,17F
4,,SING,P1,O6,no,N,4,,178842,30735,17F
5,,SING,C2,C1,no,N,5,,178842,30735,17F
6,,SING,O2,P1,no,N,6,,178842,30735,17F
7,,SING,C3,C2,no,N,7,,178842,30735,17F
8,,SING,C3,O5,no,N,8,,178842,30735,17F
9,,SING,O3,P1,no,N,9,,178842,30735,17F
10,,SING,C4,C5,no,N,10,,178842,30735,17F
11,,DOUB,O4,C3,no,N,11,,178842,30735,17F
12,,SING,C5,C6,no,N,12,,178842,30735,17F
13,,SING,C5,O9,no,N,13,,178842,30735,17F
14,,SING,C6,O7,no,N,14,,178842,30735,17F
15,,SING,O6,C4,no,N,15,,178842,30735,17F
16,,SING,C7,C8,no,N,16,,178842,30735,17F
17,,SING,O7,C7,no,N,17,,178842,30735,17F
18,,SING,C8,C9,no,N,18,,178842,30735,17F
19,,DOUB,O8,C7,no,N,19,,178842,30735,17F
20,,SING,C9,C10,no,N,20,,178842,30735,17F
21,,SING,O9,C17,no,N,21,,178842,30735,17F
22,,SING,C10,C11,no,N,22,,178842,30735,17F
23,,SING,C11,C12,no,N,23,,178842,30735,17F
24,,SING,C12,C1X,no,N,24,,178842,30735,17F
25,,DOUB,C17,O10,no,N,25,,178842,30735,17F
26,,SING,C17,C18,no,N,26,,178842,30735,17F
27,,SING,C18,C19,no,N,27,,178842,30735,17F
28,,SING,C19,C20,no,N,28,,178842,30735,17F
29,,SING,C20,C1Y,no,N,29,,178842,30735,17F
30,,SING,C1Y,C1Z,no,N,30,,178842,30735,17F
31,,SING,C1X,C2X,no,N,31,,178842,30735,17F
32,,SING,C2X,C21,no,N,32,,178842,30735,17F
33,,DOUB,C21,C22,no,Z,33,,178842,30735,17F
34,,SING,C22,C23,no,N,34,,178842,30735,17F
35,,SING,C23,C24,no,N,35,,178842,30735,17F
36,,SING,C24,C25,no,N,36,,178842,30735,17F
37,,SING,C25,C26,no,N,37,,178842,30735,17F
38,,SING,C26,C27,no,N,38,,178842,30735,17F
39,,SING,C27,C28,no,N,39,,178842,30735,17F
40,,SING,C28,C29,no,N,40,,178842,30735,17F
41,,SING,C29,C30,no,N,41,,178842,30735,17F
42,,SING,C1Z,C31,no,N,42,,178842,30735,17F
43,,SING,C31,C32,no,N,43,,178842,30735,17F
44,,SING,C32,C33,no,N,44,,178842,30735,17F
45,,DOUB,C33,C34,no,Z,45,,178842,30735,17F
46,,SING,C34,C35,no,N,46,,178842,30735,17F
47,,SING,C35,C36,no,N,47,,178842,30735,17F
48,,SING,C36,C37,no,N,48,,178842,30735,17F
49,,SING,C37,C38,no,N,49,,178842,30735,17F
50,,SING,C38,C39,no,N,50,,178842,30735,17F
51,,SING,C39,C40,no,N,51,,178842,30735,17F
52,,SING,C40,C41,no,N,52,,178842,30735,17F
53,,SING,C41,C42,no,N,53,,178842,30735,17F
54,,SING,C1,H1,no,N,54,,178842,30735,17F
55,,SING,C1,H1A,no,N,55,,178842,30735,17F
56,,SING,N1,HN1,no,N,56,,178842,30735,17F
57,,SING,N1,HN1A,no,N,57,,178842,30735,17F
58,,SING,C2,H2,no,N,58,,178842,30735,17F
59,,SING,O2,HO2,no,N,59,,178842,30735,17F
60,,SING,C4,H4,no,N,60,,178842,30735,17F
61,,SING,C4,H4A,no,N,61,,178842,30735,17F
62,,SING,C5,H5,no,N,62,,178842,30735,17F
63,,SING,O5,HO5,no,N,63,,178842,30735,17F
64,,SING,C6,H6,no,N,64,,178842,30735,17F
65,,SING,C6,H6A,no,N,65,,178842,30735,17F
66,,SING,C8,H8,no,N,66,,178842,30735,17F
67,,SING,C8,H8A,no,N,67,,178842,30735,17F
68,,SING,C9,H9,no,N,68,,178842,30735,17F
69,,SING,C9,H9A,no,N,69,,178842,30735,17F
70,,SING,C10,H10,no,N,70,,178842,30735,17F
71,,SING,C10,H10A,no,N,71,,178842,30735,17F
72,,SING,C11,H11,no,N,72,,178842,30735,17F
73,,SING,C11,H11A,no,N,73,,178842,30735,17F
74,,SING,C12,H12,no,N,74,,178842,30735,17F
75,,SING,C12,H12A,no,N,75,,178842,30735,17F
76,,SING,C18,H18,no,N,76,,178842,30735,17F
77,,SING,C18,H18A,no,N,77,,178842,30735,17F
78,,SING,C19,H19,no,N,78,,178842,30735,17F
79,,SING,C19,H19A,no,N,79,,178842,30735,17F
80,,SING,C20,H20,no,N,80,,178842,30735,17F
81,,SING,C20,H20A,no,N,81,,178842,30735,17F
82,,SING,C1X,H29,no,N,82,,178842,30735,17F
83,,SING,C1X,H30,no,N,83,,178842,30735,17F
84,,SING,C1Y,H31,no,N,84,,178842,30735,17F
85,,SING,C1Y,H32,no,N,85,,178842,30735,17F
86,,SING,C1Z,H33,no,N,86,,178842,30735,17F
87,,SING,C1Z,H34,no,N,87,,178842,30735,17F
88,,SING,C2X,H35,no,N,88,,178842,30735,17F
89,,SING,C2X,H36,no,N,89,,178842,30735,17F
90,,SING,C21,H37,no,N,90,,178842,30735,17F
91,,SING,C22,H38,no,N,91,,178842,30735,17F
92,,SING,C23,H39,no,N,92,,178842,30735,17F
93,,SING,C23,H40,no,N,93,,178842,30735,17F
94,,SING,C24,H41,no,N,94,,178842,30735,17F
95,,SING,C24,H42,no,N,95,,178842,30735,17F
96,,SING,C25,H43,no,N,96,,178842,30735,17F
97,,SING,C25,H44,no,N,97,,178842,30735,17F
98,,SING,C26,H45,no,N,98,,178842,30735,17F
99,,SING,C26,H46,no,N,99,,178842,30735,17F
100,,SING,C27,H47,no,N,100,,178842,30735,17F
101,,SING,C27,H48,no,N,101,,178842,30735,17F
102,,SING,C28,H49,no,N,102,,178842,30735,17F
103,,SING,C28,H50,no,N,103,,178842,30735,17F
104,,SING,C29,H51,no,N,104,,178842,30735,17F
105,,SING,C29,H52,no,N,105,,178842,30735,17F
106,,SING,C30,H53,no,N,106,,178842,30735,17F
107,,SING,C30,H54,no,N,107,,178842,30735,17F
108,,SING,C30,H55,no,N,108,,178842,30735,17F
109,,SING,C31,H56,no,N,109,,178842,30735,17F
110,,SING,C31,H57,no,N,110,,178842,30735,17F
111,,SING,C32,H58,no,N,111,,178842,30735,17F
112,,SING,C32,H59,no,N,112,,178842,30735,17F
113,,SING,C33,H60,no,N,113,,178842,30735,17F
114,,SING,C34,H61,no,N,114,,178842,30735,17F
115,,SING,C35,H62,no,N,115,,178842,30735,17F
116,,SING,C35,H63,no,N,116,,178842,30735,17F
117,,SING,C36,H64,no,N,117,,178842,30735,17F
118,,SING,C36,H65,no,N,118,,178842,30735,17F
119,,SING,C37,H66,no,N,119,,178842,30735,17F
120,,SING,C37,H67,no,N,120,,178842,30735,17F
121,,SING,C38,H68,no,N,121,,178842,30735,17F
122,,SING,C38,H69,no,N,122,,178842,30735,17F
123,,SING,C39,H70,no,N,123,,178842,30735,17F
124,,SING,C39,H71,no,N,124,,178842,30735,17F
125,,SING,C40,H72,no,N,125,,178842,30735,17F
126,,SING,C40,H73,no,N,126,,178842,30735,17F
127,,SING,C41,H74,no,N,127,,178842,30735,17F
128,,SING,C41,H75,no,N,128,,178842,30735,17F
129,,SING,C42,H76,no,N,129,,178842,30735,17F
130,,SING,C42,H77,no,N,130,,178842,30735,17F
131,,SING,C42,H78,no,N,131,,178842,30735,17F
1,,DOUB,PB,O1B,no,N,1,,178843,30735,GDP
2,,SING,PB,O2B,no,N,2,,178843,30735,GDP
3,,SING,PB,O3B,no,N,3,,178843,30735,GDP
4,,SING,PB,O3A,no,N,4,,178843,30735,GDP
5,,SING,O2B,HOB2,no,N,5,,178843,30735,GDP
6,,SING,O3B,HOB3,no,N,6,,178843,30735,GDP
7,,SING,O3A,PA,no,N,7,,178843,30735,GDP
8,,DOUB,PA,O1A,no,N,8,,178843,30735,GDP
9,,SING,PA,O2A,no,N,9,,178843,30735,GDP
10,,SING,PA,O5',no,N,10,,178843,30735,GDP
11,,SING,O2A,HOA2,no,N,11,,178843,30735,GDP
12,,SING,O5',C5',no,N,12,,178843,30735,GDP
13,,SING,C5',C4',no,N,13,,178843,30735,GDP
14,,SING,C5',H5',no,N,14,,178843,30735,GDP
15,,SING,C5',H5'',no,N,15,,178843,30735,GDP
16,,SING,C4',O4',no,N,16,,178843,30735,GDP
17,,SING,C4',C3',no,N,17,,178843,30735,GDP
18,,SING,C4',H4',no,N,18,,178843,30735,GDP
19,,SING,O4',C1',no,N,19,,178843,30735,GDP
20,,SING,C3',O3',no,N,20,,178843,30735,GDP
21,,SING,C3',C2',no,N,21,,178843,30735,GDP
22,,SING,C3',H3',no,N,22,,178843,30735,GDP
23,,SING,O3',HO3',no,N,23,,178843,30735,GDP
24,,SING,C2',O2',no,N,24,,178843,30735,GDP
25,,SING,C2',C1',no,N,25,,178843,30735,GDP
26,,SING,C2',H2',no,N,26,,178843,30735,GDP
27,,SING,O2',HO2',no,N,27,,178843,30735,GDP
28,,SING,C1',N9,no,N,28,,178843,30735,GDP
29,,SING,C1',H1',no,N,29,,178843,30735,GDP
30,,SING,N9,C8,yes,N,30,,178843,30735,GDP
31,,SING,N9,C4,yes,N,31,,178843,30735,GDP
32,,DOUB,C8,N7,yes,N,32,,178843,30735,GDP
33,,SING,C8,H8,no,N,33,,178843,30735,GDP
34,,SING,N7,C5,yes,N,34,,178843,30735,GDP
35,,SING,C5,C6,no,N,35,,178843,30735,GDP
36,,DOUB,C5,C4,yes,N,36,,178843,30735,GDP
37,,DOUB,C6,O6,no,N,37,,178843,30735,GDP
38,,SING,C6,N1,no,N,38,,178843,30735,GDP
39,,SING,N1,C2,no,N,39,,178843,30735,GDP
40,,SING,N1,HN1,no,N,40,,178843,30735,GDP
41,,SING,C2,N2,no,N,41,,178843,30735,GDP
42,,DOUB,C2,N3,no,N,42,,178843,30735,GDP
43,,SING,N2,HN21,no,N,43,,178843,30735,GDP
44,,SING,N2,HN22,no,N,44,,178843,30735,GDP
45,,SING,N3,C4,no,N,45,,178843,30735,GDP
1,,DOUB,C1,O1,no,N,1,,178863,30738,MYR
2,,SING,C1,O2,no,N,2,,178863,30738,MYR
3,,SING,C1,C2,no,N,3,,178863,30738,MYR
4,,SING,O2,HO2,no,N,4,,178863,30738,MYR
5,,SING,C2,C3,no,N,5,,178863,30738,MYR
6,,SING,C2,H21,no,N,6,,178863,30738,MYR
7,,SING,C2,H22,no,N,7,,178863,30738,MYR
8,,SING,C3,C4,no,N,8,,178863,30738,MYR
9,,SING,C3,H31,no,N,9,,178863,30738,MYR
10,,SING,C3,H32,no,N,10,,178863,30738,MYR
11,,SING,C4,C5,no,N,11,,178863,30738,MYR
12,,SING,C4,H41,no,N,12,,178863,30738,MYR
13,,SING,C4,H42,no,N,13,,178863,30738,MYR
14,,SING,C5,C6,no,N,14,,178863,30738,MYR
15,,SING,C5,H51,no,N,15,,178863,30738,MYR
16,,SING,C5,H52,no,N,16,,178863,30738,MYR
17,,SING,C6,C7,no,N,17,,178863,30738,MYR
18,,SING,C6,H61,no,N,18,,178863,30738,MYR
19,,SING,C6,H62,no,N,19,,178863,30738,MYR
20,,SING,C7,C8,no,N,20,,178863,30738,MYR
21,,SING,C7,H71,no,N,21,,178863,30738,MYR
22,,SING,C7,H72,no,N,22,,178863,30738,MYR
23,,SING,C8,C9,no,N,23,,178863,30738,MYR
24,,SING,C8,H81,no,N,24,,178863,30738,MYR
25,,SING,C8,H82,no,N,25,,178863,30738,MYR
26,,SING,C9,C10,no,N,26,,178863,30738,MYR
27,,SING,C9,H91,no,N,27,,178863,30738,MYR
28,,SING,C9,H92,no,N,28,,178863,30738,MYR
29,,SING,C10,C11,no,N,29,,178863,30738,MYR
30,,SING,C10,H101,no,N,30,,178863,30738,MYR
31,,SING,C10,H102,no,N,31,,178863,30738,MYR
32,,SING,C11,C12,no,N,32,,178863,30738,MYR
33,,SING,C11,H111,no,N,33,,178863,30738,MYR
34,,SING,C11,H112,no,N,34,,178863,30738,MYR
35,,SING,C12,C13,no,N,35,,178863,30738,MYR
36,,SING,C12,H121,no,N,36,,178863,30738,MYR
37,,SING,C12,H122,no,N,37,,178863,30738,MYR
38,,SING,C13,C14,no,N,38,,178863,30738,MYR
39,,SING,C13,H131,no,N,39,,178863,30738,MYR
40,,SING,C13,H132,no,N,40,,178863,30738,MYR
41,,SING,C14,H141,no,N,41,,178863,30738,MYR
42,,SING,C14,H142,no,N,42,,178863,30738,MYR
43,,SING,C14,H143,no,N,43,,178863,30738,MYR
1,,SING,N,HN1,no,N,1,,178970,30744,NH2
2,,SING,N,HN2,no,N,2,,178970,30744,NH2
1,,SING,N,HN1,no,N,1,,178989,30745,NH2
2,,SING,N,HN2,no,N,2,,178989,30745,NH2
1,,SING,N,CA,no,N,1,,179026,30748,PCA
2,,SING,N,CD,no,N,2,,179026,30748,PCA
3,,SING,N,H,no,N,3,,179026,30748,PCA
4,,SING,CA,CB,no,N,4,,179026,30748,PCA
5,,SING,CA,C,no,N,5,,179026,30748,PCA
6,,SING,CA,HA,no,N,6,,179026,30748,PCA
7,,SING,CB,CG,no,N,7,,179026,30748,PCA
8,,SING,CB,HB2,no,N,8,,179026,30748,PCA
9,,SING,CB,HB3,no,N,9,,179026,30748,PCA
10,,SING,CG,CD,no,N,10,,179026,30748,PCA
11,,SING,CG,HG2,no,N,11,,179026,30748,PCA
12,,SING,CG,HG3,no,N,12,,179026,30748,PCA
13,,DOUB,CD,OE,no,N,13,,179026,30748,PCA
14,,DOUB,C,O,no,N,14,,179026,30748,PCA
15,,SING,C,OXT,no,N,15,,179026,30748,PCA
16,,SING,OXT,HXT,no,N,16,,179026,30748,PCA
1,,SING,N,CA,no,N,1,,179047,30749,PCA
2,,SING,N,CD,no,N,2,,179047,30749,PCA
3,,SING,N,H,no,N,3,,179047,30749,PCA
4,,SING,CA,CB,no,N,4,,179047,30749,PCA
5,,SING,CA,C,no,N,5,,179047,30749,PCA
6,,SING,CA,HA,no,N,6,,179047,30749,PCA
7,,SING,CB,CG,no,N,7,,179047,30749,PCA
8,,SING,CB,HB2,no,N,8,,179047,30749,PCA
9,,SING,CB,HB3,no,N,9,,179047,30749,PCA
10,,SING,CG,CD,no,N,10,,179047,30749,PCA
11,,SING,CG,HG2,no,N,11,,179047,30749,PCA
12,,SING,CG,HG3,no,N,12,,179047,30749,PCA
13,,DOUB,CD,OE,no,N,13,,179047,30749,PCA
14,,DOUB,C,O,no,N,14,,179047,30749,PCA
15,,SING,C,OXT,no,N,15,,179047,30749,PCA
16,,SING,OXT,HXT,no,N,16,,179047,30749,PCA
1,,SING,N,HN1,no,N,1,,179066,30750,NH2
2,,SING,N,HN2,no,N,2,,179066,30750,NH2
1,,SING,N,HN1,no,N,1,,179129,30758,NH2
2,,SING,N,HN2,no,N,2,,179129,30758,NH2
1,,DOUB,C6,C7,yes,N,1,,179270,30774,V8Y
2,,SING,C6,C5,yes,N,2,,179270,30774,V8Y
3,,SING,CL1,C5,no,N,3,,179270,30774,V8Y
4,,SING,C7,C8,yes,N,4,,179270,30774,V8Y
5,,DOUB,C5,C10,yes,N,5,,179270,30774,V8Y
6,,DOUB,O1,S1,no,N,6,,179270,30774,V8Y
7,,DOUB,C8,C9,yes,N,7,,179270,30774,V8Y
8,,SING,C10,C9,yes,N,8,,179270,30774,V8Y
9,,SING,C10,C4,yes,N,9,,179270,30774,V8Y
10,,SING,C9,C1,yes,N,10,,179270,30774,V8Y
11,,DOUB,C4,C3,yes,N,11,,179270,30774,V8Y
12,,SING,C1,S1,no,N,12,,179270,30774,V8Y
13,,DOUB,C1,C2,yes,N,13,,179270,30774,V8Y
14,,SING,C3,C2,yes,N,14,,179270,30774,V8Y
15,,DOUB,S1,O2,no,N,15,,179270,30774,V8Y
16,,SING,S1,N1,no,N,16,,179270,30774,V8Y
17,,SING,C11,N1,no,N,17,,179270,30774,V8Y
18,,SING,C11,C12,no,N,18,,179270,30774,V8Y
19,,SING,C12,C13,no,N,19,,179270,30774,V8Y
20,,SING,C14,C13,no,N,20,,179270,30774,V8Y
21,,SING,C14,C15,no,N,21,,179270,30774,V8Y
22,,SING,C15,C16,no,N,22,,179270,30774,V8Y
23,,SING,C16,C17,no,N,23,,179270,30774,V8Y
24,,DOUB,O3,C17,no,N,24,,179270,30774,V8Y
25,,SING,C17,O4,no,N,25,,179270,30774,V8Y
26,,SING,N1,H17,no,N,26,,179270,30774,V8Y
27,,SING,C2,H21,no,N,27,,179270,30774,V8Y
28,,SING,C3,H3,no,N,28,,179270,30774,V8Y
29,,SING,C4,H4,no,N,29,,179270,30774,V8Y
30,,SING,O4,H1,no,N,30,,179270,30774,V8Y
31,,SING,C6,H6,no,N,31,,179270,30774,V8Y
32,,SING,C7,H7,no,N,32,,179270,30774,V8Y
33,,SING,C8,H8,no,N,33,,179270,30774,V8Y
34,,SING,C11,H11,no,N,34,,179270,30774,V8Y
35,,SING,C11,H8L,no,N,35,,179270,30774,V8Y
36,,SING,C12,H12,no,N,36,,179270,30774,V8Y
37,,SING,C12,H8M,no,N,37,,179270,30774,V8Y
38,,SING,C13,H13,no,N,38,,179270,30774,V8Y
39,,SING,C13,H8O,no,N,39,,179270,30774,V8Y
40,,SING,C14,H14,no,N,40,,179270,30774,V8Y
41,,SING,C14,H8N,no,N,41,,179270,30774,V8Y
42,,SING,C15,H15,no,N,42,,179270,30774,V8Y
43,,SING,C15,H8P,no,N,43,,179270,30774,V8Y
44,,SING,C16,H16,no,N,44,,179270,30774,V8Y
45,,SING,C16,H8Q,no,N,45,,179270,30774,V8Y
1,,SING,N,CA,no,N,1,,179361,30789,DAL
2,,SING,N,H,no,N,2,,179361,30789,DAL
3,,SING,N,H2,no,N,3,,179361,30789,DAL
4,,SING,CA,CB,no,N,4,,179361,30789,DAL
5,,SING,CA,C,no,N,5,,179361,30789,DAL
6,,SING,CA,HA,no,N,6,,179361,30789,DAL
7,,SING,CB,HB1,no,N,7,,179361,30789,DAL
8,,SING,CB,HB2,no,N,8,,179361,30789,DAL
9,,SING,CB,HB3,no,N,9,,179361,30789,DAL
10,,DOUB,C,O,no,N,10,,179361,30789,DAL
11,,SING,C,OXT,no,N,11,,179361,30789,DAL
12,,SING,OXT,HXT,no,N,12,,179361,30789,DAL
1,,SING,N,CA,no,N,1,,179362,30789,DBB
2,,SING,CA,C,no,N,2,,179362,30789,DBB
3,,SING,CA,CB,no,N,3,,179362,30789,DBB
4,,DOUB,C,O,no,N,4,,179362,30789,DBB
5,,SING,CB,CG,no,N,5,,179362,30789,DBB
6,,SING,C,OXT,no,N,6,,179362,30789,DBB
7,,SING,N,H,no,N,7,,179362,30789,DBB
8,,SING,N,H1,no,N,8,,179362,30789,DBB
9,,SING,CA,HA,no,N,9,,179362,30789,DBB
10,,SING,CB,HB2,no,N,10,,179362,30789,DBB
11,,SING,CB,HB3,no,N,11,,179362,30789,DBB
12,,SING,CG,HG1,no,N,12,,179362,30789,DBB
13,,SING,CG,HG2,no,N,13,,179362,30789,DBB
14,,SING,CG,HG3,no,N,14,,179362,30789,DBB
15,,SING,OXT,HXT,no,N,15,,179362,30789,DBB
1,,SING,N,CA,no,N,1,,179363,30789,DBU
2,,SING,N,H,no,N,2,,179363,30789,DBU
3,,SING,N,H2,no,N,3,,179363,30789,DBU
4,,DOUB,CA,CB,no,Z,4,,179363,30789,DBU
5,,SING,CA,C,no,N,5,,179363,30789,DBU
6,,SING,CB,CG,no,N,6,,179363,30789,DBU
7,,SING,CB,HB,no,N,7,,179363,30789,DBU
8,,SING,CG,HG1,no,N,8,,179363,30789,DBU
9,,SING,CG,HG2,no,N,9,,179363,30789,DBU
10,,SING,CG,HG3,no,N,10,,179363,30789,DBU
11,,DOUB,C,O,no,N,11,,179363,30789,DBU
12,,SING,C,OXT,no,N,12,,179363,30789,DBU
13,,SING,OXT,HXT,no,N,13,,179363,30789,DBU
1,,SING,C1,C2,no,N,1,,179588,316,AAC
2,,SING,C1,O1,no,N,2,,179588,316,AAC
3,,DOUB,C1,O2,no,N,3,,179588,316,AAC
4,,SING,C2,N1,no,N,4,,179588,316,AAC
5,,SING,C2,HC21,no,N,5,,179588,316,AAC
6,,SING,C2,HC22,no,N,6,,179588,316,AAC
7,,SING,C3,C4,no,N,7,,179588,316,AAC
8,,SING,C3,N1,no,N,8,,179588,316,AAC
9,,DOUB,C3,O3,no,N,9,,179588,316,AAC
10,,SING,C4,HC41,no,N,10,,179588,316,AAC
11,,SING,C4,HC42,no,N,11,,179588,316,AAC
12,,SING,C4,HC43,no,N,12,,179588,316,AAC
13,,SING,N1,HN1,no,N,13,,179588,316,AAC
14,,SING,O1,HO1,no,N,14,,179588,316,AAC
1,,SING,FE,NA,no,N,1,,179589,316,HEC
2,,SING,FE,NB,no,N,2,,179589,316,HEC
3,,SING,FE,NC,no,N,3,,179589,316,HEC
4,,SING,FE,ND,no,N,4,,179589,316,HEC
5,,DOUB,CHA,C1A,no,N,5,,179589,316,HEC
6,,SING,CHA,C4D,no,N,6,,179589,316,HEC
7,,SING,CHA,HHA,no,N,7,,179589,316,HEC
8,,DOUB,CHB,C4A,no,N,8,,179589,316,HEC
9,,SING,CHB,C1B,no,N,9,,179589,316,HEC
10,,SING,CHB,HHB,no,N,10,,179589,316,HEC
11,,DOUB,CHC,C4B,no,N,11,,179589,316,HEC
12,,SING,CHC,C1C,no,N,12,,179589,316,HEC
13,,SING,CHC,HHC,no,N,13,,179589,316,HEC
14,,DOUB,CHD,C4C,no,N,14,,179589,316,HEC
15,,SING,CHD,C1D,no,N,15,,179589,316,HEC
16,,SING,CHD,HHD,no,N,16,,179589,316,HEC
17,,SING,NA,C1A,yes,N,17,,179589,316,HEC
18,,SING,NA,C4A,yes,N,18,,179589,316,HEC
19,,SING,C1A,C2A,yes,N,19,,179589,316,HEC
20,,DOUB,C2A,C3A,yes,N,20,,179589,316,HEC
21,,SING,C2A,CAA,no,N,21,,179589,316,HEC
22,,SING,C3A,C4A,yes,N,22,,179589,316,HEC
23,,SING,C3A,CMA,no,N,23,,179589,316,HEC
24,,SING,CMA,HMA1,no,N,24,,179589,316,HEC
25,,SING,CMA,HMA2,no,N,25,,179589,316,HEC
26,,SING,CMA,HMA3,no,N,26,,179589,316,HEC
27,,SING,CAA,CBA,no,N,27,,179589,316,HEC
28,,SING,CAA,HAA1,no,N,28,,179589,316,HEC
29,,SING,CAA,HAA2,no,N,29,,179589,316,HEC
30,,SING,CBA,CGA,no,N,30,,179589,316,HEC
31,,SING,CBA,HBA1,no,N,31,,179589,316,HEC
32,,SING,CBA,HBA2,no,N,32,,179589,316,HEC
33,,DOUB,CGA,O1A,no,N,33,,179589,316,HEC
34,,SING,CGA,O2A,no,N,34,,179589,316,HEC
35,,SING,O2A,H2A,no,N,35,,179589,316,HEC
36,,SING,NB,C1B,yes,N,36,,179589,316,HEC
37,,SING,NB,C4B,yes,N,37,,179589,316,HEC
38,,DOUB,C1B,C2B,yes,N,38,,179589,316,HEC
39,,SING,C2B,C3B,yes,N,39,,179589,316,HEC
40,,SING,C2B,CMB,no,N,40,,179589,316,HEC
41,,SING,C3B,C4B,yes,N,41,,179589,316,HEC
42,,DOUB,C3B,CAB,no,E,42,,179589,316,HEC
43,,SING,CMB,HMB1,no,N,43,,179589,316,HEC
44,,SING,CMB,HMB2,no,N,44,,179589,316,HEC
45,,SING,CMB,HMB3,no,N,45,,179589,316,HEC
46,,SING,CAB,CBB,no,N,46,,179589,316,HEC
47,,SING,CAB,HAB,no,N,47,,179589,316,HEC
48,,SING,CBB,HBB1,no,N,48,,179589,316,HEC
49,,SING,CBB,HBB2,no,N,49,,179589,316,HEC
50,,SING,CBB,HBB3,no,N,50,,179589,316,HEC
51,,SING,NC,C1C,yes,N,51,,179589,316,HEC
52,,SING,NC,C4C,yes,N,52,,179589,316,HEC
53,,DOUB,C1C,C2C,yes,N,53,,179589,316,HEC
54,,SING,C2C,C3C,yes,N,54,,179589,316,HEC
55,,SING,C2C,CMC,no,N,55,,179589,316,HEC
56,,SING,C3C,C4C,yes,N,56,,179589,316,HEC
57,,DOUB,C3C,CAC,no,E,57,,179589,316,HEC
58,,SING,CMC,HMC1,no,N,58,,179589,316,HEC
59,,SING,CMC,HMC2,no,N,59,,179589,316,HEC
60,,SING,CMC,HMC3,no,N,60,,179589,316,HEC
61,,SING,CAC,CBC,no,N,61,,179589,316,HEC
62,,SING,CAC,HAC,no,N,62,,179589,316,HEC
63,,SING,CBC,HBC1,no,N,63,,179589,316,HEC
64,,SING,CBC,HBC2,no,N,64,,179589,316,HEC
65,,SING,CBC,HBC3,no,N,65,,179589,316,HEC
66,,SING,ND,C1D,yes,N,66,,179589,316,HEC
67,,SING,ND,C4D,yes,N,67,,179589,316,HEC
68,,DOUB,C1D,C2D,yes,N,68,,179589,316,HEC
69,,SING,C2D,C3D,yes,N,69,,179589,316,HEC
70,,SING,C2D,CMD,no,N,70,,179589,316,HEC
71,,DOUB,C3D,C4D,yes,N,71,,179589,316,HEC
72,,SING,C3D,CAD,no,N,72,,179589,316,HEC
73,,SING,CMD,HMD1,no,N,73,,179589,316,HEC
74,,SING,CMD,HMD2,no,N,74,,179589,316,HEC
75,,SING,CMD,HMD3,no,N,75,,179589,316,HEC
76,,SING,CAD,CBD,no,N,76,,179589,316,HEC
77,,SING,CAD,HAD1,no,N,77,,179589,316,HEC
78,,SING,CAD,HAD2,no,N,78,,179589,316,HEC
79,,SING,CBD,CGD,no,N,79,,179589,316,HEC
80,,SING,CBD,HBD1,no,N,80,,179589,316,HEC
81,,SING,CBD,HBD2,no,N,81,,179589,316,HEC
82,,DOUB,CGD,O1D,no,N,82,,179589,316,HEC
83,,SING,CGD,O2D,no,N,83,,179589,316,HEC
84,,SING,O2D,H2D,no,N,84,,179589,316,HEC
1,,SING,C1,C2,no,N,1,,179604,317,AAC
2,,SING,C1,O1,no,N,2,,179604,317,AAC
3,,DOUB,C1,O2,no,N,3,,179604,317,AAC
4,,SING,C2,N1,no,N,4,,179604,317,AAC
5,,SING,C2,HC21,no,N,5,,179604,317,AAC
6,,SING,C2,HC22,no,N,6,,179604,317,AAC
7,,SING,C3,C4,no,N,7,,179604,317,AAC
8,,SING,C3,N1,no,N,8,,179604,317,AAC
9,,DOUB,C3,O3,no,N,9,,179604,317,AAC
10,,SING,C4,HC41,no,N,10,,179604,317,AAC
11,,SING,C4,HC42,no,N,11,,179604,317,AAC
12,,SING,C4,HC43,no,N,12,,179604,317,AAC
13,,SING,N1,HN1,no,N,13,,179604,317,AAC
14,,SING,O1,HO1,no,N,14,,179604,317,AAC
1,,SING,FE,NA,no,N,1,,179605,317,HEC
2,,SING,FE,NB,no,N,2,,179605,317,HEC
3,,SING,FE,NC,no,N,3,,179605,317,HEC
4,,SING,FE,ND,no,N,4,,179605,317,HEC
5,,DOUB,CHA,C1A,no,N,5,,179605,317,HEC
6,,SING,CHA,C4D,no,N,6,,179605,317,HEC
7,,SING,CHA,HHA,no,N,7,,179605,317,HEC
8,,DOUB,CHB,C4A,no,N,8,,179605,317,HEC
9,,SING,CHB,C1B,no,N,9,,179605,317,HEC
10,,SING,CHB,HHB,no,N,10,,179605,317,HEC
11,,DOUB,CHC,C4B,no,N,11,,179605,317,HEC
12,,SING,CHC,C1C,no,N,12,,179605,317,HEC
13,,SING,CHC,HHC,no,N,13,,179605,317,HEC
14,,DOUB,CHD,C4C,no,N,14,,179605,317,HEC
15,,SING,CHD,C1D,no,N,15,,179605,317,HEC
16,,SING,CHD,HHD,no,N,16,,179605,317,HEC
17,,SING,NA,C1A,yes,N,17,,179605,317,HEC
18,,SING,NA,C4A,yes,N,18,,179605,317,HEC
19,,SING,C1A,C2A,yes,N,19,,179605,317,HEC
20,,DOUB,C2A,C3A,yes,N,20,,179605,317,HEC
21,,SING,C2A,CAA,no,N,21,,179605,317,HEC
22,,SING,C3A,C4A,yes,N,22,,179605,317,HEC
23,,SING,C3A,CMA,no,N,23,,179605,317,HEC
24,,SING,CMA,HMA1,no,N,24,,179605,317,HEC
25,,SING,CMA,HMA2,no,N,25,,179605,317,HEC
26,,SING,CMA,HMA3,no,N,26,,179605,317,HEC
27,,SING,CAA,CBA,no,N,27,,179605,317,HEC
28,,SING,CAA,HAA1,no,N,28,,179605,317,HEC
29,,SING,CAA,HAA2,no,N,29,,179605,317,HEC
30,,SING,CBA,CGA,no,N,30,,179605,317,HEC
31,,SING,CBA,HBA1,no,N,31,,179605,317,HEC
32,,SING,CBA,HBA2,no,N,32,,179605,317,HEC
33,,DOUB,CGA,O1A,no,N,33,,179605,317,HEC
34,,SING,CGA,O2A,no,N,34,,179605,317,HEC
35,,SING,O2A,H2A,no,N,35,,179605,317,HEC
36,,SING,NB,C1B,yes,N,36,,179605,317,HEC
37,,SING,NB,C4B,yes,N,37,,179605,317,HEC
38,,DOUB,C1B,C2B,yes,N,38,,179605,317,HEC
39,,SING,C2B,C3B,yes,N,39,,179605,317,HEC
40,,SING,C2B,CMB,no,N,40,,179605,317,HEC
41,,SING,C3B,C4B,yes,N,41,,179605,317,HEC
42,,DOUB,C3B,CAB,no,E,42,,179605,317,HEC
43,,SING,CMB,HMB1,no,N,43,,179605,317,HEC
44,,SING,CMB,HMB2,no,N,44,,179605,317,HEC
45,,SING,CMB,HMB3,no,N,45,,179605,317,HEC
46,,SING,CAB,CBB,no,N,46,,179605,317,HEC
47,,SING,CAB,HAB,no,N,47,,179605,317,HEC
48,,SING,CBB,HBB1,no,N,48,,179605,317,HEC
49,,SING,CBB,HBB2,no,N,49,,179605,317,HEC
50,,SING,CBB,HBB3,no,N,50,,179605,317,HEC
51,,SING,NC,C1C,yes,N,51,,179605,317,HEC
52,,SING,NC,C4C,yes,N,52,,179605,317,HEC
53,,DOUB,C1C,C2C,yes,N,53,,179605,317,HEC
54,,SING,C2C,C3C,yes,N,54,,179605,317,HEC
55,,SING,C2C,CMC,no,N,55,,179605,317,HEC
56,,SING,C3C,C4C,yes,N,56,,179605,317,HEC
57,,DOUB,C3C,CAC,no,E,57,,179605,317,HEC
58,,SING,CMC,HMC1,no,N,58,,179605,317,HEC
59,,SING,CMC,HMC2,no,N,59,,179605,317,HEC
60,,SING,CMC,HMC3,no,N,60,,179605,317,HEC
61,,SING,CAC,CBC,no,N,61,,179605,317,HEC
62,,SING,CAC,HAC,no,N,62,,179605,317,HEC
63,,SING,CBC,HBC1,no,N,63,,179605,317,HEC
64,,SING,CBC,HBC2,no,N,64,,179605,317,HEC
65,,SING,CBC,HBC3,no,N,65,,179605,317,HEC
66,,SING,ND,C1D,yes,N,66,,179605,317,HEC
67,,SING,ND,C4D,yes,N,67,,179605,317,HEC
68,,DOUB,C1D,C2D,yes,N,68,,179605,317,HEC
69,,SING,C2D,C3D,yes,N,69,,179605,317,HEC
70,,SING,C2D,CMD,no,N,70,,179605,317,HEC
71,,DOUB,C3D,C4D,yes,N,71,,179605,317,HEC
72,,SING,C3D,CAD,no,N,72,,179605,317,HEC
73,,SING,CMD,HMD1,no,N,73,,179605,317,HEC
74,,SING,CMD,HMD2,no,N,74,,179605,317,HEC
75,,SING,CMD,HMD3,no,N,75,,179605,317,HEC
76,,SING,CAD,CBD,no,N,76,,179605,317,HEC
77,,SING,CAD,HAD1,no,N,77,,179605,317,HEC
78,,SING,CAD,HAD2,no,N,78,,179605,317,HEC
79,,SING,CBD,CGD,no,N,79,,179605,317,HEC
80,,SING,CBD,HBD1,no,N,80,,179605,317,HEC
81,,SING,CBD,HBD2,no,N,81,,179605,317,HEC
82,,DOUB,CGD,O1D,no,N,82,,179605,317,HEC
83,,SING,CGD,O2D,no,N,83,,179605,317,HEC
84,,SING,O2D,H2D,no,N,84,,179605,317,HEC
1,,SING,N,HN1,no,N,1,,179632,321,NH2
2,,SING,N,HN2,no,N,2,,179632,321,NH2
1,,SING,C1A,C2A,no,N,1,,179683,329,SAC
2,,DOUB,C1A,OAC,no,N,2,,179683,329,SAC
3,,SING,C1A,N,no,N,3,,179683,329,SAC
4,,SING,C2A,H2A1,no,N,4,,179683,329,SAC
5,,SING,C2A,H2A2,no,N,5,,179683,329,SAC
6,,SING,C2A,H2A3,no,N,6,,179683,329,SAC
7,,SING,N,CA,no,N,7,,179683,329,SAC
8,,SING,N,H,no,N,8,,179683,329,SAC
9,,SING,CA,C,no,N,9,,179683,329,SAC
10,,SING,CA,CB,no,N,10,,179683,329,SAC
11,,SING,CA,HA,no,N,11,,179683,329,SAC
12,,DOUB,C,O,no,N,12,,179683,329,SAC
13,,SING,C,OXT,no,N,13,,179683,329,SAC
14,,SING,OXT,HXT,no,N,14,,179683,329,SAC
15,,SING,CB,OG,no,N,15,,179683,329,SAC
16,,SING,CB,HB2,no,N,16,,179683,329,SAC
17,,SING,CB,HB3,no,N,17,,179683,329,SAC
18,,SING,OG,HG,no,N,18,,179683,329,SAC
1,,SING,FE,NA,no,N,1,,179698,330,HEC
2,,SING,FE,NB,no,N,2,,179698,330,HEC
3,,SING,FE,NC,no,N,3,,179698,330,HEC
4,,SING,FE,ND,no,N,4,,179698,330,HEC
5,,DOUB,CHA,C1A,no,N,5,,179698,330,HEC
6,,SING,CHA,C4D,no,N,6,,179698,330,HEC
7,,SING,CHA,HHA,no,N,7,,179698,330,HEC
8,,DOUB,CHB,C4A,no,N,8,,179698,330,HEC
9,,SING,CHB,C1B,no,N,9,,179698,330,HEC
10,,SING,CHB,HHB,no,N,10,,179698,330,HEC
11,,DOUB,CHC,C4B,no,N,11,,179698,330,HEC
12,,SING,CHC,C1C,no,N,12,,179698,330,HEC
13,,SING,CHC,HHC,no,N,13,,179698,330,HEC
14,,DOUB,CHD,C4C,no,N,14,,179698,330,HEC
15,,SING,CHD,C1D,no,N,15,,179698,330,HEC
16,,SING,CHD,HHD,no,N,16,,179698,330,HEC
17,,SING,NA,C1A,yes,N,17,,179698,330,HEC
18,,SING,NA,C4A,yes,N,18,,179698,330,HEC
19,,SING,C1A,C2A,yes,N,19,,179698,330,HEC
20,,DOUB,C2A,C3A,yes,N,20,,179698,330,HEC
21,,SING,C2A,CAA,no,N,21,,179698,330,HEC
22,,SING,C3A,C4A,yes,N,22,,179698,330,HEC
23,,SING,C3A,CMA,no,N,23,,179698,330,HEC
24,,SING,CMA,HMA1,no,N,24,,179698,330,HEC
25,,SING,CMA,HMA2,no,N,25,,179698,330,HEC
26,,SING,CMA,HMA3,no,N,26,,179698,330,HEC
27,,SING,CAA,CBA,no,N,27,,179698,330,HEC
28,,SING,CAA,HAA1,no,N,28,,179698,330,HEC
29,,SING,CAA,HAA2,no,N,29,,179698,330,HEC
30,,SING,CBA,CGA,no,N,30,,179698,330,HEC
31,,SING,CBA,HBA1,no,N,31,,179698,330,HEC
32,,SING,CBA,HBA2,no,N,32,,179698,330,HEC
33,,DOUB,CGA,O1A,no,N,33,,179698,330,HEC
34,,SING,CGA,O2A,no,N,34,,179698,330,HEC
35,,SING,O2A,H2A,no,N,35,,179698,330,HEC
36,,SING,NB,C1B,yes,N,36,,179698,330,HEC
37,,SING,NB,C4B,yes,N,37,,179698,330,HEC
38,,DOUB,C1B,C2B,yes,N,38,,179698,330,HEC
39,,SING,C2B,C3B,yes,N,39,,179698,330,HEC
40,,SING,C2B,CMB,no,N,40,,179698,330,HEC
41,,SING,C3B,C4B,yes,N,41,,179698,330,HEC
42,,DOUB,C3B,CAB,no,E,42,,179698,330,HEC
43,,SING,CMB,HMB1,no,N,43,,179698,330,HEC
44,,SING,CMB,HMB2,no,N,44,,179698,330,HEC
45,,SING,CMB,HMB3,no,N,45,,179698,330,HEC
46,,SING,CAB,CBB,no,N,46,,179698,330,HEC
47,,SING,CAB,HAB,no,N,47,,179698,330,HEC
48,,SING,CBB,HBB1,no,N,48,,179698,330,HEC
49,,SING,CBB,HBB2,no,N,49,,179698,330,HEC
50,,SING,CBB,HBB3,no,N,50,,179698,330,HEC
51,,SING,NC,C1C,yes,N,51,,179698,330,HEC
52,,SING,NC,C4C,yes,N,52,,179698,330,HEC
53,,DOUB,C1C,C2C,yes,N,53,,179698,330,HEC
54,,SING,C2C,C3C,yes,N,54,,179698,330,HEC
55,,SING,C2C,CMC,no,N,55,,179698,330,HEC
56,,SING,C3C,C4C,yes,N,56,,179698,330,HEC
57,,DOUB,C3C,CAC,no,E,57,,179698,330,HEC
58,,SING,CMC,HMC1,no,N,58,,179698,330,HEC
59,,SING,CMC,HMC2,no,N,59,,179698,330,HEC
60,,SING,CMC,HMC3,no,N,60,,179698,330,HEC
61,,SING,CAC,CBC,no,N,61,,179698,330,HEC
62,,SING,CAC,HAC,no,N,62,,179698,330,HEC
63,,SING,CBC,HBC1,no,N,63,,179698,330,HEC
64,,SING,CBC,HBC2,no,N,64,,179698,330,HEC
65,,SING,CBC,HBC3,no,N,65,,179698,330,HEC
66,,SING,ND,C1D,yes,N,66,,179698,330,HEC
67,,SING,ND,C4D,yes,N,67,,179698,330,HEC
68,,DOUB,C1D,C2D,yes,N,68,,179698,330,HEC
69,,SING,C2D,C3D,yes,N,69,,179698,330,HEC
70,,SING,C2D,CMD,no,N,70,,179698,330,HEC
71,,DOUB,C3D,C4D,yes,N,71,,179698,330,HEC
72,,SING,C3D,CAD,no,N,72,,179698,330,HEC
73,,SING,CMD,HMD1,no,N,73,,179698,330,HEC
74,,SING,CMD,HMD2,no,N,74,,179698,330,HEC
75,,SING,CMD,HMD3,no,N,75,,179698,330,HEC
76,,SING,CAD,CBD,no,N,76,,179698,330,HEC
77,,SING,CAD,HAD1,no,N,77,,179698,330,HEC
78,,SING,CAD,HAD2,no,N,78,,179698,330,HEC
79,,SING,CBD,CGD,no,N,79,,179698,330,HEC
80,,SING,CBD,HBD1,no,N,80,,179698,330,HEC
81,,SING,CBD,HBD2,no,N,81,,179698,330,HEC
82,,DOUB,CGD,O1D,no,N,82,,179698,330,HEC
83,,SING,CGD,O2D,no,N,83,,179698,330,HEC
84,,SING,O2D,H2D,no,N,84,,179698,330,HEC
1,,SING,N,CA,no,N,1,,179699,330,M3L
2,,SING,N,H,no,N,2,,179699,330,M3L
3,,SING,N,H2,no,N,3,,179699,330,M3L
4,,SING,CA,CB,no,N,4,,179699,330,M3L
5,,SING,CA,C,no,N,5,,179699,330,M3L
6,,SING,CA,HA,no,N,6,,179699,330,M3L
7,,SING,CB,CG,no,N,7,,179699,330,M3L
8,,SING,CB,HB2,no,N,8,,179699,330,M3L
9,,SING,CB,HB3,no,N,9,,179699,330,M3L
10,,SING,CG,CD,no,N,10,,179699,330,M3L
11,,SING,CG,HG2,no,N,11,,179699,330,M3L
12,,SING,CG,HG3,no,N,12,,179699,330,M3L
13,,SING,CD,CE,no,N,13,,179699,330,M3L
14,,SING,CD,HD2,no,N,14,,179699,330,M3L
15,,SING,CD,HD3,no,N,15,,179699,330,M3L
16,,SING,CE,NZ,no,N,16,,179699,330,M3L
17,,SING,CE,HE2,no,N,17,,179699,330,M3L
18,,SING,CE,HE3,no,N,18,,179699,330,M3L
19,,SING,NZ,CM1,no,N,19,,179699,330,M3L
20,,SING,NZ,CM2,no,N,20,,179699,330,M3L
21,,SING,NZ,CM3,no,N,21,,179699,330,M3L
22,,DOUB,C,O,no,N,22,,179699,330,M3L
23,,SING,C,OXT,no,N,23,,179699,330,M3L
24,,SING,OXT,HXT,no,N,24,,179699,330,M3L
25,,SING,CM1,HM11,no,N,25,,179699,330,M3L
26,,SING,CM1,HM12,no,N,26,,179699,330,M3L
27,,SING,CM1,HM13,no,N,27,,179699,330,M3L
28,,SING,CM2,HM21,no,N,28,,179699,330,M3L
29,,SING,CM2,HM22,no,N,29,,179699,330,M3L
30,,SING,CM2,HM23,no,N,30,,179699,330,M3L
31,,SING,CM3,HM31,no,N,31,,179699,330,M3L
32,,SING,CM3,HM32,no,N,32,,179699,330,M3L
33,,SING,CM3,HM33,no,N,33,,179699,330,M3L
1,,SING,FE,NA,no,N,1,,179713,331,HEC
2,,SING,FE,NB,no,N,2,,179713,331,HEC
3,,SING,FE,NC,no,N,3,,179713,331,HEC
4,,SING,FE,ND,no,N,4,,179713,331,HEC
5,,DOUB,CHA,C1A,no,N,5,,179713,331,HEC
6,,SING,CHA,C4D,no,N,6,,179713,331,HEC
7,,SING,CHA,HHA,no,N,7,,179713,331,HEC
8,,DOUB,CHB,C4A,no,N,8,,179713,331,HEC
9,,SING,CHB,C1B,no,N,9,,179713,331,HEC
10,,SING,CHB,HHB,no,N,10,,179713,331,HEC
11,,DOUB,CHC,C4B,no,N,11,,179713,331,HEC
12,,SING,CHC,C1C,no,N,12,,179713,331,HEC
13,,SING,CHC,HHC,no,N,13,,179713,331,HEC
14,,DOUB,CHD,C4C,no,N,14,,179713,331,HEC
15,,SING,CHD,C1D,no,N,15,,179713,331,HEC
16,,SING,CHD,HHD,no,N,16,,179713,331,HEC
17,,SING,NA,C1A,yes,N,17,,179713,331,HEC
18,,SING,NA,C4A,yes,N,18,,179713,331,HEC
19,,SING,C1A,C2A,yes,N,19,,179713,331,HEC
20,,DOUB,C2A,C3A,yes,N,20,,179713,331,HEC
21,,SING,C2A,CAA,no,N,21,,179713,331,HEC
22,,SING,C3A,C4A,yes,N,22,,179713,331,HEC
23,,SING,C3A,CMA,no,N,23,,179713,331,HEC
24,,SING,CMA,HMA1,no,N,24,,179713,331,HEC
25,,SING,CMA,HMA2,no,N,25,,179713,331,HEC
26,,SING,CMA,HMA3,no,N,26,,179713,331,HEC
27,,SING,CAA,CBA,no,N,27,,179713,331,HEC
28,,SING,CAA,HAA1,no,N,28,,179713,331,HEC
29,,SING,CAA,HAA2,no,N,29,,179713,331,HEC
30,,SING,CBA,CGA,no,N,30,,179713,331,HEC
31,,SING,CBA,HBA1,no,N,31,,179713,331,HEC
32,,SING,CBA,HBA2,no,N,32,,179713,331,HEC
33,,DOUB,CGA,O1A,no,N,33,,179713,331,HEC
34,,SING,CGA,O2A,no,N,34,,179713,331,HEC
35,,SING,O2A,H2A,no,N,35,,179713,331,HEC
36,,SING,NB,C1B,yes,N,36,,179713,331,HEC
37,,SING,NB,C4B,yes,N,37,,179713,331,HEC
38,,DOUB,C1B,C2B,yes,N,38,,179713,331,HEC
39,,SING,C2B,C3B,yes,N,39,,179713,331,HEC
40,,SING,C2B,CMB,no,N,40,,179713,331,HEC
41,,SING,C3B,C4B,yes,N,41,,179713,331,HEC
42,,DOUB,C3B,CAB,no,E,42,,179713,331,HEC
43,,SING,CMB,HMB1,no,N,43,,179713,331,HEC
44,,SING,CMB,HMB2,no,N,44,,179713,331,HEC
45,,SING,CMB,HMB3,no,N,45,,179713,331,HEC
46,,SING,CAB,CBB,no,N,46,,179713,331,HEC
47,,SING,CAB,HAB,no,N,47,,179713,331,HEC
48,,SING,CBB,HBB1,no,N,48,,179713,331,HEC
49,,SING,CBB,HBB2,no,N,49,,179713,331,HEC
50,,SING,CBB,HBB3,no,N,50,,179713,331,HEC
51,,SING,NC,C1C,yes,N,51,,179713,331,HEC
52,,SING,NC,C4C,yes,N,52,,179713,331,HEC
53,,DOUB,C1C,C2C,yes,N,53,,179713,331,HEC
54,,SING,C2C,C3C,yes,N,54,,179713,331,HEC
55,,SING,C2C,CMC,no,N,55,,179713,331,HEC
56,,SING,C3C,C4C,yes,N,56,,179713,331,HEC
57,,DOUB,C3C,CAC,no,E,57,,179713,331,HEC
58,,SING,CMC,HMC1,no,N,58,,179713,331,HEC
59,,SING,CMC,HMC2,no,N,59,,179713,331,HEC
60,,SING,CMC,HMC3,no,N,60,,179713,331,HEC
61,,SING,CAC,CBC,no,N,61,,179713,331,HEC
62,,SING,CAC,HAC,no,N,62,,179713,331,HEC
63,,SING,CBC,HBC1,no,N,63,,179713,331,HEC
64,,SING,CBC,HBC2,no,N,64,,179713,331,HEC
65,,SING,CBC,HBC3,no,N,65,,179713,331,HEC
66,,SING,ND,C1D,yes,N,66,,179713,331,HEC
67,,SING,ND,C4D,yes,N,67,,179713,331,HEC
68,,DOUB,C1D,C2D,yes,N,68,,179713,331,HEC
69,,SING,C2D,C3D,yes,N,69,,179713,331,HEC
70,,SING,C2D,CMD,no,N,70,,179713,331,HEC
71,,DOUB,C3D,C4D,yes,N,71,,179713,331,HEC
72,,SING,C3D,CAD,no,N,72,,179713,331,HEC
73,,SING,CMD,HMD1,no,N,73,,179713,331,HEC
74,,SING,CMD,HMD2,no,N,74,,179713,331,HEC
75,,SING,CMD,HMD3,no,N,75,,179713,331,HEC
76,,SING,CAD,CBD,no,N,76,,179713,331,HEC
77,,SING,CAD,HAD1,no,N,77,,179713,331,HEC
78,,SING,CAD,HAD2,no,N,78,,179713,331,HEC
79,,SING,CBD,CGD,no,N,79,,179713,331,HEC
80,,SING,CBD,HBD1,no,N,80,,179713,331,HEC
81,,SING,CBD,HBD2,no,N,81,,179713,331,HEC
82,,DOUB,CGD,O1D,no,N,82,,179713,331,HEC
83,,SING,CGD,O2D,no,N,83,,179713,331,HEC
84,,SING,O2D,H2D,no,N,84,,179713,331,HEC
1,,SING,N,CA,no,N,1,,179714,331,M3L
2,,SING,N,H,no,N,2,,179714,331,M3L
3,,SING,N,H2,no,N,3,,179714,331,M3L
4,,SING,CA,CB,no,N,4,,179714,331,M3L
5,,SING,CA,C,no,N,5,,179714,331,M3L
6,,SING,CA,HA,no,N,6,,179714,331,M3L
7,,SING,CB,CG,no,N,7,,179714,331,M3L
8,,SING,CB,HB2,no,N,8,,179714,331,M3L
9,,SING,CB,HB3,no,N,9,,179714,331,M3L
10,,SING,CG,CD,no,N,10,,179714,331,M3L
11,,SING,CG,HG2,no,N,11,,179714,331,M3L
12,,SING,CG,HG3,no,N,12,,179714,331,M3L
13,,SING,CD,CE,no,N,13,,179714,331,M3L
14,,SING,CD,HD2,no,N,14,,179714,331,M3L
15,,SING,CD,HD3,no,N,15,,179714,331,M3L
16,,SING,CE,NZ,no,N,16,,179714,331,M3L
17,,SING,CE,HE2,no,N,17,,179714,331,M3L
18,,SING,CE,HE3,no,N,18,,179714,331,M3L
19,,SING,NZ,CM1,no,N,19,,179714,331,M3L
20,,SING,NZ,CM2,no,N,20,,179714,331,M3L
21,,SING,NZ,CM3,no,N,21,,179714,331,M3L
22,,DOUB,C,O,no,N,22,,179714,331,M3L
23,,SING,C,OXT,no,N,23,,179714,331,M3L
24,,SING,OXT,HXT,no,N,24,,179714,331,M3L
25,,SING,CM1,HM11,no,N,25,,179714,331,M3L
26,,SING,CM1,HM12,no,N,26,,179714,331,M3L
27,,SING,CM1,HM13,no,N,27,,179714,331,M3L
28,,SING,CM2,HM21,no,N,28,,179714,331,M3L
29,,SING,CM2,HM22,no,N,29,,179714,331,M3L
30,,SING,CM2,HM23,no,N,30,,179714,331,M3L
31,,SING,CM3,HM31,no,N,31,,179714,331,M3L
32,,SING,CM3,HM32,no,N,32,,179714,331,M3L
33,,SING,CM3,HM33,no,N,33,,179714,331,M3L
1,,SING,C1,C2,no,N,1,,179764,336,AAC
2,,SING,C1,O1,no,N,2,,179764,336,AAC
3,,DOUB,C1,O2,no,N,3,,179764,336,AAC
4,,SING,C2,N1,no,N,4,,179764,336,AAC
5,,SING,C2,HC21,no,N,5,,179764,336,AAC
6,,SING,C2,HC22,no,N,6,,179764,336,AAC
7,,SING,C3,C4,no,N,7,,179764,336,AAC
8,,SING,C3,N1,no,N,8,,179764,336,AAC
9,,DOUB,C3,O3,no,N,9,,179764,336,AAC
10,,SING,C4,HC41,no,N,10,,179764,336,AAC
11,,SING,C4,HC42,no,N,11,,179764,336,AAC
12,,SING,C4,HC43,no,N,12,,179764,336,AAC
13,,SING,N1,HN1,no,N,13,,179764,336,AAC
14,,SING,O1,HO1,no,N,14,,179764,336,AAC
1,,SING,FE,NA,no,N,1,,179765,336,HEC
2,,SING,FE,NB,no,N,2,,179765,336,HEC
3,,SING,FE,NC,no,N,3,,179765,336,HEC
4,,SING,FE,ND,no,N,4,,179765,336,HEC
5,,DOUB,CHA,C1A,no,N,5,,179765,336,HEC
6,,SING,CHA,C4D,no,N,6,,179765,336,HEC
7,,SING,CHA,HHA,no,N,7,,179765,336,HEC
8,,DOUB,CHB,C4A,no,N,8,,179765,336,HEC
9,,SING,CHB,C1B,no,N,9,,179765,336,HEC
10,,SING,CHB,HHB,no,N,10,,179765,336,HEC
11,,DOUB,CHC,C4B,no,N,11,,179765,336,HEC
12,,SING,CHC,C1C,no,N,12,,179765,336,HEC
13,,SING,CHC,HHC,no,N,13,,179765,336,HEC
14,,DOUB,CHD,C4C,no,N,14,,179765,336,HEC
15,,SING,CHD,C1D,no,N,15,,179765,336,HEC
16,,SING,CHD,HHD,no,N,16,,179765,336,HEC
17,,SING,NA,C1A,yes,N,17,,179765,336,HEC
18,,SING,NA,C4A,yes,N,18,,179765,336,HEC
19,,SING,C1A,C2A,yes,N,19,,179765,336,HEC
20,,DOUB,C2A,C3A,yes,N,20,,179765,336,HEC
21,,SING,C2A,CAA,no,N,21,,179765,336,HEC
22,,SING,C3A,C4A,yes,N,22,,179765,336,HEC
23,,SING,C3A,CMA,no,N,23,,179765,336,HEC
24,,SING,CMA,HMA1,no,N,24,,179765,336,HEC
25,,SING,CMA,HMA2,no,N,25,,179765,336,HEC
26,,SING,CMA,HMA3,no,N,26,,179765,336,HEC
27,,SING,CAA,CBA,no,N,27,,179765,336,HEC
28,,SING,CAA,HAA1,no,N,28,,179765,336,HEC
29,,SING,CAA,HAA2,no,N,29,,179765,336,HEC
30,,SING,CBA,CGA,no,N,30,,179765,336,HEC
31,,SING,CBA,HBA1,no,N,31,,179765,336,HEC
32,,SING,CBA,HBA2,no,N,32,,179765,336,HEC
33,,DOUB,CGA,O1A,no,N,33,,179765,336,HEC
34,,SING,CGA,O2A,no,N,34,,179765,336,HEC
35,,SING,O2A,H2A,no,N,35,,179765,336,HEC
36,,SING,NB,C1B,yes,N,36,,179765,336,HEC
37,,SING,NB,C4B,yes,N,37,,179765,336,HEC
38,,DOUB,C1B,C2B,yes,N,38,,179765,336,HEC
39,,SING,C2B,C3B,yes,N,39,,179765,336,HEC
40,,SING,C2B,CMB,no,N,40,,179765,336,HEC
41,,SING,C3B,C4B,yes,N,41,,179765,336,HEC
42,,DOUB,C3B,CAB,no,E,42,,179765,336,HEC
43,,SING,CMB,HMB1,no,N,43,,179765,336,HEC
44,,SING,CMB,HMB2,no,N,44,,179765,336,HEC
45,,SING,CMB,HMB3,no,N,45,,179765,336,HEC
46,,SING,CAB,CBB,no,N,46,,179765,336,HEC
47,,SING,CAB,HAB,no,N,47,,179765,336,HEC
48,,SING,CBB,HBB1,no,N,48,,179765,336,HEC
49,,SING,CBB,HBB2,no,N,49,,179765,336,HEC
50,,SING,CBB,HBB3,no,N,50,,179765,336,HEC
51,,SING,NC,C1C,yes,N,51,,179765,336,HEC
52,,SING,NC,C4C,yes,N,52,,179765,336,HEC
53,,DOUB,C1C,C2C,yes,N,53,,179765,336,HEC
54,,SING,C2C,C3C,yes,N,54,,179765,336,HEC
55,,SING,C2C,CMC,no,N,55,,179765,336,HEC
56,,SING,C3C,C4C,yes,N,56,,179765,336,HEC
57,,DOUB,C3C,CAC,no,E,57,,179765,336,HEC
58,,SING,CMC,HMC1,no,N,58,,179765,336,HEC
59,,SING,CMC,HMC2,no,N,59,,179765,336,HEC
60,,SING,CMC,HMC3,no,N,60,,179765,336,HEC
61,,SING,CAC,CBC,no,N,61,,179765,336,HEC
62,,SING,CAC,HAC,no,N,62,,179765,336,HEC
63,,SING,CBC,HBC1,no,N,63,,179765,336,HEC
64,,SING,CBC,HBC2,no,N,64,,179765,336,HEC
65,,SING,CBC,HBC3,no,N,65,,179765,336,HEC
66,,SING,ND,C1D,yes,N,66,,179765,336,HEC
67,,SING,ND,C4D,yes,N,67,,179765,336,HEC
68,,DOUB,C1D,C2D,yes,N,68,,179765,336,HEC
69,,SING,C2D,C3D,yes,N,69,,179765,336,HEC
70,,SING,C2D,CMD,no,N,70,,179765,336,HEC
71,,DOUB,C3D,C4D,yes,N,71,,179765,336,HEC
72,,SING,C3D,CAD,no,N,72,,179765,336,HEC
73,,SING,CMD,HMD1,no,N,73,,179765,336,HEC
74,,SING,CMD,HMD2,no,N,74,,179765,336,HEC
75,,SING,CMD,HMD3,no,N,75,,179765,336,HEC
76,,SING,CAD,CBD,no,N,76,,179765,336,HEC
77,,SING,CAD,HAD1,no,N,77,,179765,336,HEC
78,,SING,CAD,HAD2,no,N,78,,179765,336,HEC
79,,SING,CBD,CGD,no,N,79,,179765,336,HEC
80,,SING,CBD,HBD1,no,N,80,,179765,336,HEC
81,,SING,CBD,HBD2,no,N,81,,179765,336,HEC
82,,DOUB,CGD,O1D,no,N,82,,179765,336,HEC
83,,SING,CGD,O2D,no,N,83,,179765,336,HEC
84,,SING,O2D,H2D,no,N,84,,179765,336,HEC
1,,SING,FE,NA,no,N,1,,179780,337,HEC
2,,SING,FE,NB,no,N,2,,179780,337,HEC
3,,SING,FE,NC,no,N,3,,179780,337,HEC
4,,SING,FE,ND,no,N,4,,179780,337,HEC
5,,DOUB,CHA,C1A,no,N,5,,179780,337,HEC
6,,SING,CHA,C4D,no,N,6,,179780,337,HEC
7,,SING,CHA,HHA,no,N,7,,179780,337,HEC
8,,DOUB,CHB,C4A,no,N,8,,179780,337,HEC
9,,SING,CHB,C1B,no,N,9,,179780,337,HEC
10,,SING,CHB,HHB,no,N,10,,179780,337,HEC
11,,DOUB,CHC,C4B,no,N,11,,179780,337,HEC
12,,SING,CHC,C1C,no,N,12,,179780,337,HEC
13,,SING,CHC,HHC,no,N,13,,179780,337,HEC
14,,DOUB,CHD,C4C,no,N,14,,179780,337,HEC
15,,SING,CHD,C1D,no,N,15,,179780,337,HEC
16,,SING,CHD,HHD,no,N,16,,179780,337,HEC
17,,SING,NA,C1A,yes,N,17,,179780,337,HEC
18,,SING,NA,C4A,yes,N,18,,179780,337,HEC
19,,SING,C1A,C2A,yes,N,19,,179780,337,HEC
20,,DOUB,C2A,C3A,yes,N,20,,179780,337,HEC
21,,SING,C2A,CAA,no,N,21,,179780,337,HEC
22,,SING,C3A,C4A,yes,N,22,,179780,337,HEC
23,,SING,C3A,CMA,no,N,23,,179780,337,HEC
24,,SING,CMA,HMA1,no,N,24,,179780,337,HEC
25,,SING,CMA,HMA2,no,N,25,,179780,337,HEC
26,,SING,CMA,HMA3,no,N,26,,179780,337,HEC
27,,SING,CAA,CBA,no,N,27,,179780,337,HEC
28,,SING,CAA,HAA1,no,N,28,,179780,337,HEC
29,,SING,CAA,HAA2,no,N,29,,179780,337,HEC
30,,SING,CBA,CGA,no,N,30,,179780,337,HEC
31,,SING,CBA,HBA1,no,N,31,,179780,337,HEC
32,,SING,CBA,HBA2,no,N,32,,179780,337,HEC
33,,DOUB,CGA,O1A,no,N,33,,179780,337,HEC
34,,SING,CGA,O2A,no,N,34,,179780,337,HEC
35,,SING,O2A,H2A,no,N,35,,179780,337,HEC
36,,SING,NB,C1B,yes,N,36,,179780,337,HEC
37,,SING,NB,C4B,yes,N,37,,179780,337,HEC
38,,DOUB,C1B,C2B,yes,N,38,,179780,337,HEC
39,,SING,C2B,C3B,yes,N,39,,179780,337,HEC
40,,SING,C2B,CMB,no,N,40,,179780,337,HEC
41,,SING,C3B,C4B,yes,N,41,,179780,337,HEC
42,,DOUB,C3B,CAB,no,E,42,,179780,337,HEC
43,,SING,CMB,HMB1,no,N,43,,179780,337,HEC
44,,SING,CMB,HMB2,no,N,44,,179780,337,HEC
45,,SING,CMB,HMB3,no,N,45,,179780,337,HEC
46,,SING,CAB,CBB,no,N,46,,179780,337,HEC
47,,SING,CAB,HAB,no,N,47,,179780,337,HEC
48,,SING,CBB,HBB1,no,N,48,,179780,337,HEC
49,,SING,CBB,HBB2,no,N,49,,179780,337,HEC
50,,SING,CBB,HBB3,no,N,50,,179780,337,HEC
51,,SING,NC,C1C,yes,N,51,,179780,337,HEC
52,,SING,NC,C4C,yes,N,52,,179780,337,HEC
53,,DOUB,C1C,C2C,yes,N,53,,179780,337,HEC
54,,SING,C2C,C3C,yes,N,54,,179780,337,HEC
55,,SING,C2C,CMC,no,N,55,,179780,337,HEC
56,,SING,C3C,C4C,yes,N,56,,179780,337,HEC
57,,DOUB,C3C,CAC,no,E,57,,179780,337,HEC
58,,SING,CMC,HMC1,no,N,58,,179780,337,HEC
59,,SING,CMC,HMC2,no,N,59,,179780,337,HEC
60,,SING,CMC,HMC3,no,N,60,,179780,337,HEC
61,,SING,CAC,CBC,no,N,61,,179780,337,HEC
62,,SING,CAC,HAC,no,N,62,,179780,337,HEC
63,,SING,CBC,HBC1,no,N,63,,179780,337,HEC
64,,SING,CBC,HBC2,no,N,64,,179780,337,HEC
65,,SING,CBC,HBC3,no,N,65,,179780,337,HEC
66,,SING,ND,C1D,yes,N,66,,179780,337,HEC
67,,SING,ND,C4D,yes,N,67,,179780,337,HEC
68,,DOUB,C1D,C2D,yes,N,68,,179780,337,HEC
69,,SING,C2D,C3D,yes,N,69,,179780,337,HEC
70,,SING,C2D,CMD,no,N,70,,179780,337,HEC
71,,DOUB,C3D,C4D,yes,N,71,,179780,337,HEC
72,,SING,C3D,CAD,no,N,72,,179780,337,HEC
73,,SING,CMD,HMD1,no,N,73,,179780,337,HEC
74,,SING,CMD,HMD2,no,N,74,,179780,337,HEC
75,,SING,CMD,HMD3,no,N,75,,179780,337,HEC
76,,SING,CAD,CBD,no,N,76,,179780,337,HEC
77,,SING,CAD,HAD1,no,N,77,,179780,337,HEC
78,,SING,CAD,HAD2,no,N,78,,179780,337,HEC
79,,SING,CBD,CGD,no,N,79,,179780,337,HEC
80,,SING,CBD,HBD1,no,N,80,,179780,337,HEC
81,,SING,CBD,HBD2,no,N,81,,179780,337,HEC
82,,DOUB,CGD,O1D,no,N,82,,179780,337,HEC
83,,SING,CGD,O2D,no,N,83,,179780,337,HEC
84,,SING,O2D,H2D,no,N,84,,179780,337,HEC
1,,DOUB,C,O,no,N,1,,179820,3394,ACE
2,,SING,C,CH3,no,N,2,,179820,3394,ACE
3,,SING,C,H,no,N,3,,179820,3394,ACE
4,,SING,CH3,H1,no,N,4,,179820,3394,ACE
5,,SING,CH3,H2,no,N,5,,179820,3394,ACE
6,,SING,CH3,H3,no,N,6,,179820,3394,ACE
1,,SING,MG,NA,no,N,1,,180063,34012,BCL
2,,SING,MG,NB,no,N,2,,180063,34012,BCL
3,,SING,MG,NC,no,N,3,,180063,34012,BCL
4,,SING,MG,ND,no,N,4,,180063,34012,BCL
5,,SING,CHA,C1A,no,N,5,,180063,34012,BCL
6,,DOUB,CHA,C4D,no,N,6,,180063,34012,BCL
7,,SING,CHA,CBD,no,N,7,,180063,34012,BCL
8,,DOUB,CHB,C4A,no,N,8,,180063,34012,BCL
9,,SING,CHB,C1B,no,N,9,,180063,34012,BCL
10,,SING,CHB,HHB,no,N,10,,180063,34012,BCL
11,,SING,CHC,C4B,no,N,11,,180063,34012,BCL
12,,DOUB,CHC,C1C,no,N,12,,180063,34012,BCL
13,,SING,CHC,HHC,no,N,13,,180063,34012,BCL
14,,SING,CHD,C4C,no,N,14,,180063,34012,BCL
15,,DOUB,CHD,C1D,no,N,15,,180063,34012,BCL
16,,SING,CHD,HHD,no,N,16,,180063,34012,BCL
17,,DOUB,NA,C1A,no,N,17,,180063,34012,BCL
18,,SING,NA,C4A,no,N,18,,180063,34012,BCL
19,,SING,C1A,C2A,no,N,19,,180063,34012,BCL
20,,SING,C2A,C3A,no,N,20,,180063,34012,BCL
21,,SING,C2A,CAA,no,N,21,,180063,34012,BCL
22,,SING,C2A,H2A,no,N,22,,180063,34012,BCL
23,,SING,C3A,C4A,no,N,23,,180063,34012,BCL
24,,SING,C3A,CMA,no,N,24,,180063,34012,BCL
25,,SING,C3A,H3A,no,N,25,,180063,34012,BCL
26,,SING,CMA,HMA1,no,N,26,,180063,34012,BCL
27,,SING,CMA,HMA2,no,N,27,,180063,34012,BCL
28,,SING,CMA,HMA3,no,N,28,,180063,34012,BCL
29,,SING,CAA,CBA,no,N,29,,180063,34012,BCL
30,,SING,CAA,HAA1,no,N,30,,180063,34012,BCL
31,,SING,CAA,HAA2,no,N,31,,180063,34012,BCL
32,,SING,CBA,CGA,no,N,32,,180063,34012,BCL
33,,SING,CBA,HBA1,no,N,33,,180063,34012,BCL
34,,SING,CBA,HBA2,no,N,34,,180063,34012,BCL
35,,DOUB,CGA,O1A,no,N,35,,180063,34012,BCL
36,,SING,CGA,O2A,no,N,36,,180063,34012,BCL
37,,SING,O2A,C1,no,N,37,,180063,34012,BCL
38,,SING,NB,C1B,yes,N,38,,180063,34012,BCL
39,,SING,NB,C4B,yes,N,39,,180063,34012,BCL
40,,DOUB,C1B,C2B,yes,N,40,,180063,34012,BCL
41,,SING,C2B,C3B,yes,N,41,,180063,34012,BCL
42,,SING,C2B,CMB,no,N,42,,180063,34012,BCL
43,,DOUB,C3B,C4B,yes,N,43,,180063,34012,BCL
44,,SING,C3B,CAB,no,N,44,,180063,34012,BCL
45,,SING,CMB,HMB1,no,N,45,,180063,34012,BCL
46,,SING,CMB,HMB2,no,N,46,,180063,34012,BCL
47,,SING,CMB,HMB3,no,N,47,,180063,34012,BCL
48,,DOUB,CAB,OBB,no,N,48,,180063,34012,BCL
49,,SING,CAB,CBB,no,N,49,,180063,34012,BCL
50,,SING,CBB,HBB1,no,N,50,,180063,34012,BCL
51,,SING,CBB,HBB2,no,N,51,,180063,34012,BCL
52,,SING,CBB,HBB3,no,N,52,,180063,34012,BCL
53,,SING,NC,C1C,no,N,53,,180063,34012,BCL
54,,DOUB,NC,C4C,no,N,54,,180063,34012,BCL
55,,SING,C1C,C2C,no,N,55,,180063,34012,BCL
56,,SING,C2C,C3C,no,N,56,,180063,34012,BCL
57,,SING,C2C,CMC,no,N,57,,180063,34012,BCL
58,,SING,C2C,H2C,no,N,58,,180063,34012,BCL
59,,SING,C3C,C4C,no,N,59,,180063,34012,BCL
60,,SING,C3C,CAC,no,N,60,,180063,34012,BCL
61,,SING,C3C,H3C,no,N,61,,180063,34012,BCL
62,,SING,CMC,HMC1,no,N,62,,180063,34012,BCL
63,,SING,CMC,HMC2,no,N,63,,180063,34012,BCL
64,,SING,CMC,HMC3,no,N,64,,180063,34012,BCL
65,,SING,CAC,CBC,no,N,65,,180063,34012,BCL
66,,SING,CAC,HAC1,no,N,66,,180063,34012,BCL
67,,SING,CAC,HAC2,no,N,67,,180063,34012,BCL
68,,SING,CBC,HBC1,no,N,68,,180063,34012,BCL
69,,SING,CBC,HBC2,no,N,69,,180063,34012,BCL
70,,SING,CBC,HBC3,no,N,70,,180063,34012,BCL
71,,SING,ND,C1D,yes,N,71,,180063,34012,BCL
72,,SING,ND,C4D,yes,N,72,,180063,34012,BCL
73,,SING,C1D,C2D,yes,N,73,,180063,34012,BCL
74,,DOUB,C2D,C3D,yes,N,74,,180063,34012,BCL
75,,SING,C2D,CMD,no,N,75,,180063,34012,BCL
76,,SING,C3D,C4D,yes,N,76,,180063,34012,BCL
77,,SING,C3D,CAD,no,N,77,,180063,34012,BCL
78,,SING,CMD,HMD1,no,N,78,,180063,34012,BCL
79,,SING,CMD,HMD2,no,N,79,,180063,34012,BCL
80,,SING,CMD,HMD3,no,N,80,,180063,34012,BCL
81,,DOUB,CAD,OBD,no,N,81,,180063,34012,BCL
82,,SING,CAD,CBD,no,N,82,,180063,34012,BCL
83,,SING,CBD,CGD,no,N,83,,180063,34012,BCL
84,,SING,CBD,HBD,no,N,84,,180063,34012,BCL
85,,DOUB,CGD,O1D,no,N,85,,180063,34012,BCL
86,,SING,CGD,O2D,no,N,86,,180063,34012,BCL
87,,SING,O2D,CED,no,N,87,,180063,34012,BCL
88,,SING,CED,HED1,no,N,88,,180063,34012,BCL
89,,SING,CED,HED2,no,N,89,,180063,34012,BCL
90,,SING,CED,HED3,no,N,90,,180063,34012,BCL
91,,SING,C1,C2,no,N,91,,180063,34012,BCL
92,,SING,C1,H11,no,N,92,,180063,34012,BCL
93,,SING,C1,H12,no,N,93,,180063,34012,BCL
94,,DOUB,C2,C3,no,E,94,,180063,34012,BCL
95,,SING,C2,H2,no,N,95,,180063,34012,BCL
96,,SING,C3,C4,no,N,96,,180063,34012,BCL
97,,SING,C3,C5,no,N,97,,180063,34012,BCL
98,,SING,C4,H41,no,N,98,,180063,34012,BCL
99,,SING,C4,H42,no,N,99,,180063,34012,BCL
100,,SING,C4,H43,no,N,100,,180063,34012,BCL
101,,SING,C5,C6,no,N,101,,180063,34012,BCL
102,,SING,C5,H51,no,N,102,,180063,34012,BCL
103,,SING,C5,H52,no,N,103,,180063,34012,BCL
104,,SING,C6,C7,no,N,104,,180063,34012,BCL
105,,SING,C6,H61,no,N,105,,180063,34012,BCL
106,,SING,C6,H62,no,N,106,,180063,34012,BCL
107,,SING,C7,C8,no,N,107,,180063,34012,BCL
108,,SING,C7,H71,no,N,108,,180063,34012,BCL
109,,SING,C7,H72,no,N,109,,180063,34012,BCL
110,,SING,C8,C9,no,N,110,,180063,34012,BCL
111,,SING,C8,C10,no,N,111,,180063,34012,BCL
112,,SING,C8,H8,no,N,112,,180063,34012,BCL
113,,SING,C9,H91,no,N,113,,180063,34012,BCL
114,,SING,C9,H92,no,N,114,,180063,34012,BCL
115,,SING,C9,H93,no,N,115,,180063,34012,BCL
116,,SING,C10,C11,no,N,116,,180063,34012,BCL
117,,SING,C10,H101,no,N,117,,180063,34012,BCL
118,,SING,C10,H102,no,N,118,,180063,34012,BCL
119,,SING,C11,C12,no,N,119,,180063,34012,BCL
120,,SING,C11,H111,no,N,120,,180063,34012,BCL
121,,SING,C11,H112,no,N,121,,180063,34012,BCL
122,,SING,C12,C13,no,N,122,,180063,34012,BCL
123,,SING,C12,H121,no,N,123,,180063,34012,BCL
124,,SING,C12,H122,no,N,124,,180063,34012,BCL
125,,SING,C13,C14,no,N,125,,180063,34012,BCL
126,,SING,C13,C15,no,N,126,,180063,34012,BCL
127,,SING,C13,H13,no,N,127,,180063,34012,BCL
128,,SING,C14,H141,no,N,128,,180063,34012,BCL
129,,SING,C14,H142,no,N,129,,180063,34012,BCL
130,,SING,C14,H143,no,N,130,,180063,34012,BCL
131,,SING,C15,C16,no,N,131,,180063,34012,BCL
132,,SING,C15,H151,no,N,132,,180063,34012,BCL
133,,SING,C15,H152,no,N,133,,180063,34012,BCL
134,,SING,C16,C17,no,N,134,,180063,34012,BCL
135,,SING,C16,H161,no,N,135,,180063,34012,BCL
136,,SING,C16,H162,no,N,136,,180063,34012,BCL
137,,SING,C17,C18,no,N,137,,180063,34012,BCL
138,,SING,C17,H171,no,N,138,,180063,34012,BCL
139,,SING,C17,H172,no,N,139,,180063,34012,BCL
140,,SING,C18,C19,no,N,140,,180063,34012,BCL
141,,SING,C18,C20,no,N,141,,180063,34012,BCL
142,,SING,C18,H18,no,N,142,,180063,34012,BCL
143,,SING,C19,H191,no,N,143,,180063,34012,BCL
144,,SING,C19,H192,no,N,144,,180063,34012,BCL
145,,SING,C19,H193,no,N,145,,180063,34012,BCL
146,,SING,C20,H201,no,N,146,,180063,34012,BCL
147,,SING,C20,H202,no,N,147,,180063,34012,BCL
148,,SING,C20,H203,no,N,148,,180063,34012,BCL
1,,SING,N,CA,no,N,1,,180104,34014,PCA
2,,SING,N,CD,no,N,2,,180104,34014,PCA
3,,SING,N,H,no,N,3,,180104,34014,PCA
4,,SING,CA,CB,no,N,4,,180104,34014,PCA
5,,SING,CA,C,no,N,5,,180104,34014,PCA
6,,SING,CA,HA,no,N,6,,180104,34014,PCA
7,,SING,CB,CG,no,N,7,,180104,34014,PCA
8,,SING,CB,HB2,no,N,8,,180104,34014,PCA
9,,SING,CB,HB3,no,N,9,,180104,34014,PCA
10,,SING,CG,CD,no,N,10,,180104,34014,PCA
11,,SING,CG,HG2,no,N,11,,180104,34014,PCA
12,,SING,CG,HG3,no,N,12,,180104,34014,PCA
13,,DOUB,CD,OE,no,N,13,,180104,34014,PCA
14,,DOUB,C,O,no,N,14,,180104,34014,PCA
15,,SING,C,OXT,no,N,15,,180104,34014,PCA
16,,SING,OXT,HXT,no,N,16,,180104,34014,PCA
1,,DOUB,C1,O1,no,N,1,,180124,34015,MYR
2,,SING,C1,O2,no,N,2,,180124,34015,MYR
3,,SING,C1,C2,no,N,3,,180124,34015,MYR
4,,SING,O2,HO2,no,N,4,,180124,34015,MYR
5,,SING,C2,C3,no,N,5,,180124,34015,MYR
6,,SING,C2,H21,no,N,6,,180124,34015,MYR
7,,SING,C2,H22,no,N,7,,180124,34015,MYR
8,,SING,C3,C4,no,N,8,,180124,34015,MYR
9,,SING,C3,H31,no,N,9,,180124,34015,MYR
10,,SING,C3,H32,no,N,10,,180124,34015,MYR
11,,SING,C4,C5,no,N,11,,180124,34015,MYR
12,,SING,C4,H41,no,N,12,,180124,34015,MYR
13,,SING,C4,H42,no,N,13,,180124,34015,MYR
14,,SING,C5,C6,no,N,14,,180124,34015,MYR
15,,SING,C5,H51,no,N,15,,180124,34015,MYR
16,,SING,C5,H52,no,N,16,,180124,34015,MYR
17,,SING,C6,C7,no,N,17,,180124,34015,MYR
18,,SING,C6,H61,no,N,18,,180124,34015,MYR
19,,SING,C6,H62,no,N,19,,180124,34015,MYR
20,,SING,C7,C8,no,N,20,,180124,34015,MYR
21,,SING,C7,H71,no,N,21,,180124,34015,MYR
22,,SING,C7,H72,no,N,22,,180124,34015,MYR
23,,SING,C8,C9,no,N,23,,180124,34015,MYR
24,,SING,C8,H81,no,N,24,,180124,34015,MYR
25,,SING,C8,H82,no,N,25,,180124,34015,MYR
26,,SING,C9,C10,no,N,26,,180124,34015,MYR
27,,SING,C9,H91,no,N,27,,180124,34015,MYR
28,,SING,C9,H92,no,N,28,,180124,34015,MYR
29,,SING,C10,C11,no,N,29,,180124,34015,MYR
30,,SING,C10,H101,no,N,30,,180124,34015,MYR
31,,SING,C10,H102,no,N,31,,180124,34015,MYR
32,,SING,C11,C12,no,N,32,,180124,34015,MYR
33,,SING,C11,H111,no,N,33,,180124,34015,MYR
34,,SING,C11,H112,no,N,34,,180124,34015,MYR
35,,SING,C12,C13,no,N,35,,180124,34015,MYR
36,,SING,C12,H121,no,N,36,,180124,34015,MYR
37,,SING,C12,H122,no,N,37,,180124,34015,MYR
38,,SING,C13,C14,no,N,38,,180124,34015,MYR
39,,SING,C13,H131,no,N,39,,180124,34015,MYR
40,,SING,C13,H132,no,N,40,,180124,34015,MYR
41,,SING,C14,H141,no,N,41,,180124,34015,MYR
42,,SING,C14,H142,no,N,42,,180124,34015,MYR
43,,SING,C14,H143,no,N,43,,180124,34015,MYR
1,,DOUB,C,O,no,N,1,,180159,34017,ACE
2,,SING,C,CH3,no,N,2,,180159,34017,ACE
3,,SING,C,H,no,N,3,,180159,34017,ACE
4,,SING,CH3,H1,no,N,4,,180159,34017,ACE
5,,SING,CH3,H2,no,N,5,,180159,34017,ACE
6,,SING,CH3,H3,no,N,6,,180159,34017,ACE
1,,SING,N,CA,no,N,1,,180160,34017,DCY
2,,SING,N,H,no,N,2,,180160,34017,DCY
3,,SING,N,H2,no,N,3,,180160,34017,DCY
4,,SING,CA,C,no,N,4,,180160,34017,DCY
5,,SING,CA,CB,no,N,5,,180160,34017,DCY
6,,SING,CA,HA,no,N,6,,180160,34017,DCY
7,,DOUB,C,O,no,N,7,,180160,34017,DCY
8,,SING,C,OXT,no,N,8,,180160,34017,DCY
9,,SING,CB,SG,no,N,9,,180160,34017,DCY
10,,SING,CB,HB2,no,N,10,,180160,34017,DCY
11,,SING,CB,HB3,no,N,11,,180160,34017,DCY
12,,SING,SG,HG,no,N,12,,180160,34017,DCY
13,,SING,OXT,HXT,no,N,13,,180160,34017,DCY
1,,SING,N,HN1,no,N,1,,180196,34019,NH2
2,,SING,N,HN2,no,N,2,,180196,34019,NH2
1,,SING,O1',CD1',no,N,1,,180254,34025,6XM
2,,SING,O1',CD2',no,N,2,,180254,34025,6XM
3,,SING,CD1',CC1',no,N,3,,180254,34025,6XM
4,,SING,CC1',N2',no,N,4,,180254,34025,6XM
5,,SING,CD2',CC2',no,N,5,,180254,34025,6XM
6,,SING,CC2',N2',no,N,6,,180254,34025,6XM
7,,SING,N2',CB',no,N,7,,180254,34025,6XM
8,,SING,CB',CA',no,N,8,,180254,34025,6XM
9,,SING,CA',N1',no,N,9,,180254,34025,6XM
10,,DOUB,C3',C2',yes,N,10,,180254,34025,6XM
11,,SING,C3',C6',yes,N,11,,180254,34025,6XM
12,,SING,C2',C1',yes,N,12,,180254,34025,6XM
13,,SING,N1',C6',no,N,13,,180254,34025,6XM
14,,SING,N1',C9',no,N,14,,180254,34025,6XM
15,,DOUB,C6',C7',yes,N,15,,180254,34025,6XM
16,,DOUB,C1',C8',yes,N,16,,180254,34025,6XM
17,,SING,C4',C9',yes,N,17,,180254,34025,6XM
18,,DOUB,C4',C5,yes,N,18,,180254,34025,6XM
19,,DOUB,C9',C10,yes,N,19,,180254,34025,6XM
20,,SING,C7',C8',yes,N,20,,180254,34025,6XM
21,,SING,C7',C11,no,N,21,,180254,34025,6XM
22,,SING,C8',O,no,N,22,,180254,34025,6XM
23,,SING,C5,C4,yes,N,23,,180254,34025,6XM
24,,SING,C10,C11,no,N,24,,180254,34025,6XM
25,,SING,C10,C9,yes,N,25,,180254,34025,6XM
26,,SING,C11,C7,no,N,26,,180254,34025,6XM
27,,SING,O,C8,no,N,27,,180254,34025,6XM
28,,DOUB,C4,C9,yes,N,28,,180254,34025,6XM
29,,SING,C9,N1,no,N,29,,180254,34025,6XM
30,,SING,C7,C8,yes,N,30,,180254,34025,6XM
31,,DOUB,C7,C6,yes,N,31,,180254,34025,6XM
32,,DOUB,C8,C1,yes,N,32,,180254,34025,6XM
33,,SING,N1,C6,no,N,33,,180254,34025,6XM
34,,SING,N1,CA,no,N,34,,180254,34025,6XM
35,,SING,C6,C3,yes,N,35,,180254,34025,6XM
36,,SING,C1,C2,yes,N,36,,180254,34025,6XM
37,,SING,CA,CB,no,N,37,,180254,34025,6XM
38,,SING,CB,N2,no,N,38,,180254,34025,6XM
39,,SING,CC1,N2,no,N,39,,180254,34025,6XM
40,,SING,CC1,CD1,no,N,40,,180254,34025,6XM
41,,DOUB,C3,C2,yes,N,41,,180254,34025,6XM
42,,SING,N2,CC2,no,N,42,,180254,34025,6XM
43,,SING,CD1,O1,no,N,43,,180254,34025,6XM
44,,SING,CC2,CD2,no,N,44,,180254,34025,6XM
45,,SING,O1,CD2,no,N,45,,180254,34025,6XM
46,,SING,C1,H1,no,N,46,,180254,34025,6XM
47,,SING,C2,H2,no,N,47,,180254,34025,6XM
48,,SING,CA,HA2,no,N,48,,180254,34025,6XM
49,,SING,CA,HA1,no,N,49,,180254,34025,6XM
50,,SING,CB,HB2,no,N,50,,180254,34025,6XM
51,,SING,CB,HB1,no,N,51,,180254,34025,6XM
52,,SING,CC1,HC1,no,N,52,,180254,34025,6XM
53,,SING,CC1,HC2,no,N,53,,180254,34025,6XM
54,,SING,CD1,HD1,no,N,54,,180254,34025,6XM
55,,SING,CD1,HD2,no,N,55,,180254,34025,6XM
56,,SING,CD2,HD3,no,N,56,,180254,34025,6XM
57,,SING,CD2,HD4,no,N,57,,180254,34025,6XM
58,,SING,CC2,HC3,no,N,58,,180254,34025,6XM
59,,SING,CC2,HC4,no,N,59,,180254,34025,6XM
60,,SING,C3,H3,no,N,60,,180254,34025,6XM
61,,SING,C1',H1',no,N,61,,180254,34025,6XM
62,,SING,C2',H2',no,N,62,,180254,34025,6XM
63,,SING,C3',H3',no,N,63,,180254,34025,6XM
64,,SING,C11,H7,no,N,64,,180254,34025,6XM
65,,SING,C4,H4,no,N,65,,180254,34025,6XM
66,,SING,C5,H5,no,N,66,,180254,34025,6XM
67,,SING,C4',H4',no,N,67,,180254,34025,6XM
68,,SING,CA',HA1',no,N,68,,180254,34025,6XM
69,,SING,CA',HA2',no,N,69,,180254,34025,6XM
70,,SING,CB',HB1',no,N,70,,180254,34025,6XM
71,,SING,CB',HB2',no,N,71,,180254,34025,6XM
72,,SING,CC2',HC4',no,N,72,,180254,34025,6XM
73,,SING,CC2',HC3',no,N,73,,180254,34025,6XM
74,,SING,CD2',HD4',no,N,74,,180254,34025,6XM
75,,SING,CD2',HD3',no,N,75,,180254,34025,6XM
76,,SING,CD1',HD2',no,N,76,,180254,34025,6XM
77,,SING,CD1',HD1',no,N,77,,180254,34025,6XM
78,,SING,CC1',HC2',no,N,78,,180254,34025,6XM
79,,SING,CC1',HC1',no,N,79,,180254,34025,6XM
1,,DOUB,C1,O1,no,N,1,,180335,34029,MYR
2,,SING,C1,O2,no,N,2,,180335,34029,MYR
3,,SING,C1,C2,no,N,3,,180335,34029,MYR
4,,SING,O2,HO2,no,N,4,,180335,34029,MYR
5,,SING,C2,C3,no,N,5,,180335,34029,MYR
6,,SING,C2,H21,no,N,6,,180335,34029,MYR
7,,SING,C2,H22,no,N,7,,180335,34029,MYR
8,,SING,C3,C4,no,N,8,,180335,34029,MYR
9,,SING,C3,H31,no,N,9,,180335,34029,MYR
10,,SING,C3,H32,no,N,10,,180335,34029,MYR
11,,SING,C4,C5,no,N,11,,180335,34029,MYR
12,,SING,C4,H41,no,N,12,,180335,34029,MYR
13,,SING,C4,H42,no,N,13,,180335,34029,MYR
14,,SING,C5,C6,no,N,14,,180335,34029,MYR
15,,SING,C5,H51,no,N,15,,180335,34029,MYR
16,,SING,C5,H52,no,N,16,,180335,34029,MYR
17,,SING,C6,C7,no,N,17,,180335,34029,MYR
18,,SING,C6,H61,no,N,18,,180335,34029,MYR
19,,SING,C6,H62,no,N,19,,180335,34029,MYR
20,,SING,C7,C8,no,N,20,,180335,34029,MYR
21,,SING,C7,H71,no,N,21,,180335,34029,MYR
22,,SING,C7,H72,no,N,22,,180335,34029,MYR
23,,SING,C8,C9,no,N,23,,180335,34029,MYR
24,,SING,C8,H81,no,N,24,,180335,34029,MYR
25,,SING,C8,H82,no,N,25,,180335,34029,MYR
26,,SING,C9,C10,no,N,26,,180335,34029,MYR
27,,SING,C9,H91,no,N,27,,180335,34029,MYR
28,,SING,C9,H92,no,N,28,,180335,34029,MYR
29,,SING,C10,C11,no,N,29,,180335,34029,MYR
30,,SING,C10,H101,no,N,30,,180335,34029,MYR
31,,SING,C10,H102,no,N,31,,180335,34029,MYR
32,,SING,C11,C12,no,N,32,,180335,34029,MYR
33,,SING,C11,H111,no,N,33,,180335,34029,MYR
34,,SING,C11,H112,no,N,34,,180335,34029,MYR
35,,SING,C12,C13,no,N,35,,180335,34029,MYR
36,,SING,C12,H121,no,N,36,,180335,34029,MYR
37,,SING,C12,H122,no,N,37,,180335,34029,MYR
38,,SING,C13,C14,no,N,38,,180335,34029,MYR
39,,SING,C13,H131,no,N,39,,180335,34029,MYR
40,,SING,C13,H132,no,N,40,,180335,34029,MYR
41,,SING,C14,H141,no,N,41,,180335,34029,MYR
42,,SING,C14,H142,no,N,42,,180335,34029,MYR
43,,SING,C14,H143,no,N,43,,180335,34029,MYR
1,,SING,C1,C2,no,N,1,,180356,34030,FAR
2,,SING,C1,H11,no,N,2,,180356,34030,FAR
3,,SING,C1,H12A,no,N,3,,180356,34030,FAR
4,,SING,C1,H13,no,N,4,,180356,34030,FAR
5,,DOUB,C2,C3,no,E,5,,180356,34030,FAR
6,,SING,C2,H2,no,N,6,,180356,34030,FAR
7,,SING,C3,C5,no,N,7,,180356,34030,FAR
8,,SING,C3,C4,no,N,8,,180356,34030,FAR
9,,SING,C5,C6,no,N,9,,180356,34030,FAR
10,,SING,C5,H51,no,N,10,,180356,34030,FAR
11,,SING,C5,H52,no,N,11,,180356,34030,FAR
12,,SING,C6,C7,no,N,12,,180356,34030,FAR
13,,SING,C6,H61,no,N,13,,180356,34030,FAR
14,,SING,C6,H62,no,N,14,,180356,34030,FAR
15,,DOUB,C7,C8,no,E,15,,180356,34030,FAR
16,,SING,C7,H7,no,N,16,,180356,34030,FAR
17,,SING,C8,C9,no,N,17,,180356,34030,FAR
18,,SING,C8,C10,no,N,18,,180356,34030,FAR
19,,SING,C9,C11,no,N,19,,180356,34030,FAR
20,,SING,C9,H91,no,N,20,,180356,34030,FAR
21,,SING,C9,H92,no,N,21,,180356,34030,FAR
22,,SING,C11,C12,no,N,22,,180356,34030,FAR
23,,SING,C11,H111,no,N,23,,180356,34030,FAR
24,,SING,C11,H112,no,N,24,,180356,34030,FAR
25,,DOUB,C12,C13,no,N,25,,180356,34030,FAR
26,,SING,C12,H12,no,N,26,,180356,34030,FAR
27,,SING,C13,C14,no,N,27,,180356,34030,FAR
28,,SING,C13,C15,no,N,28,,180356,34030,FAR
29,,SING,C14,H141,no,N,29,,180356,34030,FAR
30,,SING,C14,H142,no,N,30,,180356,34030,FAR
31,,SING,C14,H143,no,N,31,,180356,34030,FAR
32,,SING,C15,H151,no,N,32,,180356,34030,FAR
33,,SING,C15,H152,no,N,33,,180356,34030,FAR
34,,SING,C15,H153,no,N,34,,180356,34030,FAR
35,,SING,C4,H41,no,N,35,,180356,34030,FAR
36,,SING,C4,H42,no,N,36,,180356,34030,FAR
37,,SING,C4,H43,no,N,37,,180356,34030,FAR
38,,SING,C10,H101,no,N,38,,180356,34030,FAR
39,,SING,C10,H102,no,N,39,,180356,34030,FAR
40,,SING,C10,H103,no,N,40,,180356,34030,FAR
1,,DOUB,C,O,no,N,1,,180376,34031,ACE
2,,SING,C,CH3,no,N,2,,180376,34031,ACE
3,,SING,C,H,no,N,3,,180376,34031,ACE
4,,SING,CH3,H1,no,N,4,,180376,34031,ACE
5,,SING,CH3,H2,no,N,5,,180376,34031,ACE
6,,SING,CH3,H3,no,N,6,,180376,34031,ACE
1,,SING,N,HN1,no,N,1,,180377,34031,NH2
2,,SING,N,HN2,no,N,2,,180377,34031,NH2
1,,SING,N,CA,no,N,1,,180396,34032,0A1
2,,SING,N,HN1,no,N,2,,180396,34032,0A1
3,,SING,N,HN2,no,N,3,,180396,34032,0A1
4,,SING,CA,C,no,N,4,,180396,34032,0A1
5,,SING,CA,CB,no,N,5,,180396,34032,0A1
6,,SING,CA,HA,no,N,6,,180396,34032,0A1
7,,SING,CB,CG,no,N,7,,180396,34032,0A1
8,,SING,CB,HBC1,no,N,8,,180396,34032,0A1
9,,SING,CB,HBC2,no,N,9,,180396,34032,0A1
10,,SING,CG,CD1,yes,N,10,,180396,34032,0A1
11,,DOUB,CG,CD2,yes,N,11,,180396,34032,0A1
12,,DOUB,CD1,CE1,yes,N,12,,180396,34032,0A1
13,,SING,CD1,HD1,no,N,13,,180396,34032,0A1
14,,SING,CE1,CZ,yes,N,14,,180396,34032,0A1
15,,SING,CE1,HE1,no,N,15,,180396,34032,0A1
16,,SING,CZ,OH,no,N,16,,180396,34032,0A1
17,,SING,OH,CM,no,N,17,,180396,34032,0A1
18,,SING,CM,HMC1,no,N,18,,180396,34032,0A1
19,,SING,CM,HMC2,no,N,19,,180396,34032,0A1
20,,SING,CM,HMC3,no,N,20,,180396,34032,0A1
21,,DOUB,CE2,CZ,yes,N,21,,180396,34032,0A1
22,,SING,CE2,HE2,no,N,22,,180396,34032,0A1
23,,SING,CD2,CE2,yes,N,23,,180396,34032,0A1
24,,SING,CD2,HD2,no,N,24,,180396,34032,0A1
25,,SING,C,OXT,no,N,25,,180396,34032,0A1
26,,DOUB,C,O,no,N,26,,180396,34032,0A1
27,,SING,HXT,OXT,no,N,27,,180396,34032,0A1
1,,DOUB,C,O,no,N,1,,180397,34032,ACE
2,,SING,C,CH3,no,N,2,,180397,34032,ACE
3,,SING,C,H,no,N,3,,180397,34032,ACE
4,,SING,CH3,H1,no,N,4,,180397,34032,ACE
5,,SING,CH3,H2,no,N,5,,180397,34032,ACE
6,,SING,CH3,H3,no,N,6,,180397,34032,ACE
1,,SING,N,HN1,no,N,1,,180398,34032,NH2
2,,SING,N,HN2,no,N,2,,180398,34032,NH2
1,,SING,CB,CA,no,N,1,,180417,34033,4PH
2,,SING,N,CA,no,N,2,,180417,34033,4PH
3,,SING,CA,C,no,N,3,,180417,34033,4PH
4,,SING,CA,HA,no,N,4,,180417,34033,4PH
5,,SING,CB,CG,no,N,5,,180417,34033,4PH
6,,SING,CB,HB2,no,N,6,,180417,34033,4PH
7,,SING,CB,HB3,no,N,7,,180417,34033,4PH
8,,DOUB,CD2,CG,yes,N,8,,180417,34033,4PH
9,,SING,CG,CD1,yes,N,9,,180417,34033,4PH
10,,SING,CD2,CE2,yes,N,10,,180417,34033,4PH
11,,SING,CD2,HD2,no,N,11,,180417,34033,4PH
12,,DOUB,CD1,CE1,yes,N,12,,180417,34033,4PH
13,,SING,CD1,HD1,no,N,13,,180417,34033,4PH
14,,DOUB,CE2,CZ,yes,N,14,,180417,34033,4PH
15,,SING,CE2,HE2,no,N,15,,180417,34033,4PH
16,,SING,CZ,CE1,yes,N,16,,180417,34033,4PH
17,,SING,CE1,HE1,no,N,17,,180417,34033,4PH
18,,SING,CZ,C33,no,N,18,,180417,34033,4PH
19,,DOUB,O,C,no,N,19,,180417,34033,4PH
20,,SING,C,OXT,no,N,20,,180417,34033,4PH
21,,SING,C33,H33,no,N,21,,180417,34033,4PH
22,,SING,C33,H33A,no,N,22,,180417,34033,4PH
23,,SING,C33,H33B,no,N,23,,180417,34033,4PH
24,,SING,N,H,no,N,24,,180417,34033,4PH
25,,SING,N,H2,no,N,25,,180417,34033,4PH
26,,SING,OXT,HXT,no,N,26,,180417,34033,4PH
1,,DOUB,C,O,no,N,1,,180418,34033,ACE
2,,SING,C,CH3,no,N,2,,180418,34033,ACE
3,,SING,C,H,no,N,3,,180418,34033,ACE
4,,SING,CH3,H1,no,N,4,,180418,34033,ACE
5,,SING,CH3,H2,no,N,5,,180418,34033,ACE
6,,SING,CH3,H3,no,N,6,,180418,34033,ACE
1,,SING,N,HN1,no,N,1,,180419,34033,NH2
2,,SING,N,HN2,no,N,2,,180419,34033,NH2
1,,SING,C1,O1,no,N,1,,180478,34036,PGM
2,,SING,C1,C2,no,N,2,,180478,34036,PGM
3,,SING,C1,HC11,no,N,3,,180478,34036,PGM
4,,SING,C1,HC12,no,N,4,,180478,34036,PGM
5,,SING,O1,HO1,no,N,5,,180478,34036,PGM
6,,SING,C2,O2,no,N,6,,180478,34036,PGM
7,,SING,C2,C3,no,N,7,,180478,34036,PGM
8,,SING,C2,HC2,no,N,8,,180478,34036,PGM
9,,SING,O2,HO2,no,N,9,,180478,34036,PGM
10,,SING,C3,O4,no,N,10,,180478,34036,PGM
11,,SING,C3,HC31,no,N,11,,180478,34036,PGM
12,,SING,C3,HC32,no,N,12,,180478,34036,PGM
13,,SING,O4,P5,no,N,13,,180478,34036,PGM
14,,DOUB,P5,O5A,no,N,14,,180478,34036,PGM
15,,SING,P5,O5B,no,N,15,,180478,34036,PGM
16,,SING,P5,O6,no,N,16,,180478,34036,PGM
17,,SING,O6,C7,no,N,17,,180478,34036,PGM
18,,SING,C7,C8,no,N,18,,180478,34036,PGM
19,,SING,C7,HC71,no,N,19,,180478,34036,PGM
20,,SING,C7,HC72,no,N,20,,180478,34036,PGM
21,,SING,C8,O8,no,N,21,,180478,34036,PGM
22,,SING,C8,C9,no,N,22,,180478,34036,PGM
23,,SING,C8,HC8,no,N,23,,180478,34036,PGM
24,,SING,O8,HO8,no,N,24,,180478,34036,PGM
25,,SING,C9,OQ2,no,N,25,,180478,34036,PGM
26,,SING,C9,HC91,no,N,26,,180478,34036,PGM
27,,SING,C9,HC92,no,N,27,,180478,34036,PGM
28,,DOUB,OQ1,CA,no,N,28,,180478,34036,PGM
29,,SING,OQ2,CA,no,N,29,,180478,34036,PGM
30,,SING,CA,CB,no,N,30,,180478,34036,PGM
31,,SING,CB,CC,no,N,31,,180478,34036,PGM
32,,SING,CB,HCB1,no,N,32,,180478,34036,PGM
33,,SING,CB,HCB2,no,N,33,,180478,34036,PGM
34,,SING,CC,CD,no,N,34,,180478,34036,PGM
35,,SING,CC,HCC1,no,N,35,,180478,34036,PGM
36,,SING,CC,HCC2,no,N,36,,180478,34036,PGM
37,,SING,CD,CE,no,N,37,,180478,34036,PGM
38,,SING,CD,HCD1,no,N,38,,180478,34036,PGM
39,,SING,CD,HCD2,no,N,39,,180478,34036,PGM
40,,SING,CE,CF,no,N,40,,180478,34036,PGM
41,,SING,CE,HCE1,no,N,41,,180478,34036,PGM
42,,SING,CE,HCE2,no,N,42,,180478,34036,PGM
43,,SING,CF,CG,no,N,43,,180478,34036,PGM
44,,SING,CF,HCF1,no,N,44,,180478,34036,PGM
45,,SING,CF,HCF2,no,N,45,,180478,34036,PGM
46,,SING,CG,CH,no,N,46,,180478,34036,PGM
47,,SING,CG,HCG1,no,N,47,,180478,34036,PGM
48,,SING,CG,HCG2,no,N,48,,180478,34036,PGM
49,,SING,CH,CI,no,N,49,,180478,34036,PGM
50,,SING,CH,HCH1,no,N,50,,180478,34036,PGM
51,,SING,CH,HCH2,no,N,51,,180478,34036,PGM
52,,SING,CI,CJ,no,N,52,,180478,34036,PGM
53,,SING,CI,HCI1,no,N,53,,180478,34036,PGM
54,,SING,CI,HCI2,no,N,54,,180478,34036,PGM
55,,SING,CJ,CK,no,N,55,,180478,34036,PGM
56,,SING,CJ,HCJ1,no,N,56,,180478,34036,PGM
57,,SING,CJ,HCJ2,no,N,57,,180478,34036,PGM
58,,SING,CK,CL,no,N,58,,180478,34036,PGM
59,,SING,CK,HCK1,no,N,59,,180478,34036,PGM
60,,SING,CK,HCK2,no,N,60,,180478,34036,PGM
61,,SING,CL,CM,no,N,61,,180478,34036,PGM
62,,SING,CL,HCL1,no,N,62,,180478,34036,PGM
63,,SING,CL,HCL2,no,N,63,,180478,34036,PGM
64,,SING,CM,CN,no,N,64,,180478,34036,PGM
65,,SING,CM,HCM1,no,N,65,,180478,34036,PGM
66,,SING,CM,HCM2,no,N,66,,180478,34036,PGM
67,,SING,CN,CO,no,N,67,,180478,34036,PGM
68,,SING,CN,HCN1,no,N,68,,180478,34036,PGM
69,,SING,CN,HCN2,no,N,69,,180478,34036,PGM
70,,SING,CO,CP,no,N,70,,180478,34036,PGM
71,,SING,CO,HCO1,no,N,71,,180478,34036,PGM
72,,SING,CO,HCO2,no,N,72,,180478,34036,PGM
73,,SING,CP,HCP1,no,N,73,,180478,34036,PGM
74,,SING,CP,HCP2,no,N,74,,180478,34036,PGM
75,,SING,CP,HCP3,no,N,75,,180478,34036,PGM
1,,SING,CA,C,no,N,1,,180556,3404,NLG
2,,SING,CA,CB,no,N,2,,180556,3404,NLG
3,,SING,CA,N2,no,N,3,,180556,3404,NLG
4,,SING,CA,HA,no,N,4,,180556,3404,NLG
5,,SING,C,OXT,no,N,5,,180556,3404,NLG
6,,DOUB,C,O,no,N,6,,180556,3404,NLG
7,,SING,OXT,HXT,no,N,7,,180556,3404,NLG
8,,SING,CB,CG,no,N,8,,180556,3404,NLG
9,,SING,CB,HBC1,no,N,9,,180556,3404,NLG
10,,SING,CB,HBC2,no,N,10,,180556,3404,NLG
11,,SING,CG,CD,no,N,11,,180556,3404,NLG
12,,SING,CG,HGC1,no,N,12,,180556,3404,NLG
13,,SING,CG,HGC2,no,N,13,,180556,3404,NLG
14,,DOUB,CD,OE1,no,N,14,,180556,3404,NLG
15,,SING,CD,OE2,no,N,15,,180556,3404,NLG
16,,SING,OE2,HE2,no,N,16,,180556,3404,NLG
17,,SING,C7,C8,no,N,17,,180556,3404,NLG
18,,DOUB,C7,O7,no,N,18,,180556,3404,NLG
19,,SING,C7,N2,no,N,19,,180556,3404,NLG
20,,SING,C8,H8C1,no,N,20,,180556,3404,NLG
21,,SING,C8,H8C2,no,N,21,,180556,3404,NLG
22,,SING,C8,H8C3,no,N,22,,180556,3404,NLG
23,,SING,N2,H2,no,N,23,,180556,3404,NLG
1,,SING,N,HN1,no,N,1,,180557,3404,NH2
2,,SING,N,HN2,no,N,2,,180557,3404,NH2
1,,SING,N,CA,no,N,1,,180587,34041,TPO
2,,SING,N,H,no,N,2,,180587,34041,TPO
3,,SING,N,H2,no,N,3,,180587,34041,TPO
4,,SING,CA,CB,no,N,4,,180587,34041,TPO
5,,SING,CA,C,no,N,5,,180587,34041,TPO
6,,SING,CA,HA,no,N,6,,180587,34041,TPO
7,,SING,CB,CG2,no,N,7,,180587,34041,TPO
8,,SING,CB,OG1,no,N,8,,180587,34041,TPO
9,,SING,CB,HB,no,N,9,,180587,34041,TPO
10,,SING,CG2,HG21,no,N,10,,180587,34041,TPO
11,,SING,CG2,HG22,no,N,11,,180587,34041,TPO
12,,SING,CG2,HG23,no,N,12,,180587,34041,TPO
13,,SING,OG1,P,no,N,13,,180587,34041,TPO
14,,DOUB,P,O1P,no,N,14,,180587,34041,TPO
15,,SING,P,O2P,no,N,15,,180587,34041,TPO
16,,SING,P,O3P,no,N,16,,180587,34041,TPO
17,,SING,O2P,HOP2,no,N,17,,180587,34041,TPO
18,,SING,O3P,HOP3,no,N,18,,180587,34041,TPO
19,,DOUB,C,O,no,N,19,,180587,34041,TPO
20,,SING,C,OXT,no,N,20,,180587,34041,TPO
21,,SING,OXT,HXT,no,N,21,,180587,34041,TPO
1,,SING,N,CN,no,N,1,,180639,34044,FME
2,,SING,N,CA,no,N,2,,180639,34044,FME
3,,SING,N,H,no,N,3,,180639,34044,FME
4,,DOUB,CN,O1,no,N,4,,180639,34044,FME
5,,SING,CN,HCN,no,N,5,,180639,34044,FME
6,,SING,CA,CB,no,N,6,,180639,34044,FME
7,,SING,CA,C,no,N,7,,180639,34044,FME
8,,SING,CA,HA,no,N,8,,180639,34044,FME
9,,SING,CB,CG,no,N,9,,180639,34044,FME
10,,SING,CB,HB2,no,N,10,,180639,34044,FME
11,,SING,CB,HB3,no,N,11,,180639,34044,FME
12,,SING,CG,SD,no,N,12,,180639,34044,FME
13,,SING,CG,HG2,no,N,13,,180639,34044,FME
14,,SING,CG,HG3,no,N,14,,180639,34044,FME
15,,SING,SD,CE,no,N,15,,180639,34044,FME
16,,SING,CE,HE1,no,N,16,,180639,34044,FME
17,,SING,CE,HE2,no,N,17,,180639,34044,FME
18,,SING,CE,HE3,no,N,18,,180639,34044,FME
19,,DOUB,C,O,no,N,19,,180639,34044,FME
20,,SING,C,OXT,no,N,20,,180639,34044,FME
21,,SING,OXT,HXT,no,N,21,,180639,34044,FME
1,,SING,OP3,P,no,N,1,,180872,34056,DI
2,,SING,OP3,HOP3,no,N,2,,180872,34056,DI
3,,DOUB,P,OP1,no,N,3,,180872,34056,DI
4,,SING,P,OP2,no,N,4,,180872,34056,DI
5,,SING,P,O5',no,N,5,,180872,34056,DI
6,,SING,OP2,HOP2,no,N,6,,180872,34056,DI
7,,SING,O5',C5',no,N,7,,180872,34056,DI
8,,SING,C5',C4',no,N,8,,180872,34056,DI
9,,SING,C5',H5',no,N,9,,180872,34056,DI
10,,SING,C5',H5'',no,N,10,,180872,34056,DI
11,,SING,C4',O4',no,N,11,,180872,34056,DI
12,,SING,C4',C3',no,N,12,,180872,34056,DI
13,,SING,C4',H4',no,N,13,,180872,34056,DI
14,,SING,O4',C1',no,N,14,,180872,34056,DI
15,,SING,C3',O3',no,N,15,,180872,34056,DI
16,,SING,C3',C2',no,N,16,,180872,34056,DI
17,,SING,C3',H3',no,N,17,,180872,34056,DI
18,,SING,O3',HO3',no,N,18,,180872,34056,DI
19,,SING,C2',C1',no,N,19,,180872,34056,DI
20,,SING,C2',H2',no,N,20,,180872,34056,DI
21,,SING,C2',H2'',no,N,21,,180872,34056,DI
22,,SING,C1',N9,no,N,22,,180872,34056,DI
23,,SING,C1',H1',no,N,23,,180872,34056,DI
24,,SING,N9,C8,yes,N,24,,180872,34056,DI
25,,SING,N9,C4,yes,N,25,,180872,34056,DI
26,,DOUB,C8,N7,yes,N,26,,180872,34056,DI
27,,SING,C8,H8,no,N,27,,180872,34056,DI
28,,SING,N7,C5,yes,N,28,,180872,34056,DI
29,,SING,C5,C6,no,N,29,,180872,34056,DI
30,,DOUB,C5,C4,yes,N,30,,180872,34056,DI
31,,DOUB,C6,O6,no,N,31,,180872,34056,DI
32,,SING,C6,N1,no,N,32,,180872,34056,DI
33,,SING,N1,C2,no,N,33,,180872,34056,DI
34,,SING,N1,H1,no,N,34,,180872,34056,DI
35,,DOUB,C2,N3,no,N,35,,180872,34056,DI
36,,SING,C2,H2,no,N,36,,180872,34056,DI
37,,SING,N3,C4,no,N,37,,180872,34056,DI
1,,SING,N,CA,no,N,1,,180919,34058,SEP
2,,SING,N,H,no,N,2,,180919,34058,SEP
3,,SING,N,H2,no,N,3,,180919,34058,SEP
4,,SING,CA,CB,no,N,4,,180919,34058,SEP
5,,SING,CA,C,no,N,5,,180919,34058,SEP
6,,SING,CA,HA,no,N,6,,180919,34058,SEP
7,,SING,CB,OG,no,N,7,,180919,34058,SEP
8,,SING,CB,HB2,no,N,8,,180919,34058,SEP
9,,SING,CB,HB3,no,N,9,,180919,34058,SEP
10,,SING,OG,P,no,N,10,,180919,34058,SEP
11,,DOUB,C,O,no,N,11,,180919,34058,SEP
12,,SING,C,OXT,no,N,12,,180919,34058,SEP
13,,SING,OXT,HXT,no,N,13,,180919,34058,SEP
14,,DOUB,P,O1P,no,N,14,,180919,34058,SEP
15,,SING,P,O2P,no,N,15,,180919,34058,SEP
16,,SING,P,O3P,no,N,16,,180919,34058,SEP
17,,SING,O2P,HOP2,no,N,17,,180919,34058,SEP
18,,SING,O3P,HOP3,no,N,18,,180919,34058,SEP
1,,SING,N,CA,no,N,1,,180957,34060,DCL
2,,SING,N,HN1,no,N,2,,180957,34060,DCL
3,,SING,N,HN2,no,N,3,,180957,34060,DCL
4,,SING,CA,C,no,N,4,,180957,34060,DCL
5,,SING,CA,CB,no,N,5,,180957,34060,DCL
6,,SING,CA,HA,no,N,6,,180957,34060,DCL
7,,SING,C,OXT,no,N,7,,180957,34060,DCL
8,,SING,C,HC1,no,N,8,,180957,34060,DCL
9,,SING,C,HC2,no,N,9,,180957,34060,DCL
10,,SING,CB,CG,no,N,10,,180957,34060,DCL
11,,SING,CB,HB1,no,N,11,,180957,34060,DCL
12,,SING,CB,HB2,no,N,12,,180957,34060,DCL
13,,SING,CG,CD1,no,N,13,,180957,34060,DCL
14,,SING,CG,CD2,no,N,14,,180957,34060,DCL
15,,SING,CG,HG,no,N,15,,180957,34060,DCL
16,,SING,CD1,HD11,no,N,16,,180957,34060,DCL
17,,SING,CD1,HD12,no,N,17,,180957,34060,DCL
18,,SING,CD1,HD13,no,N,18,,180957,34060,DCL
19,,SING,CD2,HD21,no,N,19,,180957,34060,DCL
20,,SING,CD2,HD22,no,N,20,,180957,34060,DCL
21,,SING,CD2,HD23,no,N,21,,180957,34060,DCL
22,,SING,OXT,HXT,no,N,22,,180957,34060,DCL
1,,DOUB,C,O,no,N,1,,180958,34060,ACE
2,,SING,C,CH3,no,N,2,,180958,34060,ACE
3,,SING,C,H,no,N,3,,180958,34060,ACE
4,,SING,CH3,H1,no,N,4,,180958,34060,ACE
5,,SING,CH3,H2,no,N,5,,180958,34060,ACE
6,,SING,CH3,H3,no,N,6,,180958,34060,ACE
1,,SING,N,CA,no,N,1,,180959,34060,AIB
2,,SING,N,H,no,N,2,,180959,34060,AIB
3,,SING,N,H2,no,N,3,,180959,34060,AIB
4,,SING,CA,C,no,N,4,,180959,34060,AIB
5,,SING,CA,CB1,no,N,5,,180959,34060,AIB
6,,SING,CA,CB2,no,N,6,,180959,34060,AIB
7,,DOUB,C,O,no,N,7,,180959,34060,AIB
8,,SING,C,OXT,no,N,8,,180959,34060,AIB
9,,SING,OXT,HO2,no,N,9,,180959,34060,AIB
10,,SING,CB1,HB11,no,N,10,,180959,34060,AIB
11,,SING,CB1,HB12,no,N,11,,180959,34060,AIB
12,,SING,CB1,HB13,no,N,12,,180959,34060,AIB
13,,SING,CB2,HB21,no,N,13,,180959,34060,AIB
14,,SING,CB2,HB22,no,N,14,,180959,34060,AIB
15,,SING,CB2,HB23,no,N,15,,180959,34060,AIB
1,,SING,P,O5',no,N,1,,181005,34062,GF2
2,,SING,N1,C2,no,N,2,,181005,34062,GF2
3,,DOUB,C2,N3,no,N,3,,181005,34062,GF2
4,,SING,C2,N2,no,N,4,,181005,34062,GF2
5,,SING,C4,N3,no,N,5,,181005,34062,GF2
6,,DOUB,C5,C4,yes,N,6,,181005,34062,GF2
7,,SING,C6,N1,no,N,7,,181005,34062,GF2
8,,SING,C6,C5,no,N,8,,181005,34062,GF2
9,,DOUB,O6,C6,no,N,9,,181005,34062,GF2
10,,SING,N7,C5,yes,N,10,,181005,34062,GF2
11,,DOUB,N7,C8,yes,N,11,,181005,34062,GF2
12,,SING,C8,N9,yes,N,12,,181005,34062,GF2
13,,SING,N9,C4,yes,N,13,,181005,34062,GF2
14,,SING,N9,C1',no,N,14,,181005,34062,GF2
15,,SING,C1',O4',no,N,15,,181005,34062,GF2
16,,SING,OP2,P,no,N,16,,181005,34062,GF2
17,,SING,C2',F,no,N,17,,181005,34062,GF2
18,,SING,C2',C1',no,N,18,,181005,34062,GF2
19,,DOUB,OP1,P,no,N,19,,181005,34062,GF2
20,,SING,C3',C2',no,N,20,,181005,34062,GF2
21,,SING,C3',C4',no,N,21,,181005,34062,GF2
22,,SING,O3',C3',no,N,22,,181005,34062,GF2
23,,SING,C4',O4',no,N,23,,181005,34062,GF2
24,,SING,C5',C4',no,N,24,,181005,34062,GF2
25,,SING,O5',C5',no,N,25,,181005,34062,GF2
26,,SING,P,OP3,no,N,26,,181005,34062,GF2
27,,SING,N1,HN1,no,N,27,,181005,34062,GF2
28,,SING,N2,HN2,no,N,28,,181005,34062,GF2
29,,SING,N2,HN2A,no,N,29,,181005,34062,GF2
30,,SING,C8,H8,no,N,30,,181005,34062,GF2
31,,SING,C1',H1',no,N,31,,181005,34062,GF2
32,,SING,OP2,HOP2,no,N,32,,181005,34062,GF2
33,,SING,C2',H2',no,N,33,,181005,34062,GF2
34,,SING,C3',H3',no,N,34,,181005,34062,GF2
35,,SING,O3',HO3',no,N,35,,181005,34062,GF2
36,,SING,C4',H4',no,N,36,,181005,34062,GF2
37,,SING,C5',H5',no,N,37,,181005,34062,GF2
38,,SING,C5',H5'A,no,N,38,,181005,34062,GF2
39,,SING,OP3,HOP3,no,N,39,,181005,34062,GF2
1,,DOUB,O6,C6,no,N,1,,181024,34063,GF0
2,,SING,C6,C5,no,N,2,,181024,34063,GF0
3,,SING,C6,N1,no,N,3,,181024,34063,GF0
4,,SING,N7,C5,yes,N,4,,181024,34063,GF0
5,,DOUB,N7,C8,yes,N,5,,181024,34063,GF0
6,,DOUB,C5,C4,yes,N,6,,181024,34063,GF0
7,,SING,N1,C2,no,N,7,,181024,34063,GF0
8,,SING,C8,N9,yes,N,8,,181024,34063,GF0
9,,SING,C4,N9,yes,N,9,,181024,34063,GF0
10,,SING,C4,N3,no,N,10,,181024,34063,GF0
11,,DOUB,C2,N3,no,N,11,,181024,34063,GF0
12,,SING,C2,N2,no,N,12,,181024,34063,GF0
13,,SING,N9,C1',no,N,13,,181024,34063,GF0
14,,SING,C5',O5',no,N,14,,181024,34063,GF0
15,,SING,C5',C4',no,N,15,,181024,34063,GF0
16,,SING,C3',C4',no,N,16,,181024,34063,GF0
17,,SING,C3',C2',no,N,17,,181024,34063,GF0
18,,SING,C3',O3',no,N,18,,181024,34063,GF0
19,,SING,O4',C1',no,N,19,,181024,34063,GF0
20,,SING,O4',C4',no,N,20,,181024,34063,GF0
21,,SING,C1',C2',no,N,21,,181024,34063,GF0
22,,SING,C2',F,no,N,22,,181024,34063,GF0
23,,SING,N1,HN1,no,N,23,,181024,34063,GF0
24,,SING,N2,HN2,no,N,24,,181024,34063,GF0
25,,SING,N2,HN2A,no,N,25,,181024,34063,GF0
26,,SING,C8,H8,no,N,26,,181024,34063,GF0
27,,SING,C1',H1',no,N,27,,181024,34063,GF0
28,,SING,C2',H2',no,N,28,,181024,34063,GF0
29,,SING,C3',H3',no,N,29,,181024,34063,GF0
30,,SING,O3',H1,no,N,30,,181024,34063,GF0
31,,SING,C4',H4',no,N,31,,181024,34063,GF0
32,,SING,C5',H5'A,no,N,32,,181024,34063,GF0
33,,SING,C5',H5',no,N,33,,181024,34063,GF0
34,,SING,O5',H5T,no,N,34,,181024,34063,GF0
1,,SING,P,O5',no,N,1,,181025,34063,GF2
2,,SING,N1,C2,no,N,2,,181025,34063,GF2
3,,DOUB,C2,N3,no,N,3,,181025,34063,GF2
4,,SING,C2,N2,no,N,4,,181025,34063,GF2
5,,SING,C4,N3,no,N,5,,181025,34063,GF2
6,,DOUB,C5,C4,yes,N,6,,181025,34063,GF2
7,,SING,C6,N1,no,N,7,,181025,34063,GF2
8,,SING,C6,C5,no,N,8,,181025,34063,GF2
9,,DOUB,O6,C6,no,N,9,,181025,34063,GF2
10,,SING,N7,C5,yes,N,10,,181025,34063,GF2
11,,DOUB,N7,C8,yes,N,11,,181025,34063,GF2
12,,SING,C8,N9,yes,N,12,,181025,34063,GF2
13,,SING,N9,C4,yes,N,13,,181025,34063,GF2
14,,SING,N9,C1',no,N,14,,181025,34063,GF2
15,,SING,C1',O4',no,N,15,,181025,34063,GF2
16,,SING,OP2,P,no,N,16,,181025,34063,GF2
17,,SING,C2',F,no,N,17,,181025,34063,GF2
18,,SING,C2',C1',no,N,18,,181025,34063,GF2
19,,DOUB,OP1,P,no,N,19,,181025,34063,GF2
20,,SING,C3',C2',no,N,20,,181025,34063,GF2
21,,SING,C3',C4',no,N,21,,181025,34063,GF2
22,,SING,O3',C3',no,N,22,,181025,34063,GF2
23,,SING,C4',O4',no,N,23,,181025,34063,GF2
24,,SING,C5',C4',no,N,24,,181025,34063,GF2
25,,SING,O5',C5',no,N,25,,181025,34063,GF2
26,,SING,P,OP3,no,N,26,,181025,34063,GF2
27,,SING,N1,HN1,no,N,27,,181025,34063,GF2
28,,SING,N2,HN2,no,N,28,,181025,34063,GF2
29,,SING,N2,HN2A,no,N,29,,181025,34063,GF2
30,,SING,C8,H8,no,N,30,,181025,34063,GF2
31,,SING,C1',H1',no,N,31,,181025,34063,GF2
32,,SING,OP2,HOP2,no,N,32,,181025,34063,GF2
33,,SING,C2',H2',no,N,33,,181025,34063,GF2
34,,SING,C3',H3',no,N,34,,181025,34063,GF2
35,,SING,O3',HO3',no,N,35,,181025,34063,GF2
36,,SING,C4',H4',no,N,36,,181025,34063,GF2
37,,SING,C5',H5',no,N,37,,181025,34063,GF2
38,,SING,C5',H5'A,no,N,38,,181025,34063,GF2
39,,SING,OP3,HOP3,no,N,39,,181025,34063,GF2
1,,SING,FE,NA,no,N,1,,181044,34064,HEC
2,,SING,FE,NB,no,N,2,,181044,34064,HEC
3,,SING,FE,NC,no,N,3,,181044,34064,HEC
4,,SING,FE,ND,no,N,4,,181044,34064,HEC
5,,DOUB,CHA,C1A,no,N,5,,181044,34064,HEC
6,,SING,CHA,C4D,no,N,6,,181044,34064,HEC
7,,SING,CHA,HHA,no,N,7,,181044,34064,HEC
8,,DOUB,CHB,C4A,no,N,8,,181044,34064,HEC
9,,SING,CHB,C1B,no,N,9,,181044,34064,HEC
10,,SING,CHB,HHB,no,N,10,,181044,34064,HEC
11,,DOUB,CHC,C4B,no,N,11,,181044,34064,HEC
12,,SING,CHC,C1C,no,N,12,,181044,34064,HEC
13,,SING,CHC,HHC,no,N,13,,181044,34064,HEC
14,,DOUB,CHD,C4C,no,N,14,,181044,34064,HEC
15,,SING,CHD,C1D,no,N,15,,181044,34064,HEC
16,,SING,CHD,HHD,no,N,16,,181044,34064,HEC
17,,SING,NA,C1A,yes,N,17,,181044,34064,HEC
18,,SING,NA,C4A,yes,N,18,,181044,34064,HEC
19,,SING,C1A,C2A,yes,N,19,,181044,34064,HEC
20,,DOUB,C2A,C3A,yes,N,20,,181044,34064,HEC
21,,SING,C2A,CAA,no,N,21,,181044,34064,HEC
22,,SING,C3A,C4A,yes,N,22,,181044,34064,HEC
23,,SING,C3A,CMA,no,N,23,,181044,34064,HEC
24,,SING,CMA,HMA1,no,N,24,,181044,34064,HEC
25,,SING,CMA,HMA2,no,N,25,,181044,34064,HEC
26,,SING,CMA,HMA3,no,N,26,,181044,34064,HEC
27,,SING,CAA,CBA,no,N,27,,181044,34064,HEC
28,,SING,CAA,HAA1,no,N,28,,181044,34064,HEC
29,,SING,CAA,HAA2,no,N,29,,181044,34064,HEC
30,,SING,CBA,CGA,no,N,30,,181044,34064,HEC
31,,SING,CBA,HBA1,no,N,31,,181044,34064,HEC
32,,SING,CBA,HBA2,no,N,32,,181044,34064,HEC
33,,DOUB,CGA,O1A,no,N,33,,181044,34064,HEC
34,,SING,CGA,O2A,no,N,34,,181044,34064,HEC
35,,SING,O2A,H2A,no,N,35,,181044,34064,HEC
36,,SING,NB,C1B,yes,N,36,,181044,34064,HEC
37,,SING,NB,C4B,yes,N,37,,181044,34064,HEC
38,,DOUB,C1B,C2B,yes,N,38,,181044,34064,HEC
39,,SING,C2B,C3B,yes,N,39,,181044,34064,HEC
40,,SING,C2B,CMB,no,N,40,,181044,34064,HEC
41,,SING,C3B,C4B,yes,N,41,,181044,34064,HEC
42,,DOUB,C3B,CAB,no,E,42,,181044,34064,HEC
43,,SING,CMB,HMB1,no,N,43,,181044,34064,HEC
44,,SING,CMB,HMB2,no,N,44,,181044,34064,HEC
45,,SING,CMB,HMB3,no,N,45,,181044,34064,HEC
46,,SING,CAB,CBB,no,N,46,,181044,34064,HEC
47,,SING,CAB,HAB,no,N,47,,181044,34064,HEC
48,,SING,CBB,HBB1,no,N,48,,181044,34064,HEC
49,,SING,CBB,HBB2,no,N,49,,181044,34064,HEC
50,,SING,CBB,HBB3,no,N,50,,181044,34064,HEC
51,,SING,NC,C1C,yes,N,51,,181044,34064,HEC
52,,SING,NC,C4C,yes,N,52,,181044,34064,HEC
53,,DOUB,C1C,C2C,yes,N,53,,181044,34064,HEC
54,,SING,C2C,C3C,yes,N,54,,181044,34064,HEC
55,,SING,C2C,CMC,no,N,55,,181044,34064,HEC
56,,SING,C3C,C4C,yes,N,56,,181044,34064,HEC
57,,DOUB,C3C,CAC,no,E,57,,181044,34064,HEC
58,,SING,CMC,HMC1,no,N,58,,181044,34064,HEC
59,,SING,CMC,HMC2,no,N,59,,181044,34064,HEC
60,,SING,CMC,HMC3,no,N,60,,181044,34064,HEC
61,,SING,CAC,CBC,no,N,61,,181044,34064,HEC
62,,SING,CAC,HAC,no,N,62,,181044,34064,HEC
63,,SING,CBC,HBC1,no,N,63,,181044,34064,HEC
64,,SING,CBC,HBC2,no,N,64,,181044,34064,HEC
65,,SING,CBC,HBC3,no,N,65,,181044,34064,HEC
66,,SING,ND,C1D,yes,N,66,,181044,34064,HEC
67,,SING,ND,C4D,yes,N,67,,181044,34064,HEC
68,,DOUB,C1D,C2D,yes,N,68,,181044,34064,HEC
69,,SING,C2D,C3D,yes,N,69,,181044,34064,HEC
70,,SING,C2D,CMD,no,N,70,,181044,34064,HEC
71,,DOUB,C3D,C4D,yes,N,71,,181044,34064,HEC
72,,SING,C3D,CAD,no,N,72,,181044,34064,HEC
73,,SING,CMD,HMD1,no,N,73,,181044,34064,HEC
74,,SING,CMD,HMD2,no,N,74,,181044,34064,HEC
75,,SING,CMD,HMD3,no,N,75,,181044,34064,HEC
76,,SING,CAD,CBD,no,N,76,,181044,34064,HEC
77,,SING,CAD,HAD1,no,N,77,,181044,34064,HEC
78,,SING,CAD,HAD2,no,N,78,,181044,34064,HEC
79,,SING,CBD,CGD,no,N,79,,181044,34064,HEC
80,,SING,CBD,HBD1,no,N,80,,181044,34064,HEC
81,,SING,CBD,HBD2,no,N,81,,181044,34064,HEC
82,,DOUB,CGD,O1D,no,N,82,,181044,34064,HEC
83,,SING,CGD,O2D,no,N,83,,181044,34064,HEC
84,,SING,O2D,H2D,no,N,84,,181044,34064,HEC
1,,DOUB,C,O,no,N,1,,181067,34065,ACE
2,,SING,C,CH3,no,N,2,,181067,34065,ACE
3,,SING,C,H,no,N,3,,181067,34065,ACE
4,,SING,CH3,H1,no,N,4,,181067,34065,ACE
5,,SING,CH3,H2,no,N,5,,181067,34065,ACE
6,,SING,CH3,H3,no,N,6,,181067,34065,ACE
1,,SING,N,CA,no,N,1,,181068,34065,AIB
2,,SING,N,H,no,N,2,,181068,34065,AIB
3,,SING,N,H2,no,N,3,,181068,34065,AIB
4,,SING,CA,C,no,N,4,,181068,34065,AIB
5,,SING,CA,CB1,no,N,5,,181068,34065,AIB
6,,SING,CA,CB2,no,N,6,,181068,34065,AIB
7,,DOUB,C,O,no,N,7,,181068,34065,AIB
8,,SING,C,OXT,no,N,8,,181068,34065,AIB
9,,SING,OXT,HO2,no,N,9,,181068,34065,AIB
10,,SING,CB1,HB11,no,N,10,,181068,34065,AIB
11,,SING,CB1,HB12,no,N,11,,181068,34065,AIB
12,,SING,CB1,HB13,no,N,12,,181068,34065,AIB
13,,SING,CB2,HB21,no,N,13,,181068,34065,AIB
14,,SING,CB2,HB22,no,N,14,,181068,34065,AIB
15,,SING,CB2,HB23,no,N,15,,181068,34065,AIB
1,,SING,N,CA,no,N,1,,181069,34065,DCL
2,,SING,N,HN1,no,N,2,,181069,34065,DCL
3,,SING,N,HN2,no,N,3,,181069,34065,DCL
4,,SING,CA,C,no,N,4,,181069,34065,DCL
5,,SING,CA,CB,no,N,5,,181069,34065,DCL
6,,SING,CA,HA,no,N,6,,181069,34065,DCL
7,,SING,C,OXT,no,N,7,,181069,34065,DCL
8,,SING,C,HC1,no,N,8,,181069,34065,DCL
9,,SING,C,HC2,no,N,9,,181069,34065,DCL
10,,SING,CB,CG,no,N,10,,181069,34065,DCL
11,,SING,CB,HB1,no,N,11,,181069,34065,DCL
12,,SING,CB,HB2,no,N,12,,181069,34065,DCL
13,,SING,CG,CD1,no,N,13,,181069,34065,DCL
14,,SING,CG,CD2,no,N,14,,181069,34065,DCL
15,,SING,CG,HG,no,N,15,,181069,34065,DCL
16,,SING,CD1,HD11,no,N,16,,181069,34065,DCL
17,,SING,CD1,HD12,no,N,17,,181069,34065,DCL
18,,SING,CD1,HD13,no,N,18,,181069,34065,DCL
19,,SING,CD2,HD21,no,N,19,,181069,34065,DCL
20,,SING,CD2,HD22,no,N,20,,181069,34065,DCL
21,,SING,CD2,HD23,no,N,21,,181069,34065,DCL
22,,SING,OXT,HXT,no,N,22,,181069,34065,DCL
1,,DOUB,C,O,no,N,1,,181087,34066,ACE
2,,SING,C,CH3,no,N,2,,181087,34066,ACE
3,,SING,C,H,no,N,3,,181087,34066,ACE
4,,SING,CH3,H1,no,N,4,,181087,34066,ACE
5,,SING,CH3,H2,no,N,5,,181087,34066,ACE
6,,SING,CH3,H3,no,N,6,,181087,34066,ACE
1,,SING,N,CA,no,N,1,,181088,34066,AIB
2,,SING,N,H,no,N,2,,181088,34066,AIB
3,,SING,N,H2,no,N,3,,181088,34066,AIB
4,,SING,CA,C,no,N,4,,181088,34066,AIB
5,,SING,CA,CB1,no,N,5,,181088,34066,AIB
6,,SING,CA,CB2,no,N,6,,181088,34066,AIB
7,,DOUB,C,O,no,N,7,,181088,34066,AIB
8,,SING,C,OXT,no,N,8,,181088,34066,AIB
9,,SING,OXT,HO2,no,N,9,,181088,34066,AIB
10,,SING,CB1,HB11,no,N,10,,181088,34066,AIB
11,,SING,CB1,HB12,no,N,11,,181088,34066,AIB
12,,SING,CB1,HB13,no,N,12,,181088,34066,AIB
13,,SING,CB2,HB21,no,N,13,,181088,34066,AIB
14,,SING,CB2,HB22,no,N,14,,181088,34066,AIB
15,,SING,CB2,HB23,no,N,15,,181088,34066,AIB
1,,SING,N,CA,no,N,1,,181089,34066,DCL
2,,SING,N,HN1,no,N,2,,181089,34066,DCL
3,,SING,N,HN2,no,N,3,,181089,34066,DCL
4,,SING,CA,C,no,N,4,,181089,34066,DCL
5,,SING,CA,CB,no,N,5,,181089,34066,DCL
6,,SING,CA,HA,no,N,6,,181089,34066,DCL
7,,SING,C,OXT,no,N,7,,181089,34066,DCL
8,,SING,C,HC1,no,N,8,,181089,34066,DCL
9,,SING,C,HC2,no,N,9,,181089,34066,DCL
10,,SING,CB,CG,no,N,10,,181089,34066,DCL
11,,SING,CB,HB1,no,N,11,,181089,34066,DCL
12,,SING,CB,HB2,no,N,12,,181089,34066,DCL
13,,SING,CG,CD1,no,N,13,,181089,34066,DCL
14,,SING,CG,CD2,no,N,14,,181089,34066,DCL
15,,SING,CG,HG,no,N,15,,181089,34066,DCL
16,,SING,CD1,HD11,no,N,16,,181089,34066,DCL
17,,SING,CD1,HD12,no,N,17,,181089,34066,DCL
18,,SING,CD1,HD13,no,N,18,,181089,34066,DCL
19,,SING,CD2,HD21,no,N,19,,181089,34066,DCL
20,,SING,CD2,HD22,no,N,20,,181089,34066,DCL
21,,SING,CD2,HD23,no,N,21,,181089,34066,DCL
22,,SING,OXT,HXT,no,N,22,,181089,34066,DCL
1,,SING,N,CA,no,N,1,,181144,34069,TYC
2,,SING,N,H0,no,N,2,,181144,34069,TYC
3,,SING,N,H,no,N,3,,181144,34069,TYC
4,,SING,CA,C,no,N,4,,181144,34069,TYC
5,,SING,CA,CB,no,N,5,,181144,34069,TYC
6,,SING,CA,HA,no,N,6,,181144,34069,TYC
7,,DOUB,C,O,no,N,7,,181144,34069,TYC
8,,SING,C,NXT,no,N,8,,181144,34069,TYC
9,,SING,CB,CG,no,N,9,,181144,34069,TYC
10,,SING,CB,HB1,no,N,10,,181144,34069,TYC
11,,SING,CB,HB2,no,N,11,,181144,34069,TYC
12,,DOUB,CG,CD1,yes,N,12,,181144,34069,TYC
13,,SING,CG,CD2,yes,N,13,,181144,34069,TYC
14,,SING,CD1,CE1,yes,N,14,,181144,34069,TYC
15,,SING,CD1,HD1,no,N,15,,181144,34069,TYC
16,,DOUB,CD2,CE2,yes,N,16,,181144,34069,TYC
17,,SING,CD2,HD2,no,N,17,,181144,34069,TYC
18,,DOUB,CE1,CZ,yes,N,18,,181144,34069,TYC
19,,SING,CE1,HE1,no,N,19,,181144,34069,TYC
20,,SING,CE2,CZ,yes,N,20,,181144,34069,TYC
21,,SING,CE2,HE2,no,N,21,,181144,34069,TYC
22,,SING,OH,CZ,no,N,22,,181144,34069,TYC
23,,SING,OH,HH,no,N,23,,181144,34069,TYC
24,,SING,NXT,HT21,no,N,24,,181144,34069,TYC
25,,SING,NXT,HT22,no,N,25,,181144,34069,TYC
1,,SING,P,OP1,no,N,1,,181182,34071,TAF
2,,SING,P,OP2,no,N,2,,181182,34071,TAF
3,,DOUB,P,OP3,no,N,3,,181182,34071,TAF
4,,SING,P,O5',no,N,4,,181182,34071,TAF
5,,SING,OP1,HOP1,no,N,5,,181182,34071,TAF
6,,SING,OP2,HOP2,no,N,6,,181182,34071,TAF
7,,SING,O5',C5',no,N,7,,181182,34071,TAF
8,,SING,N1,C6,no,N,8,,181182,34071,TAF
9,,SING,N1,C2,no,N,9,,181182,34071,TAF
10,,SING,N1,C1',no,N,10,,181182,34071,TAF
11,,DOUB,C6,C5,no,N,11,,181182,34071,TAF
12,,SING,C6,H6,no,N,12,,181182,34071,TAF
13,,DOUB,C2,O2,no,N,13,,181182,34071,TAF
14,,SING,C2,N3,no,N,14,,181182,34071,TAF
15,,SING,N3,C4,no,N,15,,181182,34071,TAF
16,,SING,N3,H3,no,N,16,,181182,34071,TAF
17,,DOUB,C4,O4,no,N,17,,181182,34071,TAF
18,,SING,C4,C5,no,N,18,,181182,34071,TAF
19,,SING,C5,C5M,no,N,19,,181182,34071,TAF
20,,SING,C5M,H71,no,N,20,,181182,34071,TAF
21,,SING,C5M,H72,no,N,21,,181182,34071,TAF
22,,SING,C5M,H73,no,N,22,,181182,34071,TAF
23,,SING,F2',C2',no,N,23,,181182,34071,TAF
24,,SING,C2',C1',no,N,24,,181182,34071,TAF
25,,SING,C2',C3',no,N,25,,181182,34071,TAF
26,,SING,C2',H2',no,N,26,,181182,34071,TAF
27,,SING,C5',C4',no,N,27,,181182,34071,TAF
28,,SING,C5',H5',no,N,28,,181182,34071,TAF
29,,SING,C5',H5'',no,N,29,,181182,34071,TAF
30,,SING,C4',O4',no,N,30,,181182,34071,TAF
31,,SING,C4',C3',no,N,31,,181182,34071,TAF
32,,SING,C4',H4',no,N,32,,181182,34071,TAF
33,,SING,O4',C1',no,N,33,,181182,34071,TAF
34,,SING,C1',H1',no,N,34,,181182,34071,TAF
35,,SING,C3',O3',no,N,35,,181182,34071,TAF
36,,SING,C3',H3',no,N,36,,181182,34071,TAF
37,,SING,O3',HO'3,no,N,37,,181182,34071,TAF
1,,SING,N,HN1,no,N,1,,181245,34074,NH2
2,,SING,N,HN2,no,N,2,,181245,34074,NH2
1,,SING,N,HN1,no,N,1,,181263,34075,NH2
2,,SING,N,HN2,no,N,2,,181263,34075,NH2
1,,SING,CBG,OAA,no,N,1,,181304,34077,Z90
2,,SING,OAA,HOAA,no,N,2,,181304,34077,Z90
3,,DOUB,CBH,OAB,no,N,3,,181304,34077,Z90
4,,DOUB,OAC,CBG,no,N,4,,181304,34077,Z90
5,,SING,CBH,OAD,no,N,5,,181304,34077,Z90
6,,SING,OAD,HOAD,no,N,6,,181304,34077,Z90
7,,DOUB,CAF,CAE,yes,N,7,,181304,34077,Z90
8,,SING,CAE,CAG,yes,N,8,,181304,34077,Z90
9,,SING,CAE,HAE,no,N,9,,181304,34077,Z90
10,,SING,CAJ,CAF,yes,N,10,,181304,34077,Z90
11,,SING,CAF,HAF,no,N,11,,181304,34077,Z90
12,,DOUB,CAK,CAG,yes,N,12,,181304,34077,Z90
13,,SING,CAG,HAG,no,N,13,,181304,34077,Z90
14,,DOUB,CAI,CAH,yes,N,14,,181304,34077,Z90
15,,SING,CAH,CAL,yes,N,15,,181304,34077,Z90
16,,SING,CAH,HAH,no,N,16,,181304,34077,Z90
17,,SING,CAI,CAM,yes,N,17,,181304,34077,Z90
18,,SING,CAI,HAI,no,N,18,,181304,34077,Z90
19,,DOUB,CAJ,CBI,yes,N,19,,181304,34077,Z90
20,,SING,CAJ,HAJ,no,N,20,,181304,34077,Z90
21,,SING,CBI,CAK,yes,N,21,,181304,34077,Z90
22,,SING,CAK,HAK,no,N,22,,181304,34077,Z90
23,,DOUB,CAL,CBN,yes,N,23,,181304,34077,Z90
24,,SING,CAL,HAL,no,N,24,,181304,34077,Z90
25,,DOUB,CAM,CBO,yes,N,25,,181304,34077,Z90
26,,SING,CAM,HAM,no,N,26,,181304,34077,Z90
27,,DOUB,CAP,CAN,yes,N,27,,181304,34077,Z90
28,,SING,CAN,CBJ,yes,N,28,,181304,34077,Z90
29,,SING,CAN,HAN,no,N,29,,181304,34077,Z90
30,,SING,CAQ,CAO,yes,N,30,,181304,34077,Z90
31,,DOUB,CBJ,CAO,yes,N,31,,181304,34077,Z90
32,,SING,CAO,HAO,no,N,32,,181304,34077,Z90
33,,SING,CAP,CBK,yes,N,33,,181304,34077,Z90
34,,SING,CAP,HAP,no,N,34,,181304,34077,Z90
35,,DOUB,CBK,CAQ,yes,N,35,,181304,34077,Z90
36,,SING,CAQ,HAQ,no,N,36,,181304,34077,Z90
37,,DOUB,CBL,CAR,yes,N,37,,181304,34077,Z90
38,,SING,CAR,CAT,yes,N,38,,181304,34077,Z90
39,,SING,CAR,HAR,no,N,39,,181304,34077,Z90
40,,SING,CBL,CAS,yes,N,40,,181304,34077,Z90
41,,DOUB,CAS,CAU,yes,N,41,,181304,34077,Z90
42,,SING,CAS,HAS,no,N,42,,181304,34077,Z90
43,,DOUB,CAT,CBM,yes,N,43,,181304,34077,Z90
44,,SING,CAT,HAT,no,N,44,,181304,34077,Z90
45,,SING,CAU,CBM,yes,N,45,,181304,34077,Z90
46,,SING,CAU,HAU,no,N,46,,181304,34077,Z90
47,,SING,CAW,CAV,no,N,47,,181304,34077,Z90
48,,SING,CAX,CAV,no,N,48,,181304,34077,Z90
49,,SING,CAV,HAV,no,N,49,,181304,34077,Z90
50,,SING,CAV,HAVA,no,N,50,,181304,34077,Z90
51,,SING,CAW,CBB,no,N,51,,181304,34077,Z90
52,,SING,CAW,HAW,no,N,52,,181304,34077,Z90
53,,SING,CAW,HAWA,no,N,53,,181304,34077,Z90
54,,SING,CAX,CBG,no,N,54,,181304,34077,Z90
55,,SING,CAX,HAX,no,N,55,,181304,34077,Z90
56,,SING,CAX,HAXA,no,N,56,,181304,34077,Z90
57,,SING,CAZ,CAY,no,N,57,,181304,34077,Z90
58,,SING,CAY,CBI,no,N,58,,181304,34077,Z90
59,,SING,CAY,HAY,no,N,59,,181304,34077,Z90
60,,SING,CAY,HAYA,no,N,60,,181304,34077,Z90
61,,SING,CBJ,CAZ,no,N,61,,181304,34077,Z90
62,,SING,CAZ,HAZ,no,N,62,,181304,34077,Z90
63,,SING,CAZ,HAZA,no,N,63,,181304,34077,Z90
64,,SING,CBN,CBA,no,N,64,,181304,34077,Z90
65,,SING,CBA,CBC,no,N,65,,181304,34077,Z90
66,,SING,CBA,HBA,no,N,66,,181304,34077,Z90
67,,SING,CBA,HBAA,no,N,67,,181304,34077,Z90
68,,SING,NBP,CBB,no,N,68,,181304,34077,Z90
69,,SING,CBB,HBB,no,N,69,,181304,34077,Z90
70,,SING,CBB,HBBA,no,N,70,,181304,34077,Z90
71,,SING,CBC,NBP,no,N,71,,181304,34077,Z90
72,,SING,CBC,HBC,no,N,72,,181304,34077,Z90
73,,SING,CBC,HBCA,no,N,73,,181304,34077,Z90
74,,SING,OBF,CBD,no,N,74,,181304,34077,Z90
75,,SING,CBD,CBK,no,N,75,,181304,34077,Z90
76,,SING,CBD,HBD,no,N,76,,181304,34077,Z90
77,,SING,CBD,HBDA,no,N,77,,181304,34077,Z90
78,,SING,NBP,CBE,no,N,78,,181304,34077,Z90
79,,SING,CBE,CBL,no,N,79,,181304,34077,Z90
80,,SING,CBE,HBE,no,N,80,,181304,34077,Z90
81,,SING,CBE,HBEA,no,N,81,,181304,34077,Z90
82,,SING,CBO,OBF,no,N,82,,181304,34077,Z90
83,,SING,CBM,CBH,no,N,83,,181304,34077,Z90
84,,SING,CBO,CBN,yes,N,84,,181304,34077,Z90
1,,DOUB,C32,C42,yes,N,1,,181489,34086,AUZ
2,,SING,C32,C22,yes,N,2,,181489,34086,AUZ
3,,SING,C42,C52,yes,N,3,,181489,34086,AUZ
4,,DOUB,C22,C12,yes,N,4,,181489,34086,AUZ
5,,DOUB,C41,C31,yes,N,5,,181489,34086,AUZ
6,,SING,C41,C51,yes,N,6,,181489,34086,AUZ
7,,SING,C52,C51,no,N,7,,181489,34086,AUZ
8,,DOUB,C52,N12,yes,N,8,,181489,34086,AUZ
9,,SING,C12,N12,yes,N,9,,181489,34086,AUZ
10,,SING,C12,C62,no,N,10,,181489,34086,AUZ
11,,SING,C31,C21,yes,N,11,,181489,34086,AUZ
12,,DOUB,C51,N11,yes,N,12,,181489,34086,AUZ
13,,SING,N12,AU1,no,N,13,,181489,34086,AUZ
14,,DOUB,C21,C11,yes,N,14,,181489,34086,AUZ
15,,SING,N11,C11,yes,N,15,,181489,34086,AUZ
16,,SING,N11,AU1,no,N,16,,181489,34086,AUZ
17,,SING,C11,C61,no,N,17,,181489,34086,AUZ
18,,SING,AU1,O2,no,N,18,,181489,34086,AUZ
19,,SING,AU1,O1,no,N,19,,181489,34086,AUZ
20,,SING,O2,AU2,no,N,20,,181489,34086,AUZ
21,,SING,C64,C14,no,N,21,,181489,34086,AUZ
22,,SING,O1,AU2,no,N,22,,181489,34086,AUZ
23,,SING,AU2,N14,no,N,23,,181489,34086,AUZ
24,,SING,AU2,N13,no,N,24,,181489,34086,AUZ
25,,SING,C14,N14,yes,N,25,,181489,34086,AUZ
26,,DOUB,C14,C24,yes,N,26,,181489,34086,AUZ
27,,DOUB,N14,C54,yes,N,27,,181489,34086,AUZ
28,,SING,C24,C34,yes,N,28,,181489,34086,AUZ
29,,SING,C63,C13,no,N,29,,181489,34086,AUZ
30,,SING,N13,C13,yes,N,30,,181489,34086,AUZ
31,,DOUB,N13,C53,yes,N,31,,181489,34086,AUZ
32,,SING,C54,C53,no,N,32,,181489,34086,AUZ
33,,SING,C54,C44,yes,N,33,,181489,34086,AUZ
34,,DOUB,C34,C44,yes,N,34,,181489,34086,AUZ
35,,DOUB,C13,C23,yes,N,35,,181489,34086,AUZ
36,,SING,C53,C43,yes,N,36,,181489,34086,AUZ
37,,SING,C23,C33,yes,N,37,,181489,34086,AUZ
38,,DOUB,C43,C33,yes,N,38,,181489,34086,AUZ
39,,SING,C21,H21,no,N,39,,181489,34086,AUZ
40,,SING,C31,H31,no,N,40,,181489,34086,AUZ
41,,SING,C41,H41,no,N,41,,181489,34086,AUZ
42,,SING,C61,H613,no,N,42,,181489,34086,AUZ
43,,SING,C61,H611,no,N,43,,181489,34086,AUZ
44,,SING,C61,H612,no,N,44,,181489,34086,AUZ
45,,SING,C22,H22,no,N,45,,181489,34086,AUZ
46,,SING,C32,H32,no,N,46,,181489,34086,AUZ
47,,SING,C42,H42,no,N,47,,181489,34086,AUZ
48,,SING,C62,H623,no,N,48,,181489,34086,AUZ
49,,SING,C62,H622,no,N,49,,181489,34086,AUZ
50,,SING,C62,H621,no,N,50,,181489,34086,AUZ
51,,SING,C24,H24,no,N,51,,181489,34086,AUZ
52,,SING,C34,H34,no,N,52,,181489,34086,AUZ
53,,SING,C44,H44,no,N,53,,181489,34086,AUZ
54,,SING,C64,H643,no,N,54,,181489,34086,AUZ
55,,SING,C64,H641,no,N,55,,181489,34086,AUZ
56,,SING,C64,H642,no,N,56,,181489,34086,AUZ
57,,SING,C23,H23,no,N,57,,181489,34086,AUZ
58,,SING,C33,H33,no,N,58,,181489,34086,AUZ
59,,SING,C43,H43,no,N,59,,181489,34086,AUZ
60,,SING,C63,H633,no,N,60,,181489,34086,AUZ
61,,SING,C63,H631,no,N,61,,181489,34086,AUZ
62,,SING,C63,H632,no,N,62,,181489,34086,AUZ
1,,SING,N,HN1,no,N,1,,181594,34090,NH2
2,,SING,N,HN2,no,N,2,,181594,34090,NH2
1,,SING,N,HN1,no,N,1,,181610,34091,NH2
2,,SING,N,HN2,no,N,2,,181610,34091,NH2
1,,SING,N,HN1,no,N,1,,181626,34092,NH2
2,,SING,N,HN2,no,N,2,,181626,34092,NH2
1,,DOUB,O07,C06,no,N,1,,181643,34093,UU3
2,,DOUB,O09,C08,no,N,2,,181643,34093,UU3
3,,SING,C06,C08,no,N,3,,181643,34093,UU3
4,,SING,C06,C04,no,N,4,,181643,34093,UU3
5,,SING,C08,O10,no,N,5,,181643,34093,UU3
6,,SING,O12,C01,no,N,6,,181643,34093,UU3
7,,DOUB,C04,O05,no,N,7,,181643,34093,UU3
8,,SING,C04,C03,no,N,8,,181643,34093,UU3
9,,SING,O10,C03,no,N,9,,181643,34093,UU3
10,,SING,C01,C02,no,N,10,,181643,34093,UU3
11,,SING,C03,C02,no,N,11,,181643,34093,UU3
12,,SING,C02,O11,no,N,12,,181643,34093,UU3
13,,SING,C01,H1,no,N,13,,181643,34093,UU3
14,,SING,C01,H2,no,N,14,,181643,34093,UU3
15,,SING,C02,H3,no,N,15,,181643,34093,UU3
16,,SING,C03,H4,no,N,16,,181643,34093,UU3
17,,SING,O11,H5,no,N,17,,181643,34093,UU3
18,,SING,O12,H6,no,N,18,,181643,34093,UU3
1,,SING,O,H1,no,N,1,,181666,34094,HOH
2,,SING,O,H2,no,N,2,,181666,34094,HOH
1,,DOUB,OD2,CG,no,N,1,,181667,34094,OUD
2,,SING,CM,N2,no,N,2,,181667,34094,OUD
3,,SING,CM,CA,no,N,3,,181667,34094,OUD
4,,SING,N2,C,no,N,4,,181667,34094,OUD
5,,SING,CG,CB,no,N,5,,181667,34094,OUD
6,,SING,CG,OD1,no,N,6,,181667,34094,OUD
7,,SING,CB,CA,no,N,7,,181667,34094,OUD
8,,DOUB,C,O,no,N,8,,181667,34094,OUD
9,,SING,CA,N,no,N,9,,181667,34094,OUD
10,,SING,N,H1,no,N,10,,181667,34094,OUD
11,,SING,N,H2,no,N,11,,181667,34094,OUD
12,,SING,CA,HA,no,N,12,,181667,34094,OUD
13,,SING,CB,HB3,no,N,13,,181667,34094,OUD
14,,SING,CB,HB2,no,N,14,,181667,34094,OUD
15,,SING,OD1,H4,no,N,15,,181667,34094,OUD
16,,SING,CM,HM3,no,N,16,,181667,34094,OUD
17,,SING,CM,HM2,no,N,17,,181667,34094,OUD
18,,SING,N2,HN2,no,N,18,,181667,34094,OUD
19,,SING,C,O1,no,N,19,,181667,34094,OUD
20,,SING,O1,H3,no,N,20,,181667,34094,OUD
1,,DOUB,OE2,CD,no,N,1,,181668,34094,OUE
2,,SING,OE1,CD,no,N,2,,181668,34094,OUE
3,,SING,CD,CG,no,N,3,,181668,34094,OUE
4,,SING,CB,CG,no,N,4,,181668,34094,OUE
5,,SING,CB,CA,no,N,5,,181668,34094,OUE
6,,SING,N,CA,no,N,6,,181668,34094,OUE
7,,SING,CA,CM,no,N,7,,181668,34094,OUE
8,,SING,CM,N2,no,N,8,,181668,34094,OUE
9,,SING,N2,C,no,N,9,,181668,34094,OUE
10,,DOUB,C,O,no,N,10,,181668,34094,OUE
11,,SING,N,H1,no,N,11,,181668,34094,OUE
12,,SING,N,H,no,N,12,,181668,34094,OUE
13,,SING,CA,HA,no,N,13,,181668,34094,OUE
14,,SING,CB,HB3,no,N,14,,181668,34094,OUE
15,,SING,CB,HB2,no,N,15,,181668,34094,OUE
16,,SING,CG,HG3,no,N,16,,181668,34094,OUE
17,,SING,CG,HG2,no,N,17,,181668,34094,OUE
18,,SING,OE1,H4,no,N,18,,181668,34094,OUE
19,,SING,CM,HM2,no,N,19,,181668,34094,OUE
20,,SING,CM,HM3,no,N,20,,181668,34094,OUE
21,,SING,N2,HN2,no,N,21,,181668,34094,OUE
22,,SING,C,O1,no,N,22,,181668,34094,OUE
23,,SING,O1,H2,no,N,23,,181668,34094,OUE
1,,SING,N,CA,no,N,1,,181669,34094,OUH
2,,SING,CA,CB,no,N,2,,181669,34094,OUH
3,,SING,CA,CM,no,N,3,,181669,34094,OUH
4,,SING,CB,CG,no,N,4,,181669,34094,OUH
5,,SING,ND1,CG,yes,N,5,,181669,34094,OUH
6,,SING,ND1,CE1,yes,N,6,,181669,34094,OUH
7,,SING,N2,CM,no,N,7,,181669,34094,OUH
8,,SING,N2,C,no,N,8,,181669,34094,OUH
9,,DOUB,CG,CD2,yes,N,9,,181669,34094,OUH
10,,DOUB,CE1,NE2,yes,N,10,,181669,34094,OUH
11,,DOUB,C,O,no,N,11,,181669,34094,OUH
12,,SING,CD2,NE2,yes,N,12,,181669,34094,OUH
13,,SING,N,H1,no,N,13,,181669,34094,OUH
14,,SING,N,H,no,N,14,,181669,34094,OUH
15,,SING,CA,HA,no,N,15,,181669,34094,OUH
16,,SING,CB,HB2,no,N,16,,181669,34094,OUH
17,,SING,CB,HB3,no,N,17,,181669,34094,OUH
18,,SING,CD2,HD2,no,N,18,,181669,34094,OUH
19,,SING,ND1,HD1,no,N,19,,181669,34094,OUH
20,,SING,CE1,HE1,no,N,20,,181669,34094,OUH
21,,SING,CM,HM2,no,N,21,,181669,34094,OUH
22,,SING,CM,HM3,no,N,22,,181669,34094,OUH
23,,SING,N2,HN2,no,N,23,,181669,34094,OUH
24,,SING,C,O1,no,N,24,,181669,34094,OUH
25,,SING,O1,H2,no,N,25,,181669,34094,OUH
1,,SING,CD1,CG1,no,N,1,,181670,34094,OUI
2,,SING,CG1,CB,no,N,2,,181670,34094,OUI
3,,SING,CG2,CB,no,N,3,,181670,34094,OUI
4,,SING,CB,CA,no,N,4,,181670,34094,OUI
5,,SING,N,CA,no,N,5,,181670,34094,OUI
6,,SING,CA,CM,no,N,6,,181670,34094,OUI
7,,SING,CM,N2,no,N,7,,181670,34094,OUI
8,,SING,N2,C,no,N,8,,181670,34094,OUI
9,,DOUB,C,O,no,N,9,,181670,34094,OUI
10,,SING,N,H1,no,N,10,,181670,34094,OUI
11,,SING,N,H,no,N,11,,181670,34094,OUI
12,,SING,CA,HA,no,N,12,,181670,34094,OUI
13,,SING,CB,HB,no,N,13,,181670,34094,OUI
14,,SING,CG1,3HG1,no,N,14,,181670,34094,OUI
15,,SING,CG1,2HG1,no,N,15,,181670,34094,OUI
16,,SING,CG2,1HG2,no,N,16,,181670,34094,OUI
17,,SING,CG2,2HG2,no,N,17,,181670,34094,OUI
18,,SING,CG2,3HG2,no,N,18,,181670,34094,OUI
19,,SING,CD1,2HD1,no,N,19,,181670,34094,OUI
20,,SING,CD1,3HD1,no,N,20,,181670,34094,OUI
21,,SING,CD1,1HD1,no,N,21,,181670,34094,OUI
22,,SING,CM,HM2,no,N,22,,181670,34094,OUI
23,,SING,CM,HM3,no,N,23,,181670,34094,OUI
24,,SING,N2,HN2,no,N,24,,181670,34094,OUI
25,,SING,C,O1,no,N,25,,181670,34094,OUI
26,,SING,O1,H2,no,N,26,,181670,34094,OUI
1,,SING,N2,C,no,N,1,,181671,34094,OUK
2,,SING,N2,CM,no,N,2,,181671,34094,OUK
3,,DOUB,C,O,no,N,3,,181671,34094,OUK
4,,SING,N,CA,no,N,4,,181671,34094,OUK
5,,SING,CM,CA,no,N,5,,181671,34094,OUK
6,,SING,CA,CB,no,N,6,,181671,34094,OUK
7,,SING,CB,CG,no,N,7,,181671,34094,OUK
8,,SING,CG,CD,no,N,8,,181671,34094,OUK
9,,SING,CD,CE,no,N,9,,181671,34094,OUK
10,,SING,CE,NZ,no,N,10,,181671,34094,OUK
11,,SING,C,O1,no,N,11,,181671,34094,OUK
12,,SING,N,H2,no,N,12,,181671,34094,OUK
13,,SING,N,H1,no,N,13,,181671,34094,OUK
14,,SING,CA,HA,no,N,14,,181671,34094,OUK
15,,SING,CB,HB2,no,N,15,,181671,34094,OUK
16,,SING,CB,HB3,no,N,16,,181671,34094,OUK
17,,SING,CG,HG2,no,N,17,,181671,34094,OUK
18,,SING,CG,HG3,no,N,18,,181671,34094,OUK
19,,SING,CD,HD2,no,N,19,,181671,34094,OUK
20,,SING,CD,HD3,no,N,20,,181671,34094,OUK
21,,SING,CE,HE2,no,N,21,,181671,34094,OUK
22,,SING,CE,HE3,no,N,22,,181671,34094,OUK
23,,SING,NZ,HZ3,no,N,23,,181671,34094,OUK
24,,SING,NZ,HZ1,no,N,24,,181671,34094,OUK
25,,SING,NZ,HZ2,no,N,25,,181671,34094,OUK
26,,SING,CM,HM3,no,N,26,,181671,34094,OUK
27,,SING,CM,HM2,no,N,27,,181671,34094,OUK
28,,SING,N2,HN2,no,N,28,,181671,34094,OUK
29,,SING,O1,H4,no,N,29,,181671,34094,OUK
1,,DOUB,NH2,CZ,no,N,1,,181672,34094,OUR
2,,SING,NH1,CZ,no,N,2,,181672,34094,OUR
3,,SING,CZ,NE,no,N,3,,181672,34094,OUR
4,,SING,NE,CD,no,N,4,,181672,34094,OUR
5,,SING,CD,CG,no,N,5,,181672,34094,OUR
6,,SING,CG,CB,no,N,6,,181672,34094,OUR
7,,SING,CB,CA,no,N,7,,181672,34094,OUR
8,,SING,N,CA,no,N,8,,181672,34094,OUR
9,,SING,CA,CM,no,N,9,,181672,34094,OUR
10,,SING,CM,N2,no,N,10,,181672,34094,OUR
11,,SING,N2,C,no,N,11,,181672,34094,OUR
12,,DOUB,C,O,no,N,12,,181672,34094,OUR
13,,SING,C,O1,no,N,13,,181672,34094,OUR
14,,SING,N,H,no,N,14,,181672,34094,OUR
15,,SING,N,H2,no,N,15,,181672,34094,OUR
16,,SING,CA,HA,no,N,16,,181672,34094,OUR
17,,SING,CB,HB3,no,N,17,,181672,34094,OUR
18,,SING,CB,HB2,no,N,18,,181672,34094,OUR
19,,SING,CG,HG3,no,N,19,,181672,34094,OUR
20,,SING,CG,HG2,no,N,20,,181672,34094,OUR
21,,SING,CD,HD3,no,N,21,,181672,34094,OUR
22,,SING,CD,HD2,no,N,22,,181672,34094,OUR
23,,SING,NE,HE,no,N,23,,181672,34094,OUR
24,,SING,NH1,HH12,no,N,24,,181672,34094,OUR
25,,SING,NH1,HH11,no,N,25,,181672,34094,OUR
26,,SING,NH2,HH22,no,N,26,,181672,34094,OUR
27,,SING,CM,HM2,no,N,27,,181672,34094,OUR
28,,SING,CM,HM3,no,N,28,,181672,34094,OUR
29,,SING,N2,HN2,no,N,29,,181672,34094,OUR
30,,SING,O1,H3,no,N,30,,181672,34094,OUR
31,,SING,NH2,HH21,no,N,31,,181672,34094,OUR
1,,SING,N1,CA1,no,N,1,,181884,34105,GSH
2,,SING,N1,HN11,no,N,2,,181884,34105,GSH
3,,SING,N1,HN12,no,N,3,,181884,34105,GSH
4,,SING,CA1,C1,no,N,4,,181884,34105,GSH
5,,SING,CA1,CB1,no,N,5,,181884,34105,GSH
6,,SING,CA1,HA1,no,N,6,,181884,34105,GSH
7,,DOUB,C1,O11,no,N,7,,181884,34105,GSH
8,,SING,C1,O12,no,N,8,,181884,34105,GSH
9,,SING,O12,H12,no,N,9,,181884,34105,GSH
10,,SING,CB1,CG1,no,N,10,,181884,34105,GSH
11,,SING,CB1,HB12,no,N,11,,181884,34105,GSH
12,,SING,CB1,HB13,no,N,12,,181884,34105,GSH
13,,SING,CG1,CD1,no,N,13,,181884,34105,GSH
14,,SING,CG1,HG12,no,N,14,,181884,34105,GSH
15,,SING,CG1,HG13,no,N,15,,181884,34105,GSH
16,,DOUB,CD1,OE1,no,N,16,,181884,34105,GSH
17,,SING,CD1,N2,no,N,17,,181884,34105,GSH
18,,SING,N2,CA2,no,N,18,,181884,34105,GSH
19,,SING,N2,HN2,no,N,19,,181884,34105,GSH
20,,SING,CA2,C2,no,N,20,,181884,34105,GSH
21,,SING,CA2,CB2,no,N,21,,181884,34105,GSH
22,,SING,CA2,HA2,no,N,22,,181884,34105,GSH
23,,DOUB,C2,O2,no,N,23,,181884,34105,GSH
24,,SING,C2,N3,no,N,24,,181884,34105,GSH
25,,SING,CB2,SG2,no,N,25,,181884,34105,GSH
26,,SING,CB2,HB22,no,N,26,,181884,34105,GSH
27,,SING,CB2,HB23,no,N,27,,181884,34105,GSH
28,,SING,SG2,HSG,no,N,28,,181884,34105,GSH
29,,SING,N3,CA3,no,N,29,,181884,34105,GSH
30,,SING,N3,HN3,no,N,30,,181884,34105,GSH
31,,SING,CA3,C3,no,N,31,,181884,34105,GSH
32,,SING,CA3,HA31,no,N,32,,181884,34105,GSH
33,,SING,CA3,HA32,no,N,33,,181884,34105,GSH
34,,DOUB,C3,O31,no,N,34,,181884,34105,GSH
35,,SING,C3,O32,no,N,35,,181884,34105,GSH
36,,SING,O32,H32,no,N,36,,181884,34105,GSH
1,,DOUB,O2,C2,no,N,1,,182097,34118,8YN
2,,SING,C2,N3,no,N,2,,182097,34118,8YN
3,,SING,C2,C1,no,N,3,,182097,34118,8YN
4,,SING,N3,C4,no,N,4,,182097,34118,8YN
5,,SING,O3',C3',no,N,5,,182097,34118,8YN
6,,SING,C1',C1,no,N,6,,182097,34118,8YN
7,,SING,C1',O4',no,N,7,,182097,34118,8YN
8,,SING,C1',C2',no,N,8,,182097,34118,8YN
9,,DOUB,C1,C6,no,N,9,,182097,34118,8YN
10,,SING,C4,N4,no,N,10,,182097,34118,8YN
11,,DOUB,C4,N5,no,N,11,,182097,34118,8YN
12,,SING,O4',C4',no,N,12,,182097,34118,8YN
13,,SING,C2',C3',no,N,13,,182097,34118,8YN
14,,SING,C3',C4',no,N,14,,182097,34118,8YN
15,,SING,C4',C5',no,N,15,,182097,34118,8YN
16,,SING,C6,N5,no,N,16,,182097,34118,8YN
17,,SING,O1P,P,no,N,17,,182097,34118,8YN
18,,SING,P,O5',no,N,18,,182097,34118,8YN
19,,SING,P,O2P,no,N,19,,182097,34118,8YN
20,,SING,C5',O5',no,N,20,,182097,34118,8YN
21,,SING,C6,H6,no,N,21,,182097,34118,8YN
22,,SING,O1P,H1,no,N,22,,182097,34118,8YN
23,,SING,O2P,H2,no,N,23,,182097,34118,8YN
24,,SING,C5',2H5',no,N,24,,182097,34118,8YN
25,,SING,C5',1H5',no,N,25,,182097,34118,8YN
26,,SING,C4',H4',no,N,26,,182097,34118,8YN
27,,SING,C1',H1',no,N,27,,182097,34118,8YN
28,,SING,N3,H3,no,N,28,,182097,34118,8YN
29,,SING,N4,1H4,no,N,29,,182097,34118,8YN
30,,SING,N4,2H4,no,N,30,,182097,34118,8YN
31,,SING,C2',1H2',no,N,31,,182097,34118,8YN
32,,SING,C2',2H2',no,N,32,,182097,34118,8YN
33,,SING,C3',H3',no,N,33,,182097,34118,8YN
34,,SING,O3',H4,no,N,34,,182097,34118,8YN
1,,SING,N,HN1,no,N,1,,182115,34119,NH2
2,,SING,N,HN2,no,N,2,,182115,34119,NH2
1,,DOUB,O01,C02,no,N,1,,182116,34119,D6M
2,,SING,C02,N03,no,N,2,,182116,34119,D6M
3,,SING,C02,C12,no,N,3,,182116,34119,D6M
4,,SING,N03,C04,no,N,4,,182116,34119,D6M
5,,SING,C04,C05,no,N,5,,182116,34119,D6M
6,,SING,C04,C09,no,N,6,,182116,34119,D6M
7,,SING,C05,C06,no,N,7,,182116,34119,D6M
8,,SING,C06,C07,no,N,8,,182116,34119,D6M
9,,DOUB,C07,O08,no,N,9,,182116,34119,D6M
10,,SING,C07,OXT,no,N,10,,182116,34119,D6M
11,,DOUB,C09,O10,no,N,11,,182116,34119,D6M
12,,SING,C09,O11,no,N,12,,182116,34119,D6M
13,,SING,C12,C13,no,N,13,,182116,34119,D6M
14,,SING,C13,C14,no,N,14,,182116,34119,D6M
15,,SING,C14,C15,no,N,15,,182116,34119,D6M
16,,SING,C15,C16,no,N,16,,182116,34119,D6M
17,,SING,C16,C17,no,N,17,,182116,34119,D6M
18,,SING,C17,C18,no,N,18,,182116,34119,D6M
19,,SING,C18,C19,no,N,19,,182116,34119,D6M
20,,SING,C19,C20,no,N,20,,182116,34119,D6M
21,,SING,C20,C21,no,N,21,,182116,34119,D6M
22,,SING,C21,C22,no,N,22,,182116,34119,D6M
23,,SING,C22,C23,no,N,23,,182116,34119,D6M
24,,SING,C23,C24,no,N,24,,182116,34119,D6M
25,,SING,C24,C25,no,N,25,,182116,34119,D6M
26,,SING,C25,C26,no,N,26,,182116,34119,D6M
27,,SING,N03,H03,no,N,27,,182116,34119,D6M
28,,SING,C12,H121,no,N,28,,182116,34119,D6M
29,,SING,C12,H122,no,N,29,,182116,34119,D6M
30,,SING,C04,H04,no,N,30,,182116,34119,D6M
31,,SING,C05,H051,no,N,31,,182116,34119,D6M
32,,SING,C05,H052,no,N,32,,182116,34119,D6M
33,,SING,C06,H061,no,N,33,,182116,34119,D6M
34,,SING,C06,H062,no,N,34,,182116,34119,D6M
35,,SING,OXT,HX0,no,N,35,,182116,34119,D6M
36,,SING,O11,H11,no,N,36,,182116,34119,D6M
37,,SING,C13,H131,no,N,37,,182116,34119,D6M
38,,SING,C13,H132,no,N,38,,182116,34119,D6M
39,,SING,C14,H141,no,N,39,,182116,34119,D6M
40,,SING,C14,H142,no,N,40,,182116,34119,D6M
41,,SING,C15,H151,no,N,41,,182116,34119,D6M
42,,SING,C15,H152,no,N,42,,182116,34119,D6M
43,,SING,C16,H161,no,N,43,,182116,34119,D6M
44,,SING,C16,H162,no,N,44,,182116,34119,D6M
45,,SING,C17,H171,no,N,45,,182116,34119,D6M
46,,SING,C17,H172,no,N,46,,182116,34119,D6M
47,,SING,C18,H181,no,N,47,,182116,34119,D6M
48,,SING,C18,H182,no,N,48,,182116,34119,D6M
49,,SING,C19,H191,no,N,49,,182116,34119,D6M
50,,SING,C19,H192,no,N,50,,182116,34119,D6M
51,,SING,C20,H201,no,N,51,,182116,34119,D6M
52,,SING,C20,H202,no,N,52,,182116,34119,D6M
53,,SING,C21,H211,no,N,53,,182116,34119,D6M
54,,SING,C21,H212,no,N,54,,182116,34119,D6M
55,,SING,C22,H221,no,N,55,,182116,34119,D6M
56,,SING,C22,H222,no,N,56,,182116,34119,D6M
57,,SING,C23,H231,no,N,57,,182116,34119,D6M
58,,SING,C23,H232,no,N,58,,182116,34119,D6M
59,,SING,C24,H241,no,N,59,,182116,34119,D6M
60,,SING,C24,H242,no,N,60,,182116,34119,D6M
61,,SING,C25,H251,no,N,61,,182116,34119,D6M
62,,SING,C25,H252,no,N,62,,182116,34119,D6M
63,,SING,C26,H261,no,N,63,,182116,34119,D6M
64,,SING,C26,H262,no,N,64,,182116,34119,D6M
65,,SING,C26,H263,no,N,65,,182116,34119,D6M
1,,SING,N,CA,no,N,1,,182117,34119,DSN
2,,SING,N,H,no,N,2,,182117,34119,DSN
3,,SING,N,H2,no,N,3,,182117,34119,DSN
4,,SING,CA,C,no,N,4,,182117,34119,DSN
5,,SING,CA,CB,no,N,5,,182117,34119,DSN
6,,SING,CA,HA,no,N,6,,182117,34119,DSN
7,,DOUB,C,O,no,N,7,,182117,34119,DSN
8,,SING,C,OXT,no,N,8,,182117,34119,DSN
9,,SING,OXT,HXT,no,N,9,,182117,34119,DSN
10,,SING,CB,OG,no,N,10,,182117,34119,DSN
11,,SING,CB,HB2,no,N,11,,182117,34119,DSN
12,,SING,CB,HB3,no,N,12,,182117,34119,DSN
13,,SING,OG,HG,no,N,13,,182117,34119,DSN
1,,SING,O,H1,no,N,1,,182226,34125,HOH
2,,SING,O,H2,no,N,2,,182226,34125,HOH
1,,DOUB,C1,O1,no,N,1,,182308,34130,ACA
2,,SING,C1,O2,no,N,2,,182308,34130,ACA
3,,SING,C1,C2,no,N,3,,182308,34130,ACA
4,,SING,O2,HO2,no,N,4,,182308,34130,ACA
5,,SING,C2,C3,no,N,5,,182308,34130,ACA
6,,SING,C2,H21,no,N,6,,182308,34130,ACA
7,,SING,C2,H22,no,N,7,,182308,34130,ACA
8,,SING,C3,C4,no,N,8,,182308,34130,ACA
9,,SING,C3,H31,no,N,9,,182308,34130,ACA
10,,SING,C3,H32,no,N,10,,182308,34130,ACA
11,,SING,C4,C5,no,N,11,,182308,34130,ACA
12,,SING,C4,H41,no,N,12,,182308,34130,ACA
13,,SING,C4,H42,no,N,13,,182308,34130,ACA
14,,SING,C5,C6,no,N,14,,182308,34130,ACA
15,,SING,C5,H51,no,N,15,,182308,34130,ACA
16,,SING,C5,H52,no,N,16,,182308,34130,ACA
17,,SING,C6,N6,no,N,17,,182308,34130,ACA
18,,SING,C6,H61,no,N,18,,182308,34130,ACA
19,,SING,C6,H62,no,N,19,,182308,34130,ACA
20,,SING,N6,HN61,no,N,20,,182308,34130,ACA
21,,SING,N6,HN62,no,N,21,,182308,34130,ACA
1,,DOUB,C1,O1,no,N,1,,182357,34132,ACA
2,,SING,C1,O2,no,N,2,,182357,34132,ACA
3,,SING,C1,C2,no,N,3,,182357,34132,ACA
4,,SING,O2,HO2,no,N,4,,182357,34132,ACA
5,,SING,C2,C3,no,N,5,,182357,34132,ACA
6,,SING,C2,H21,no,N,6,,182357,34132,ACA
7,,SING,C2,H22,no,N,7,,182357,34132,ACA
8,,SING,C3,C4,no,N,8,,182357,34132,ACA
9,,SING,C3,H31,no,N,9,,182357,34132,ACA
10,,SING,C3,H32,no,N,10,,182357,34132,ACA
11,,SING,C4,C5,no,N,11,,182357,34132,ACA
12,,SING,C4,H41,no,N,12,,182357,34132,ACA
13,,SING,C4,H42,no,N,13,,182357,34132,ACA
14,,SING,C5,C6,no,N,14,,182357,34132,ACA
15,,SING,C5,H51,no,N,15,,182357,34132,ACA
16,,SING,C5,H52,no,N,16,,182357,34132,ACA
17,,SING,C6,N6,no,N,17,,182357,34132,ACA
18,,SING,C6,H61,no,N,18,,182357,34132,ACA
19,,SING,C6,H62,no,N,19,,182357,34132,ACA
20,,SING,N6,HN61,no,N,20,,182357,34132,ACA
21,,SING,N6,HN62,no,N,21,,182357,34132,ACA
1,,DOUB,C1,O1,no,N,1,,182374,34133,ACA
2,,SING,C1,O2,no,N,2,,182374,34133,ACA
3,,SING,C1,C2,no,N,3,,182374,34133,ACA
4,,SING,O2,HO2,no,N,4,,182374,34133,ACA
5,,SING,C2,C3,no,N,5,,182374,34133,ACA
6,,SING,C2,H21,no,N,6,,182374,34133,ACA
7,,SING,C2,H22,no,N,7,,182374,34133,ACA
8,,SING,C3,C4,no,N,8,,182374,34133,ACA
9,,SING,C3,H31,no,N,9,,182374,34133,ACA
10,,SING,C3,H32,no,N,10,,182374,34133,ACA
11,,SING,C4,C5,no,N,11,,182374,34133,ACA
12,,SING,C4,H41,no,N,12,,182374,34133,ACA
13,,SING,C4,H42,no,N,13,,182374,34133,ACA
14,,SING,C5,C6,no,N,14,,182374,34133,ACA
15,,SING,C5,H51,no,N,15,,182374,34133,ACA
16,,SING,C5,H52,no,N,16,,182374,34133,ACA
17,,SING,C6,N6,no,N,17,,182374,34133,ACA
18,,SING,C6,H61,no,N,18,,182374,34133,ACA
19,,SING,C6,H62,no,N,19,,182374,34133,ACA
20,,SING,N6,HN61,no,N,20,,182374,34133,ACA
21,,SING,N6,HN62,no,N,21,,182374,34133,ACA
1,,DOUB,C1,O1,no,N,1,,182391,34134,ACA
2,,SING,C1,O2,no,N,2,,182391,34134,ACA
3,,SING,C1,C2,no,N,3,,182391,34134,ACA
4,,SING,O2,HO2,no,N,4,,182391,34134,ACA
5,,SING,C2,C3,no,N,5,,182391,34134,ACA
6,,SING,C2,H21,no,N,6,,182391,34134,ACA
7,,SING,C2,H22,no,N,7,,182391,34134,ACA
8,,SING,C3,C4,no,N,8,,182391,34134,ACA
9,,SING,C3,H31,no,N,9,,182391,34134,ACA
10,,SING,C3,H32,no,N,10,,182391,34134,ACA
11,,SING,C4,C5,no,N,11,,182391,34134,ACA
12,,SING,C4,H41,no,N,12,,182391,34134,ACA
13,,SING,C4,H42,no,N,13,,182391,34134,ACA
14,,SING,C5,C6,no,N,14,,182391,34134,ACA
15,,SING,C5,H51,no,N,15,,182391,34134,ACA
16,,SING,C5,H52,no,N,16,,182391,34134,ACA
17,,SING,C6,N6,no,N,17,,182391,34134,ACA
18,,SING,C6,H61,no,N,18,,182391,34134,ACA
19,,SING,C6,H62,no,N,19,,182391,34134,ACA
20,,SING,N6,HN61,no,N,20,,182391,34134,ACA
21,,SING,N6,HN62,no,N,21,,182391,34134,ACA
1,,DOUB,C,O,no,N,1,,182459,34138,ACE
2,,SING,C,CH3,no,N,2,,182459,34138,ACE
3,,SING,C,H,no,N,3,,182459,34138,ACE
4,,SING,CH3,H1,no,N,4,,182459,34138,ACE
5,,SING,CH3,H2,no,N,5,,182459,34138,ACE
6,,SING,CH3,H3,no,N,6,,182459,34138,ACE
1,,SING,N,HN1,no,N,1,,182460,34138,NH2
2,,SING,N,HN2,no,N,2,,182460,34138,NH2
1,,SING,FE1,S2,no,N,1,,182711,34153,SF4
2,,SING,FE1,S3,no,N,2,,182711,34153,SF4
3,,SING,FE1,S4,no,N,3,,182711,34153,SF4
4,,SING,FE2,S1,no,N,4,,182711,34153,SF4
5,,SING,FE2,S3,no,N,5,,182711,34153,SF4
6,,SING,FE2,S4,no,N,6,,182711,34153,SF4
7,,SING,FE3,S1,no,N,7,,182711,34153,SF4
8,,SING,FE3,S2,no,N,8,,182711,34153,SF4
9,,SING,FE3,S4,no,N,9,,182711,34153,SF4
10,,SING,FE4,S1,no,N,10,,182711,34153,SF4
11,,SING,FE4,S2,no,N,11,,182711,34153,SF4
12,,SING,FE4,S3,no,N,12,,182711,34153,SF4
1,,SING,C83,S81,yes,N,1,,182771,34157,9T5
2,,DOUB,C83,N81,yes,N,2,,182771,34157,9T5
3,,SING,S81,C84,yes,N,3,,182771,34157,9T5
4,,SING,N81,C82,yes,N,4,,182771,34157,9T5
5,,DOUB,C84,C82,yes,N,5,,182771,34157,9T5
6,,SING,C84,CM8,no,N,6,,182771,34157,9T5
7,,SING,C82,C81,no,N,7,,182771,34157,9T5
8,,DOUB,C81,O81,no,N,8,,182771,34157,9T5
9,,SING,C81,O1,no,N,9,,182771,34157,9T5
10,,SING,CM8,H883,no,N,10,,182771,34157,9T5
11,,SING,CM8,H881,no,N,11,,182771,34157,9T5
12,,SING,CM8,H882,no,N,12,,182771,34157,9T5
13,,SING,C83,H83,no,N,13,,182771,34157,9T5
14,,SING,O1,H1,no,N,14,,182771,34157,9T5
1,,SING,N,CA,no,N,1,,182772,34157,PYB
2,,SING,N,H,no,N,2,,182772,34157,PYB
3,,SING,N,HN2,no,N,3,,182772,34157,PYB
4,,SING,CA,CB1,yes,N,4,,182772,34157,PYB
5,,DOUB,CA,CB,yes,N,5,,182772,34157,PYB
6,,DOUB,CB1,CG1,yes,N,6,,182772,34157,PYB
7,,SING,CB1,HB1,no,N,7,,182772,34157,PYB
8,,SING,CB,NG2,yes,N,8,,182772,34157,PYB
9,,SING,CB,HB,no,N,9,,182772,34157,PYB
10,,SING,CG1,NG2,yes,N,10,,182772,34157,PYB
11,,SING,CG1,C,no,N,11,,182772,34157,PYB
12,,SING,NG2,CD,no,N,12,,182772,34157,PYB
13,,SING,CD,HD1,no,N,13,,182772,34157,PYB
14,,SING,CD,HD2,no,N,14,,182772,34157,PYB
15,,SING,CD,HD3,no,N,15,,182772,34157,PYB
16,,DOUB,C,O,no,N,16,,182772,34157,PYB
17,,SING,C,OXT,no,N,17,,182772,34157,PYB
18,,SING,OXT,HXT,no,N,18,,182772,34157,PYB
1,,SING,N,CA,no,N,1,,182773,34157,ABU
2,,SING,N,H,no,N,2,,182773,34157,ABU
3,,SING,N,HN2,no,N,3,,182773,34157,ABU
4,,SING,CA,CB,no,N,4,,182773,34157,ABU
5,,SING,CA,HA1,no,N,5,,182773,34157,ABU
6,,SING,CA,HA2,no,N,6,,182773,34157,ABU
7,,SING,CB,CG,no,N,7,,182773,34157,ABU
8,,SING,CB,HB1,no,N,8,,182773,34157,ABU
9,,SING,CB,HB2,no,N,9,,182773,34157,ABU
10,,SING,CG,CD,no,N,10,,182773,34157,ABU
11,,SING,CG,HG1,no,N,11,,182773,34157,ABU
12,,SING,CG,HG2,no,N,12,,182773,34157,ABU
13,,DOUB,CD,OE1,no,N,13,,182773,34157,ABU
14,,SING,CD,OE2,no,N,14,,182773,34157,ABU
15,,SING,OE2,HE2,no,N,15,,182773,34157,ABU
1,,SING,N,CA,no,N,1,,182774,34157,IMT
2,,SING,N,HN2,no,N,2,,182774,34157,IMT
3,,SING,N,H,no,N,3,,182774,34157,IMT
4,,SING,CA,NB1,yes,N,4,,182774,34157,IMT
5,,DOUB,CA,CB,yes,N,5,,182774,34157,IMT
6,,DOUB,NB1,CG1,yes,N,6,,182774,34157,IMT
7,,SING,CB,NG2,yes,N,7,,182774,34157,IMT
8,,SING,CB,HB,no,N,8,,182774,34157,IMT
9,,SING,CG1,NG2,yes,N,9,,182774,34157,IMT
10,,SING,CG1,C,no,N,10,,182774,34157,IMT
11,,SING,NG2,CD,no,N,11,,182774,34157,IMT
12,,SING,CD,HD1,no,N,12,,182774,34157,IMT
13,,SING,CD,HD2,no,N,13,,182774,34157,IMT
14,,SING,CD,HD3,no,N,14,,182774,34157,IMT
15,,DOUB,C,O,no,N,15,,182774,34157,IMT
16,,SING,C,OXT,no,N,16,,182774,34157,IMT
17,,SING,OXT,HXT,no,N,17,,182774,34157,IMT
1,,SING,C01,N01,no,N,1,,182775,34157,9T8
2,,SING,N01,C03,no,N,2,,182775,34157,9T8
3,,SING,N01,C02,no,N,3,,182775,34157,9T8
4,,SING,C03,C04,no,N,4,,182775,34157,9T8
5,,SING,C04,C05,no,N,5,,182775,34157,9T8
6,,SING,C05,N02,no,N,6,,182775,34157,9T8
7,,SING,N02,C06,no,N,7,,182775,34157,9T8
8,,DOUB,C06,O01,no,N,8,,182775,34157,9T8
9,,SING,C06,C07,no,N,9,,182775,34157,9T8
10,,SING,C07,C08,no,N,10,,182775,34157,9T8
11,,SING,C08,N03,no,N,11,,182775,34157,9T8
12,,SING,C01,H006,no,N,12,,182775,34157,9T8
13,,SING,C01,H004,no,N,13,,182775,34157,9T8
14,,SING,C01,H005,no,N,14,,182775,34157,9T8
15,,SING,N02,HN02,no,N,15,,182775,34157,9T8
16,,SING,C03,H031,no,N,16,,182775,34157,9T8
17,,SING,C03,H032,no,N,17,,182775,34157,9T8
18,,SING,C05,H052,no,N,18,,182775,34157,9T8
19,,SING,C05,H051,no,N,19,,182775,34157,9T8
20,,SING,C07,H072,no,N,20,,182775,34157,9T8
21,,SING,C07,H071,no,N,21,,182775,34157,9T8
22,,SING,C04,H042,no,N,22,,182775,34157,9T8
23,,SING,C04,H041,no,N,23,,182775,34157,9T8
24,,SING,N01,HN01,no,N,24,,182775,34157,9T8
25,,SING,C02,H001,no,N,25,,182775,34157,9T8
26,,SING,C02,H002,no,N,26,,182775,34157,9T8
27,,SING,C02,H003,no,N,27,,182775,34157,9T8
28,,SING,N03,H1,no,N,28,,182775,34157,9T8
29,,SING,N03,H2,no,N,29,,182775,34157,9T8
30,,SING,N03,HN03,no,N,30,,182775,34157,9T8
31,,SING,C08,H081,no,N,31,,182775,34157,9T8
32,,SING,C08,H082,no,N,32,,182775,34157,9T8
1,,SING,N1,C2,no,N,1,,182776,34157,DCZ
2,,SING,N1,C6,no,N,2,,182776,34157,DCZ
3,,SING,N1,C1',no,N,3,,182776,34157,DCZ
4,,SING,C2,N3,no,N,4,,182776,34157,DCZ
5,,DOUB,C2,O2,no,N,5,,182776,34157,DCZ
6,,DOUB,N3,C4,no,N,6,,182776,34157,DCZ
7,,SING,C4,C5,no,N,7,,182776,34157,DCZ
8,,SING,C4,N4,no,N,8,,182776,34157,DCZ
9,,DOUB,C5,C6,no,N,9,,182776,34157,DCZ
10,,SING,C5,H5,no,N,10,,182776,34157,DCZ
11,,SING,C6,H6,no,N,11,,182776,34157,DCZ
12,,SING,N4,HN41,no,N,12,,182776,34157,DCZ
13,,SING,N4,HN42,no,N,13,,182776,34157,DCZ
14,,SING,C1',C2',no,N,14,,182776,34157,DCZ
15,,SING,C1',O4',no,N,15,,182776,34157,DCZ
16,,SING,C1',H1',no,N,16,,182776,34157,DCZ
17,,SING,C2',C3',no,N,17,,182776,34157,DCZ
18,,SING,C2',H2'1,no,N,18,,182776,34157,DCZ
19,,SING,C2',H2'2,no,N,19,,182776,34157,DCZ
20,,SING,C3',C4',no,N,20,,182776,34157,DCZ
21,,SING,C3',O3',no,N,21,,182776,34157,DCZ
22,,SING,C3',H3',no,N,22,,182776,34157,DCZ
23,,SING,C4',O4',no,N,23,,182776,34157,DCZ
24,,SING,C4',C5',no,N,24,,182776,34157,DCZ
25,,SING,C4',H4',no,N,25,,182776,34157,DCZ
26,,SING,O3',HO3',no,N,26,,182776,34157,DCZ
27,,SING,C5',O5',no,N,27,,182776,34157,DCZ
28,,SING,C5',H5'1,no,N,28,,182776,34157,DCZ
29,,SING,C5',H5'2,no,N,29,,182776,34157,DCZ
30,,SING,O5',HO51,no,N,30,,182776,34157,DCZ
1,,SING,C83,S81,yes,N,1,,182801,34158,9U2
2,,DOUB,C83,N81,yes,N,2,,182801,34158,9U2
3,,SING,S81,C84,yes,N,3,,182801,34158,9U2
4,,SING,N81,C82,yes,N,4,,182801,34158,9U2
5,,DOUB,C84,C82,yes,N,5,,182801,34158,9U2
6,,SING,C84,C85,no,N,6,,182801,34158,9U2
7,,SING,C82,C81,no,N,7,,182801,34158,9U2
8,,SING,CM8,C85,no,N,8,,182801,34158,9U2
9,,SING,C85,CM9,no,N,9,,182801,34158,9U2
10,,DOUB,C81,O81,no,N,10,,182801,34158,9U2
11,,SING,C81,H1,no,N,11,,182801,34158,9U2
12,,SING,C85,H85,no,N,12,,182801,34158,9U2
13,,SING,C83,H83,no,N,13,,182801,34158,9U2
14,,SING,CM8,H882,no,N,14,,182801,34158,9U2
15,,SING,CM8,H883,no,N,15,,182801,34158,9U2
16,,SING,CM8,H881,no,N,16,,182801,34158,9U2
17,,SING,CM9,H992,no,N,17,,182801,34158,9U2
18,,SING,CM9,H993,no,N,18,,182801,34158,9U2
19,,SING,CM9,H991,no,N,19,,182801,34158,9U2
1,,SING,N,CA,no,N,1,,182802,34158,PYB
2,,SING,N,H,no,N,2,,182802,34158,PYB
3,,SING,N,HN2,no,N,3,,182802,34158,PYB
4,,SING,CA,CB1,yes,N,4,,182802,34158,PYB
5,,DOUB,CA,CB,yes,N,5,,182802,34158,PYB
6,,DOUB,CB1,CG1,yes,N,6,,182802,34158,PYB
7,,SING,CB1,HB1,no,N,7,,182802,34158,PYB
8,,SING,CB,NG2,yes,N,8,,182802,34158,PYB
9,,SING,CB,HB,no,N,9,,182802,34158,PYB
10,,SING,CG1,NG2,yes,N,10,,182802,34158,PYB
11,,SING,CG1,C,no,N,11,,182802,34158,PYB
12,,SING,NG2,CD,no,N,12,,182802,34158,PYB
13,,SING,CD,HD1,no,N,13,,182802,34158,PYB
14,,SING,CD,HD2,no,N,14,,182802,34158,PYB
15,,SING,CD,HD3,no,N,15,,182802,34158,PYB
16,,DOUB,C,O,no,N,16,,182802,34158,PYB
17,,SING,C,OXT,no,N,17,,182802,34158,PYB
18,,SING,OXT,HXT,no,N,18,,182802,34158,PYB
1,,SING,N,CA,no,N,1,,182803,34158,ABU
2,,SING,N,H,no,N,2,,182803,34158,ABU
3,,SING,N,HN2,no,N,3,,182803,34158,ABU
4,,SING,CA,CB,no,N,4,,182803,34158,ABU
5,,SING,CA,HA1,no,N,5,,182803,34158,ABU
6,,SING,CA,HA2,no,N,6,,182803,34158,ABU
7,,SING,CB,CG,no,N,7,,182803,34158,ABU
8,,SING,CB,HB1,no,N,8,,182803,34158,ABU
9,,SING,CB,HB2,no,N,9,,182803,34158,ABU
10,,SING,CG,CD,no,N,10,,182803,34158,ABU
11,,SING,CG,HG1,no,N,11,,182803,34158,ABU
12,,SING,CG,HG2,no,N,12,,182803,34158,ABU
13,,DOUB,CD,OE1,no,N,13,,182803,34158,ABU
14,,SING,CD,OE2,no,N,14,,182803,34158,ABU
15,,SING,OE2,HE2,no,N,15,,182803,34158,ABU
1,,SING,N,CA,no,N,1,,182804,34158,IMT
2,,SING,N,HN2,no,N,2,,182804,34158,IMT
3,,SING,N,H,no,N,3,,182804,34158,IMT
4,,SING,CA,NB1,yes,N,4,,182804,34158,IMT
5,,DOUB,CA,CB,yes,N,5,,182804,34158,IMT
6,,DOUB,NB1,CG1,yes,N,6,,182804,34158,IMT
7,,SING,CB,NG2,yes,N,7,,182804,34158,IMT
8,,SING,CB,HB,no,N,8,,182804,34158,IMT
9,,SING,CG1,NG2,yes,N,9,,182804,34158,IMT
10,,SING,CG1,C,no,N,10,,182804,34158,IMT
11,,SING,NG2,CD,no,N,11,,182804,34158,IMT
12,,SING,CD,HD1,no,N,12,,182804,34158,IMT
13,,SING,CD,HD2,no,N,13,,182804,34158,IMT
14,,SING,CD,HD3,no,N,14,,182804,34158,IMT
15,,DOUB,C,O,no,N,15,,182804,34158,IMT
16,,SING,C,OXT,no,N,16,,182804,34158,IMT
17,,SING,OXT,HXT,no,N,17,,182804,34158,IMT
1,,SING,C01,N01,no,N,1,,182805,34158,9T8
2,,SING,N01,C03,no,N,2,,182805,34158,9T8
3,,SING,N01,C02,no,N,3,,182805,34158,9T8
4,,SING,C03,C04,no,N,4,,182805,34158,9T8
5,,SING,C04,C05,no,N,5,,182805,34158,9T8
6,,SING,C05,N02,no,N,6,,182805,34158,9T8
7,,SING,N02,C06,no,N,7,,182805,34158,9T8
8,,DOUB,C06,O01,no,N,8,,182805,34158,9T8
9,,SING,C06,C07,no,N,9,,182805,34158,9T8
10,,SING,C07,C08,no,N,10,,182805,34158,9T8
11,,SING,C08,N03,no,N,11,,182805,34158,9T8
12,,SING,C01,H006,no,N,12,,182805,34158,9T8
13,,SING,C01,H004,no,N,13,,182805,34158,9T8
14,,SING,C01,H005,no,N,14,,182805,34158,9T8
15,,SING,N02,HN02,no,N,15,,182805,34158,9T8
16,,SING,C03,H031,no,N,16,,182805,34158,9T8
17,,SING,C03,H032,no,N,17,,182805,34158,9T8
18,,SING,C05,H052,no,N,18,,182805,34158,9T8
19,,SING,C05,H051,no,N,19,,182805,34158,9T8
20,,SING,C07,H072,no,N,20,,182805,34158,9T8
21,,SING,C07,H071,no,N,21,,182805,34158,9T8
22,,SING,C04,H042,no,N,22,,182805,34158,9T8
23,,SING,C04,H041,no,N,23,,182805,34158,9T8
24,,SING,N01,HN01,no,N,24,,182805,34158,9T8
25,,SING,C02,H001,no,N,25,,182805,34158,9T8
26,,SING,C02,H002,no,N,26,,182805,34158,9T8
27,,SING,C02,H003,no,N,27,,182805,34158,9T8
28,,SING,N03,H1,no,N,28,,182805,34158,9T8
29,,SING,N03,H2,no,N,29,,182805,34158,9T8
30,,SING,N03,HN03,no,N,30,,182805,34158,9T8
31,,SING,C08,H081,no,N,31,,182805,34158,9T8
32,,SING,C08,H082,no,N,32,,182805,34158,9T8
1,,SING,N1,C2,no,N,1,,182806,34158,DCZ
2,,SING,N1,C6,no,N,2,,182806,34158,DCZ
3,,SING,N1,C1',no,N,3,,182806,34158,DCZ
4,,SING,C2,N3,no,N,4,,182806,34158,DCZ
5,,DOUB,C2,O2,no,N,5,,182806,34158,DCZ
6,,DOUB,N3,C4,no,N,6,,182806,34158,DCZ
7,,SING,C4,C5,no,N,7,,182806,34158,DCZ
8,,SING,C4,N4,no,N,8,,182806,34158,DCZ
9,,DOUB,C5,C6,no,N,9,,182806,34158,DCZ
10,,SING,C5,H5,no,N,10,,182806,34158,DCZ
11,,SING,C6,H6,no,N,11,,182806,34158,DCZ
12,,SING,N4,HN41,no,N,12,,182806,34158,DCZ
13,,SING,N4,HN42,no,N,13,,182806,34158,DCZ
14,,SING,C1',C2',no,N,14,,182806,34158,DCZ
15,,SING,C1',O4',no,N,15,,182806,34158,DCZ
16,,SING,C1',H1',no,N,16,,182806,34158,DCZ
17,,SING,C2',C3',no,N,17,,182806,34158,DCZ
18,,SING,C2',H2'1,no,N,18,,182806,34158,DCZ
19,,SING,C2',H2'2,no,N,19,,182806,34158,DCZ
20,,SING,C3',C4',no,N,20,,182806,34158,DCZ
21,,SING,C3',O3',no,N,21,,182806,34158,DCZ
22,,SING,C3',H3',no,N,22,,182806,34158,DCZ
23,,SING,C4',O4',no,N,23,,182806,34158,DCZ
24,,SING,C4',C5',no,N,24,,182806,34158,DCZ
25,,SING,C4',H4',no,N,25,,182806,34158,DCZ
26,,SING,O3',HO3',no,N,26,,182806,34158,DCZ
27,,SING,C5',O5',no,N,27,,182806,34158,DCZ
28,,SING,C5',H5'1,no,N,28,,182806,34158,DCZ
29,,SING,C5',H5'2,no,N,29,,182806,34158,DCZ
30,,SING,O5',HO51,no,N,30,,182806,34158,DCZ
1,,SING,C84,N82,yes,N,1,,182831,34159,9TK
2,,DOUB,C84,C83,yes,N,2,,182831,34159,9TK
3,,DOUB,N82,C82,yes,N,3,,182831,34159,9TK
4,,SING,C83,N81,yes,N,4,,182831,34159,9TK
5,,SING,C82,N81,yes,N,5,,182831,34159,9TK
6,,SING,C82,C81,no,N,6,,182831,34159,9TK
7,,SING,N81,C88,no,N,7,,182831,34159,9TK
8,,DOUB,C81,O81,no,N,8,,182831,34159,9TK
9,,SING,C83,H84,no,N,9,,182831,34159,9TK
10,,SING,C88,H883,no,N,10,,182831,34159,9TK
11,,SING,C88,H882,no,N,11,,182831,34159,9TK
12,,SING,C88,H881,no,N,12,,182831,34159,9TK
13,,SING,C84,H83,no,N,13,,182831,34159,9TK
14,,SING,C81,O1,no,N,14,,182831,34159,9TK
15,,SING,O1,H1,no,N,15,,182831,34159,9TK
1,,SING,N,CA,no,N,1,,182832,34159,PYB
2,,SING,N,H,no,N,2,,182832,34159,PYB
3,,SING,N,HN2,no,N,3,,182832,34159,PYB
4,,SING,CA,CB1,yes,N,4,,182832,34159,PYB
5,,DOUB,CA,CB,yes,N,5,,182832,34159,PYB
6,,DOUB,CB1,CG1,yes,N,6,,182832,34159,PYB
7,,SING,CB1,HB1,no,N,7,,182832,34159,PYB
8,,SING,CB,NG2,yes,N,8,,182832,34159,PYB
9,,SING,CB,HB,no,N,9,,182832,34159,PYB
10,,SING,CG1,NG2,yes,N,10,,182832,34159,PYB
11,,SING,CG1,C,no,N,11,,182832,34159,PYB
12,,SING,NG2,CD,no,N,12,,182832,34159,PYB
13,,SING,CD,HD1,no,N,13,,182832,34159,PYB
14,,SING,CD,HD2,no,N,14,,182832,34159,PYB
15,,SING,CD,HD3,no,N,15,,182832,34159,PYB
16,,DOUB,C,O,no,N,16,,182832,34159,PYB
17,,SING,C,OXT,no,N,17,,182832,34159,PYB
18,,SING,OXT,HXT,no,N,18,,182832,34159,PYB
1,,SING,N,CA,no,N,1,,182833,34159,ABU
2,,SING,N,H,no,N,2,,182833,34159,ABU
3,,SING,N,HN2,no,N,3,,182833,34159,ABU
4,,SING,CA,CB,no,N,4,,182833,34159,ABU
5,,SING,CA,HA1,no,N,5,,182833,34159,ABU
6,,SING,CA,HA2,no,N,6,,182833,34159,ABU
7,,SING,CB,CG,no,N,7,,182833,34159,ABU
8,,SING,CB,HB1,no,N,8,,182833,34159,ABU
9,,SING,CB,HB2,no,N,9,,182833,34159,ABU
10,,SING,CG,CD,no,N,10,,182833,34159,ABU
11,,SING,CG,HG1,no,N,11,,182833,34159,ABU
12,,SING,CG,HG2,no,N,12,,182833,34159,ABU
13,,DOUB,CD,OE1,no,N,13,,182833,34159,ABU
14,,SING,CD,OE2,no,N,14,,182833,34159,ABU
15,,SING,OE2,HE2,no,N,15,,182833,34159,ABU
1,,SING,N,CA,no,N,1,,182834,34159,IMT
2,,SING,N,HN2,no,N,2,,182834,34159,IMT
3,,SING,N,H,no,N,3,,182834,34159,IMT
4,,SING,CA,NB1,yes,N,4,,182834,34159,IMT
5,,DOUB,CA,CB,yes,N,5,,182834,34159,IMT
6,,DOUB,NB1,CG1,yes,N,6,,182834,34159,IMT
7,,SING,CB,NG2,yes,N,7,,182834,34159,IMT
8,,SING,CB,HB,no,N,8,,182834,34159,IMT
9,,SING,CG1,NG2,yes,N,9,,182834,34159,IMT
10,,SING,CG1,C,no,N,10,,182834,34159,IMT
11,,SING,NG2,CD,no,N,11,,182834,34159,IMT
12,,SING,CD,HD1,no,N,12,,182834,34159,IMT
13,,SING,CD,HD2,no,N,13,,182834,34159,IMT
14,,SING,CD,HD3,no,N,14,,182834,34159,IMT
15,,DOUB,C,O,no,N,15,,182834,34159,IMT
16,,SING,C,OXT,no,N,16,,182834,34159,IMT
17,,SING,OXT,HXT,no,N,17,,182834,34159,IMT
1,,SING,C01,N01,no,N,1,,182835,34159,9T8
2,,SING,N01,C03,no,N,2,,182835,34159,9T8
3,,SING,N01,C02,no,N,3,,182835,34159,9T8
4,,SING,C03,C04,no,N,4,,182835,34159,9T8
5,,SING,C04,C05,no,N,5,,182835,34159,9T8
6,,SING,C05,N02,no,N,6,,182835,34159,9T8
7,,SING,N02,C06,no,N,7,,182835,34159,9T8
8,,DOUB,C06,O01,no,N,8,,182835,34159,9T8
9,,SING,C06,C07,no,N,9,,182835,34159,9T8
10,,SING,C07,C08,no,N,10,,182835,34159,9T8
11,,SING,C08,N03,no,N,11,,182835,34159,9T8
12,,SING,C01,H006,no,N,12,,182835,34159,9T8
13,,SING,C01,H004,no,N,13,,182835,34159,9T8
14,,SING,C01,H005,no,N,14,,182835,34159,9T8
15,,SING,N02,HN02,no,N,15,,182835,34159,9T8
16,,SING,C03,H031,no,N,16,,182835,34159,9T8
17,,SING,C03,H032,no,N,17,,182835,34159,9T8
18,,SING,C05,H052,no,N,18,,182835,34159,9T8
19,,SING,C05,H051,no,N,19,,182835,34159,9T8
20,,SING,C07,H072,no,N,20,,182835,34159,9T8
21,,SING,C07,H071,no,N,21,,182835,34159,9T8
22,,SING,C04,H042,no,N,22,,182835,34159,9T8
23,,SING,C04,H041,no,N,23,,182835,34159,9T8
24,,SING,N01,HN01,no,N,24,,182835,34159,9T8
25,,SING,C02,H001,no,N,25,,182835,34159,9T8
26,,SING,C02,H002,no,N,26,,182835,34159,9T8
27,,SING,C02,H003,no,N,27,,182835,34159,9T8
28,,SING,N03,H1,no,N,28,,182835,34159,9T8
29,,SING,N03,H2,no,N,29,,182835,34159,9T8
30,,SING,N03,HN03,no,N,30,,182835,34159,9T8
31,,SING,C08,H081,no,N,31,,182835,34159,9T8
32,,SING,C08,H082,no,N,32,,182835,34159,9T8
1,,SING,N1,C2,no,N,1,,182836,34159,DCZ
2,,SING,N1,C6,no,N,2,,182836,34159,DCZ
3,,SING,N1,C1',no,N,3,,182836,34159,DCZ
4,,SING,C2,N3,no,N,4,,182836,34159,DCZ
5,,DOUB,C2,O2,no,N,5,,182836,34159,DCZ
6,,DOUB,N3,C4,no,N,6,,182836,34159,DCZ
7,,SING,C4,C5,no,N,7,,182836,34159,DCZ
8,,SING,C4,N4,no,N,8,,182836,34159,DCZ
9,,DOUB,C5,C6,no,N,9,,182836,34159,DCZ
10,,SING,C5,H5,no,N,10,,182836,34159,DCZ
11,,SING,C6,H6,no,N,11,,182836,34159,DCZ
12,,SING,N4,HN41,no,N,12,,182836,34159,DCZ
13,,SING,N4,HN42,no,N,13,,182836,34159,DCZ
14,,SING,C1',C2',no,N,14,,182836,34159,DCZ
15,,SING,C1',O4',no,N,15,,182836,34159,DCZ
16,,SING,C1',H1',no,N,16,,182836,34159,DCZ
17,,SING,C2',C3',no,N,17,,182836,34159,DCZ
18,,SING,C2',H2'1,no,N,18,,182836,34159,DCZ
19,,SING,C2',H2'2,no,N,19,,182836,34159,DCZ
20,,SING,C3',C4',no,N,20,,182836,34159,DCZ
21,,SING,C3',O3',no,N,21,,182836,34159,DCZ
22,,SING,C3',H3',no,N,22,,182836,34159,DCZ
23,,SING,C4',O4',no,N,23,,182836,34159,DCZ
24,,SING,C4',C5',no,N,24,,182836,34159,DCZ
25,,SING,C4',H4',no,N,25,,182836,34159,DCZ
26,,SING,O3',HO3',no,N,26,,182836,34159,DCZ
27,,SING,C5',O5',no,N,27,,182836,34159,DCZ
28,,SING,C5',H5'1,no,N,28,,182836,34159,DCZ
29,,SING,C5',H5'2,no,N,29,,182836,34159,DCZ
30,,SING,O5',HO51,no,N,30,,182836,34159,DCZ
1,,DOUB,P,OP1,no,N,1,,182902,34162,DNR
2,,SING,P,OP2,no,N,2,,182902,34162,DNR
3,,SING,P,O5',no,N,3,,182902,34162,DNR
4,,SING,P,OP3,no,N,4,,182902,34162,DNR
5,,SING,OP2,HOP2,no,N,5,,182902,34162,DNR
6,,SING,O5',C5',no,N,6,,182902,34162,DNR
7,,SING,C5',C4',no,N,7,,182902,34162,DNR
8,,SING,C5',H5',no,N,8,,182902,34162,DNR
9,,SING,C5',H5'',no,N,9,,182902,34162,DNR
10,,SING,C4',O4',no,N,10,,182902,34162,DNR
11,,SING,C4',C3',no,N,11,,182902,34162,DNR
12,,SING,C4',H4',no,N,12,,182902,34162,DNR
13,,SING,O4',C1',no,N,13,,182902,34162,DNR
14,,SING,C1',N1,no,N,14,,182902,34162,DNR
15,,SING,C1',C2',no,N,15,,182902,34162,DNR
16,,SING,C1',H1',no,N,16,,182902,34162,DNR
17,,SING,N1,C6,no,N,17,,182902,34162,DNR
18,,SING,N1,C2,no,N,18,,182902,34162,DNR
19,,DOUB,C6,C5,no,N,19,,182902,34162,DNR
20,,SING,C6,H6,no,N,20,,182902,34162,DNR
21,,DOUB,C2,O2,no,N,21,,182902,34162,DNR
22,,SING,C2,N3,no,N,22,,182902,34162,DNR
23,,DOUB,N3,C4,no,N,23,,182902,34162,DNR
24,,SING,N3,HN3,no,N,24,,182902,34162,DNR
25,,SING,C4,N4,no,N,25,,182902,34162,DNR
26,,SING,C4,C5,no,N,26,,182902,34162,DNR
27,,SING,N4,H41,no,N,27,,182902,34162,DNR
28,,SING,N4,H42,no,N,28,,182902,34162,DNR
29,,SING,C5,H5,no,N,29,,182902,34162,DNR
30,,SING,C2',C3',no,N,30,,182902,34162,DNR
31,,SING,C2',H2',no,N,31,,182902,34162,DNR
32,,SING,C2',H2'',no,N,32,,182902,34162,DNR
33,,SING,C3',O3',no,N,33,,182902,34162,DNR
34,,SING,C3',H3',no,N,34,,182902,34162,DNR
35,,SING,O3',HO3',no,N,35,,182902,34162,DNR
36,,SING,OP3,HOP3,no,N,36,,182902,34162,DNR
1,,SING,O5',C5',no,N,1,,182903,34162,THM
2,,SING,O5',HO5',no,N,2,,182903,34162,THM
3,,SING,C5',C4',no,N,3,,182903,34162,THM
4,,SING,C5',H5'1,no,N,4,,182903,34162,THM
5,,SING,C5',H5'2,no,N,5,,182903,34162,THM
6,,SING,C4',O4',no,N,6,,182903,34162,THM
7,,SING,C4',C3',no,N,7,,182903,34162,THM
8,,SING,C4',H4',no,N,8,,182903,34162,THM
9,,SING,O4',C1',no,N,9,,182903,34162,THM
10,,SING,C3',O3',no,N,10,,182903,34162,THM
11,,SING,C3',C2',no,N,11,,182903,34162,THM
12,,SING,C3',H3',no,N,12,,182903,34162,THM
13,,SING,O3',HO3',no,N,13,,182903,34162,THM
14,,SING,C2',C1',no,N,14,,182903,34162,THM
15,,SING,C2',H2'1,no,N,15,,182903,34162,THM
16,,SING,C2',H2'2,no,N,16,,182903,34162,THM
17,,SING,C1',N1,no,N,17,,182903,34162,THM
18,,SING,C1',H1',no,N,18,,182903,34162,THM
19,,SING,N1,C2,no,N,19,,182903,34162,THM
20,,SING,N1,C6,no,N,20,,182903,34162,THM
21,,DOUB,C2,O2,no,N,21,,182903,34162,THM
22,,SING,C2,N3,no,N,22,,182903,34162,THM
23,,SING,N3,C4,no,N,23,,182903,34162,THM
24,,SING,N3,HN3,no,N,24,,182903,34162,THM
25,,DOUB,C4,O4,no,N,25,,182903,34162,THM
26,,SING,C4,C5,no,N,26,,182903,34162,THM
27,,SING,C5,C5M,no,N,27,,182903,34162,THM
28,,DOUB,C5,C6,no,N,28,,182903,34162,THM
29,,SING,C5M,HM51,no,N,29,,182903,34162,THM
30,,SING,C5M,HM52,no,N,30,,182903,34162,THM
31,,SING,C5M,HM53,no,N,31,,182903,34162,THM
32,,SING,C6,H6,no,N,32,,182903,34162,THM
1,,DOUB,O,C,no,N,1,,182958,34165,LE1
2,,SING,C,OXT,no,N,2,,182958,34165,LE1
3,,SING,CA,C,no,N,3,,182958,34165,LE1
4,,SING,CA,CB,no,N,4,,182958,34165,LE1
5,,SING,CA,HA,no,N,5,,182958,34165,LE1
6,,SING,N,CA,no,N,6,,182958,34165,LE1
7,,SING,N,HN,no,N,7,,182958,34165,LE1
8,,SING,N,HNA,no,N,8,,182958,34165,LE1
9,,SING,CB,C9,no,N,9,,182958,34165,LE1
10,,SING,CB,C8,no,N,10,,182958,34165,LE1
11,,SING,C9,H9,no,N,11,,182958,34165,LE1
12,,SING,C9,H9A,no,N,12,,182958,34165,LE1
13,,SING,C9,H9B,no,N,13,,182958,34165,LE1
14,,SING,C8,H8,no,N,14,,182958,34165,LE1
15,,SING,C8,H8A,no,N,15,,182958,34165,LE1
16,,SING,C8,H8B,no,N,16,,182958,34165,LE1
17,,SING,SG,CB,no,N,17,,182958,34165,LE1
18,,SING,SG,HSG,no,N,18,,182958,34165,LE1
19,,SING,OXT,HXT,no,N,19,,182958,34165,LE1
1,,DOUB,C,O,no,N,1,,182959,34165,ACE
2,,SING,C,CH3,no,N,2,,182959,34165,ACE
3,,SING,C,H,no,N,3,,182959,34165,ACE
4,,SING,CH3,H1,no,N,4,,182959,34165,ACE
5,,SING,CH3,H2,no,N,5,,182959,34165,ACE
6,,SING,CH3,H3,no,N,6,,182959,34165,ACE
1,,SING,N,CA,no,N,1,,182960,34165,DCY
2,,SING,N,H,no,N,2,,182960,34165,DCY
3,,SING,N,H2,no,N,3,,182960,34165,DCY
4,,SING,CA,C,no,N,4,,182960,34165,DCY
5,,SING,CA,CB,no,N,5,,182960,34165,DCY
6,,SING,CA,HA,no,N,6,,182960,34165,DCY
7,,DOUB,C,O,no,N,7,,182960,34165,DCY
8,,SING,C,OXT,no,N,8,,182960,34165,DCY
9,,SING,CB,SG,no,N,9,,182960,34165,DCY
10,,SING,CB,HB2,no,N,10,,182960,34165,DCY
11,,SING,CB,HB3,no,N,11,,182960,34165,DCY
12,,SING,SG,HG,no,N,12,,182960,34165,DCY
13,,SING,OXT,HXT,no,N,13,,182960,34165,DCY
1,,DOUB,C6,C5,yes,N,1,,182961,34165,NAL
2,,SING,C6,C7,yes,N,2,,182961,34165,NAL
3,,SING,C5,C4A,yes,N,3,,182961,34165,NAL
4,,DOUB,C7,C8,yes,N,4,,182961,34165,NAL
5,,DOUB,C4A,C4,yes,N,5,,182961,34165,NAL
6,,SING,C4A,C8A,yes,N,6,,182961,34165,NAL
7,,SING,C8,C8A,yes,N,7,,182961,34165,NAL
8,,SING,C4,C3,yes,N,8,,182961,34165,NAL
9,,DOUB,C8A,C1,yes,N,9,,182961,34165,NAL
10,,DOUB,C3,C2,yes,N,10,,182961,34165,NAL
11,,SING,C1,C2,yes,N,11,,182961,34165,NAL
12,,SING,C2,C9,no,N,12,,182961,34165,NAL
13,,SING,C9,CA,no,N,13,,182961,34165,NAL
14,,SING,CA,N,no,N,14,,182961,34165,NAL
15,,SING,CA,C,no,N,15,,182961,34165,NAL
16,,DOUB,C,O,no,N,16,,182961,34165,NAL
17,,SING,C,OXT,no,N,17,,182961,34165,NAL
18,,SING,C1,H1,no,N,18,,182961,34165,NAL
19,,SING,C3,H3,no,N,19,,182961,34165,NAL
20,,SING,C4,H4,no,N,20,,182961,34165,NAL
21,,SING,C5,H5,no,N,21,,182961,34165,NAL
22,,SING,C6,H6,no,N,22,,182961,34165,NAL
23,,SING,C7,H7,no,N,23,,182961,34165,NAL
24,,SING,C8,H8,no,N,24,,182961,34165,NAL
25,,SING,C9,H91,no,N,25,,182961,34165,NAL
26,,SING,C9,H92,no,N,26,,182961,34165,NAL
27,,SING,CA,HA,no,N,27,,182961,34165,NAL
28,,SING,N,H,no,N,28,,182961,34165,NAL
29,,SING,N,H2,no,N,29,,182961,34165,NAL
30,,SING,OXT,HXT,no,N,30,,182961,34165,NAL
1,,DOUB,NH2,CE4,no,N,1,,182980,34166,9XQ
2,,SING,CE4,NE3,no,N,2,,182980,34166,9XQ
3,,SING,CE4,NH1,no,N,3,,182980,34166,9XQ
4,,DOUB,O,C,no,N,4,,182980,34166,9XQ
5,,SING,NE3,CE1,no,N,5,,182980,34166,9XQ
6,,DOUB,CD1,CE1,yes,N,6,,182980,34166,9XQ
7,,SING,CD1,CG,yes,N,7,,182980,34166,9XQ
8,,SING,C,CG,no,N,8,,182980,34166,9XQ
9,,SING,CE1,CZ,yes,N,9,,182980,34166,9XQ
10,,DOUB,CG,CD2,yes,N,10,,182980,34166,9XQ
11,,DOUB,CZ,CE2,yes,N,11,,182980,34166,9XQ
12,,SING,CD2,CE2,yes,N,12,,182980,34166,9XQ
13,,SING,CD1,1HD,no,N,13,,182980,34166,9XQ
14,,SING,CZ,HZ,no,N,14,,182980,34166,9XQ
15,,SING,CE2,2HE,no,N,15,,182980,34166,9XQ
16,,SING,CD2,2HD,no,N,16,,182980,34166,9XQ
17,,SING,NH1,2HH1,no,N,17,,182980,34166,9XQ
18,,SING,NH1,1HH1,no,N,18,,182980,34166,9XQ
19,,SING,NH2,1HH2,no,N,19,,182980,34166,9XQ
20,,SING,NE3,3HE,no,N,20,,182980,34166,9XQ
21,,SING,C,OXT,no,N,21,,182980,34166,9XQ
22,,SING,OXT,HXT,no,N,22,,182980,34166,9XQ
23,,SING,NH2,2HH2,no,N,23,,182980,34166,9XQ
1,,DOUB,P,OP1,no,N,1,,183019,34168,BGM
2,,SING,P,OP2,no,N,2,,183019,34168,BGM
3,,SING,P,O5',no,N,3,,183019,34168,BGM
4,,SING,P,OP3,no,N,4,,183019,34168,BGM
5,,SING,OP2,HOP2,no,N,5,,183019,34168,BGM
6,,SING,O5',C5',no,N,6,,183019,34168,BGM
7,,SING,C5',C4',no,N,7,,183019,34168,BGM
8,,SING,C5',H5',no,N,8,,183019,34168,BGM
9,,SING,C5',H5'',no,N,9,,183019,34168,BGM
10,,SING,C4',O4',no,N,10,,183019,34168,BGM
11,,SING,C4',C3',no,N,11,,183019,34168,BGM
12,,SING,C4',H4',no,N,12,,183019,34168,BGM
13,,SING,O4',C1',no,N,13,,183019,34168,BGM
14,,SING,C1',N9,no,N,14,,183019,34168,BGM
15,,SING,C1',C2',no,N,15,,183019,34168,BGM
16,,SING,C1',H1',no,N,16,,183019,34168,BGM
17,,SING,N9,C8,yes,N,17,,183019,34168,BGM
18,,SING,N9,C4,yes,N,18,,183019,34168,BGM
19,,DOUB,C8,N7,yes,N,19,,183019,34168,BGM
20,,SING,C8,BR,no,N,20,,183019,34168,BGM
21,,SING,N7,C5,yes,N,21,,183019,34168,BGM
22,,DOUB,C5,C4,yes,N,22,,183019,34168,BGM
23,,SING,C5,C6,no,N,23,,183019,34168,BGM
24,,SING,C4,N3,no,N,24,,183019,34168,BGM
25,,DOUB,N3,C2,no,N,25,,183019,34168,BGM
26,,SING,C2,N2,no,N,26,,183019,34168,BGM
27,,SING,C2,N1,no,N,27,,183019,34168,BGM
28,,SING,N2,H21,no,N,28,,183019,34168,BGM
29,,SING,N2,H22,no,N,29,,183019,34168,BGM
30,,SING,N1,C6,no,N,30,,183019,34168,BGM
31,,SING,N1,H1,no,N,31,,183019,34168,BGM
32,,DOUB,C6,O6,no,N,32,,183019,34168,BGM
33,,SING,C2',C3',no,N,33,,183019,34168,BGM
34,,SING,C2',H2',no,N,34,,183019,34168,BGM
35,,SING,C2',H2'',no,N,35,,183019,34168,BGM
36,,SING,C3',O3',no,N,36,,183019,34168,BGM
37,,SING,C3',H3',no,N,37,,183019,34168,BGM
38,,SING,O3',HO3',no,N,38,,183019,34168,BGM
39,,SING,OP3,HOP3,no,N,39,,183019,34168,BGM
1,,SING,N1,C2,no,N,1,,183074,34171,PSU
2,,SING,N1,C6,no,N,2,,183074,34171,PSU
3,,SING,N1,HN1,no,N,3,,183074,34171,PSU
4,,SING,C2,N3,no,N,4,,183074,34171,PSU
5,,DOUB,C2,O2,no,N,5,,183074,34171,PSU
6,,SING,N3,C4,no,N,6,,183074,34171,PSU
7,,SING,N3,HN3,no,N,7,,183074,34171,PSU
8,,SING,C4,C5,no,N,8,,183074,34171,PSU
9,,DOUB,C4,O4,no,N,9,,183074,34171,PSU
10,,DOUB,C5,C6,no,N,10,,183074,34171,PSU
11,,SING,C5,C1',no,N,11,,183074,34171,PSU
12,,SING,C6,H6,no,N,12,,183074,34171,PSU
13,,SING,C1',C2',no,N,13,,183074,34171,PSU
14,,SING,C1',O4',no,N,14,,183074,34171,PSU
15,,SING,C1',H1',no,N,15,,183074,34171,PSU
16,,SING,C2',O2',no,N,16,,183074,34171,PSU
17,,SING,C2',C3',no,N,17,,183074,34171,PSU
18,,SING,C2',H2',no,N,18,,183074,34171,PSU
19,,SING,O2',HO2',no,N,19,,183074,34171,PSU
20,,SING,C3',C4',no,N,20,,183074,34171,PSU
21,,SING,C3',O3',no,N,21,,183074,34171,PSU
22,,SING,C3',H3',no,N,22,,183074,34171,PSU
23,,SING,C4',O4',no,N,23,,183074,34171,PSU
24,,SING,C4',C5',no,N,24,,183074,34171,PSU
25,,SING,C4',H4',no,N,25,,183074,34171,PSU
26,,SING,O3',HO3',no,N,26,,183074,34171,PSU
27,,SING,C5',O5',no,N,27,,183074,34171,PSU
28,,SING,C5',H5',no,N,28,,183074,34171,PSU
29,,SING,C5',H5'',no,N,29,,183074,34171,PSU
30,,SING,O5',P,no,N,30,,183074,34171,PSU
31,,DOUB,P,OP1,no,N,31,,183074,34171,PSU
32,,SING,P,OP2,no,N,32,,183074,34171,PSU
33,,SING,P,OP3,no,N,33,,183074,34171,PSU
34,,SING,OP2,HOP2,no,N,34,,183074,34171,PSU
35,,SING,OP3,HOP3,no,N,35,,183074,34171,PSU
1,,SING,O5',C5',no,N,1,,183093,34172,GNG
2,,SING,O5',H5',no,N,2,,183093,34172,GNG
3,,SING,C5',C4',no,N,3,,183093,34172,GNG
4,,SING,C5',H5'1,no,N,4,,183093,34172,GNG
5,,SING,C5',H5'2,no,N,5,,183093,34172,GNG
6,,SING,C4',O4',no,N,6,,183093,34172,GNG
7,,SING,C4',C3',no,N,7,,183093,34172,GNG
8,,SING,C4',H4',no,N,8,,183093,34172,GNG
9,,SING,O4',C1',no,N,9,,183093,34172,GNG
10,,SING,C1',N9,no,N,10,,183093,34172,GNG
11,,SING,C1',C2',no,N,11,,183093,34172,GNG
12,,SING,C1',H1',no,N,12,,183093,34172,GNG
13,,SING,N9,C8,yes,N,13,,183093,34172,GNG
14,,SING,N9,C4,yes,N,14,,183093,34172,GNG
15,,DOUB,C8,N7,yes,N,15,,183093,34172,GNG
16,,SING,C8,H8,no,N,16,,183093,34172,GNG
17,,SING,N7,C5,yes,N,17,,183093,34172,GNG
18,,DOUB,C5,C4,yes,N,18,,183093,34172,GNG
19,,SING,C5,C6,no,N,19,,183093,34172,GNG
20,,SING,C4,N3,no,N,20,,183093,34172,GNG
21,,SING,N3,C2,no,N,21,,183093,34172,GNG
22,,SING,N3,HN3,no,N,22,,183093,34172,GNG
23,,DOUB,C2,N1,no,N,23,,183093,34172,GNG
24,,SING,C2,N2,no,N,24,,183093,34172,GNG
25,,SING,N1,C6,no,N,25,,183093,34172,GNG
26,,DOUB,C6,O6,no,N,26,,183093,34172,GNG
27,,SING,N2,HN21,no,N,27,,183093,34172,GNG
28,,SING,N2,HN22,no,N,28,,183093,34172,GNG
29,,SING,C2',C3',no,N,29,,183093,34172,GNG
30,,SING,C2',H2'1,no,N,30,,183093,34172,GNG
31,,SING,C2',H2'2,no,N,31,,183093,34172,GNG
32,,SING,C3',O3',no,N,32,,183093,34172,GNG
33,,SING,C3',H3',no,N,33,,183093,34172,GNG
34,,SING,O3',H1,no,N,34,,183093,34172,GNG
1,,SING,O3P,P,no,N,1,,183131,34174,GFL
2,,SING,O3P,HO3P,no,N,2,,183131,34174,GFL
3,,DOUB,P,O1P,no,N,3,,183131,34174,GFL
4,,SING,P,O2P,no,N,4,,183131,34174,GFL
5,,SING,P,O5',no,N,5,,183131,34174,GFL
6,,SING,O2P,HO2P,no,N,6,,183131,34174,GFL
7,,SING,O5',C5',no,N,7,,183131,34174,GFL
8,,SING,C5',C4',no,N,8,,183131,34174,GFL
9,,SING,C5',H5'1,no,N,9,,183131,34174,GFL
10,,SING,C5',H5'2,no,N,10,,183131,34174,GFL
11,,SING,C4',O4',no,N,11,,183131,34174,GFL
12,,SING,C4',C3',no,N,12,,183131,34174,GFL
13,,SING,C4',H4',no,N,13,,183131,34174,GFL
14,,SING,O4',C1',no,N,14,,183131,34174,GFL
15,,SING,C3',O3',no,N,15,,183131,34174,GFL
16,,SING,C3',C2',no,N,16,,183131,34174,GFL
17,,SING,C3',H3',no,N,17,,183131,34174,GFL
18,,SING,O3',HO3',no,N,18,,183131,34174,GFL
19,,SING,C2',C1',no,N,19,,183131,34174,GFL
20,,SING,C2',F,no,N,20,,183131,34174,GFL
21,,SING,C2',H2',no,N,21,,183131,34174,GFL
22,,SING,C1',N9,no,N,22,,183131,34174,GFL
23,,SING,C1',H1',no,N,23,,183131,34174,GFL
24,,SING,N9,C8,yes,N,24,,183131,34174,GFL
25,,SING,N9,C4,yes,N,25,,183131,34174,GFL
26,,DOUB,C8,N7,yes,N,26,,183131,34174,GFL
27,,SING,C8,H8,no,N,27,,183131,34174,GFL
28,,SING,N7,C5,yes,N,28,,183131,34174,GFL
29,,SING,C5,C6,no,N,29,,183131,34174,GFL
30,,DOUB,C5,C4,yes,N,30,,183131,34174,GFL
31,,DOUB,C6,O6,no,N,31,,183131,34174,GFL
32,,SING,C6,N1,no,N,32,,183131,34174,GFL
33,,SING,N1,C2,no,N,33,,183131,34174,GFL
34,,SING,N1,HN1,no,N,34,,183131,34174,GFL
35,,SING,C2,N2,no,N,35,,183131,34174,GFL
36,,DOUB,C2,N3,no,N,36,,183131,34174,GFL
37,,SING,N2,HN21,no,N,37,,183131,34174,GFL
38,,SING,N2,HN22,no,N,38,,183131,34174,GFL
39,,SING,N3,C4,no,N,39,,183131,34174,GFL
1,,SING,N,CA,no,N,1,,183275,34183,HYP
2,,SING,N,CD,no,N,2,,183275,34183,HYP
3,,SING,N,H,no,N,3,,183275,34183,HYP
4,,SING,CA,C,no,N,4,,183275,34183,HYP
5,,SING,CA,CB,no,N,5,,183275,34183,HYP
6,,SING,CA,HA,no,N,6,,183275,34183,HYP
7,,DOUB,C,O,no,N,7,,183275,34183,HYP
8,,SING,C,OXT,no,N,8,,183275,34183,HYP
9,,SING,CB,CG,no,N,9,,183275,34183,HYP
10,,SING,CB,HB2,no,N,10,,183275,34183,HYP
11,,SING,CB,HB3,no,N,11,,183275,34183,HYP
12,,SING,CG,CD,no,N,12,,183275,34183,HYP
13,,SING,CG,OD1,no,N,13,,183275,34183,HYP
14,,SING,CG,HG,no,N,14,,183275,34183,HYP
15,,SING,CD,HD22,no,N,15,,183275,34183,HYP
16,,SING,CD,HD23,no,N,16,,183275,34183,HYP
17,,SING,OD1,HD1,no,N,17,,183275,34183,HYP
18,,SING,OXT,HXT,no,N,18,,183275,34183,HYP
1,,DOUB,P,OP1,no,N,1,,183330,34186,BGM
2,,SING,P,OP2,no,N,2,,183330,34186,BGM
3,,SING,P,O5',no,N,3,,183330,34186,BGM
4,,SING,P,OP3,no,N,4,,183330,34186,BGM
5,,SING,OP2,HOP2,no,N,5,,183330,34186,BGM
6,,SING,O5',C5',no,N,6,,183330,34186,BGM
7,,SING,C5',C4',no,N,7,,183330,34186,BGM
8,,SING,C5',H5',no,N,8,,183330,34186,BGM
9,,SING,C5',H5'',no,N,9,,183330,34186,BGM
10,,SING,C4',O4',no,N,10,,183330,34186,BGM
11,,SING,C4',C3',no,N,11,,183330,34186,BGM
12,,SING,C4',H4',no,N,12,,183330,34186,BGM
13,,SING,O4',C1',no,N,13,,183330,34186,BGM
14,,SING,C1',N9,no,N,14,,183330,34186,BGM
15,,SING,C1',C2',no,N,15,,183330,34186,BGM
16,,SING,C1',H1',no,N,16,,183330,34186,BGM
17,,SING,N9,C8,yes,N,17,,183330,34186,BGM
18,,SING,N9,C4,yes,N,18,,183330,34186,BGM
19,,DOUB,C8,N7,yes,N,19,,183330,34186,BGM
20,,SING,C8,BR,no,N,20,,183330,34186,BGM
21,,SING,N7,C5,yes,N,21,,183330,34186,BGM
22,,DOUB,C5,C4,yes,N,22,,183330,34186,BGM
23,,SING,C5,C6,no,N,23,,183330,34186,BGM
24,,SING,C4,N3,no,N,24,,183330,34186,BGM
25,,DOUB,N3,C2,no,N,25,,183330,34186,BGM
26,,SING,C2,N2,no,N,26,,183330,34186,BGM
27,,SING,C2,N1,no,N,27,,183330,34186,BGM
28,,SING,N2,H21,no,N,28,,183330,34186,BGM
29,,SING,N2,H22,no,N,29,,183330,34186,BGM
30,,SING,N1,C6,no,N,30,,183330,34186,BGM
31,,SING,N1,H1,no,N,31,,183330,34186,BGM
32,,DOUB,C6,O6,no,N,32,,183330,34186,BGM
33,,SING,C2',C3',no,N,33,,183330,34186,BGM
34,,SING,C2',H2',no,N,34,,183330,34186,BGM
35,,SING,C2',H2'',no,N,35,,183330,34186,BGM
36,,SING,C3',O3',no,N,36,,183330,34186,BGM
37,,SING,C3',H3',no,N,37,,183330,34186,BGM
38,,SING,O3',HO3',no,N,38,,183330,34186,BGM
39,,SING,OP3,HOP3,no,N,39,,183330,34186,BGM
1,,DOUB,O3P,P,no,N,1,,183562,34199,U37
2,,SING,P,S,no,N,2,,183562,34199,U37
3,,SING,P,O1P,no,N,3,,183562,34199,U37
4,,SING,P,O5',no,N,4,,183562,34199,U37
5,,SING,S,HS,no,N,5,,183562,34199,U37
6,,SING,O1P,H1P,no,N,6,,183562,34199,U37
7,,SING,O5',C5',no,N,7,,183562,34199,U37
8,,SING,C5',C4',no,N,8,,183562,34199,U37
9,,SING,C5',H5'1,no,N,9,,183562,34199,U37
10,,SING,C5',H5'2,no,N,10,,183562,34199,U37
11,,SING,C4',O4',no,N,11,,183562,34199,U37
12,,SING,C4',C3',no,N,12,,183562,34199,U37
13,,SING,C4',H4',no,N,13,,183562,34199,U37
14,,SING,O4',C1',no,N,14,,183562,34199,U37
15,,SING,C3',O3',no,N,15,,183562,34199,U37
16,,SING,C3',C2',no,N,16,,183562,34199,U37
17,,SING,C3',H3',no,N,17,,183562,34199,U37
18,,SING,O3',HA,no,N,18,,183562,34199,U37
19,,SING,C2',O2',no,N,19,,183562,34199,U37
20,,SING,C2',C1',no,N,20,,183562,34199,U37
21,,SING,C2',H2',no,N,21,,183562,34199,U37
22,,SING,O2',HB,no,N,22,,183562,34199,U37
23,,SING,C1',N1,no,N,23,,183562,34199,U37
24,,SING,C1',H1',no,N,24,,183562,34199,U37
25,,SING,N1,C2,no,N,25,,183562,34199,U37
26,,SING,N1,C6,no,N,26,,183562,34199,U37
27,,DOUB,C2,O2,no,N,27,,183562,34199,U37
28,,SING,C2,N3,no,N,28,,183562,34199,U37
29,,SING,N3,C4,no,N,29,,183562,34199,U37
30,,SING,N3,H3,no,N,30,,183562,34199,U37
31,,DOUB,C4,O4,no,N,31,,183562,34199,U37
32,,SING,C4,C5,no,N,32,,183562,34199,U37
33,,DOUB,C5,C6,no,N,33,,183562,34199,U37
34,,SING,C5,H5,no,N,34,,183562,34199,U37
35,,SING,C6,H6,no,N,35,,183562,34199,U37
1,,SING,O3P,P,no,N,1,,183755,34210,GFL
2,,SING,O3P,HO3P,no,N,2,,183755,34210,GFL
3,,DOUB,P,O1P,no,N,3,,183755,34210,GFL
4,,SING,P,O2P,no,N,4,,183755,34210,GFL
5,,SING,P,O5',no,N,5,,183755,34210,GFL
6,,SING,O2P,HO2P,no,N,6,,183755,34210,GFL
7,,SING,O5',C5',no,N,7,,183755,34210,GFL
8,,SING,C5',C4',no,N,8,,183755,34210,GFL
9,,SING,C5',H5'1,no,N,9,,183755,34210,GFL
10,,SING,C5',H5'2,no,N,10,,183755,34210,GFL
11,,SING,C4',O4',no,N,11,,183755,34210,GFL
12,,SING,C4',C3',no,N,12,,183755,34210,GFL
13,,SING,C4',H4',no,N,13,,183755,34210,GFL
14,,SING,O4',C1',no,N,14,,183755,34210,GFL
15,,SING,C3',O3',no,N,15,,183755,34210,GFL
16,,SING,C3',C2',no,N,16,,183755,34210,GFL
17,,SING,C3',H3',no,N,17,,183755,34210,GFL
18,,SING,O3',HO3',no,N,18,,183755,34210,GFL
19,,SING,C2',C1',no,N,19,,183755,34210,GFL
20,,SING,C2',F,no,N,20,,183755,34210,GFL
21,,SING,C2',H2',no,N,21,,183755,34210,GFL
22,,SING,C1',N9,no,N,22,,183755,34210,GFL
23,,SING,C1',H1',no,N,23,,183755,34210,GFL
24,,SING,N9,C8,yes,N,24,,183755,34210,GFL
25,,SING,N9,C4,yes,N,25,,183755,34210,GFL
26,,DOUB,C8,N7,yes,N,26,,183755,34210,GFL
27,,SING,C8,H8,no,N,27,,183755,34210,GFL
28,,SING,N7,C5,yes,N,28,,183755,34210,GFL
29,,SING,C5,C6,no,N,29,,183755,34210,GFL
30,,DOUB,C5,C4,yes,N,30,,183755,34210,GFL
31,,DOUB,C6,O6,no,N,31,,183755,34210,GFL
32,,SING,C6,N1,no,N,32,,183755,34210,GFL
33,,SING,N1,C2,no,N,33,,183755,34210,GFL
34,,SING,N1,HN1,no,N,34,,183755,34210,GFL
35,,SING,C2,N2,no,N,35,,183755,34210,GFL
36,,DOUB,C2,N3,no,N,36,,183755,34210,GFL
37,,SING,N2,HN21,no,N,37,,183755,34210,GFL
38,,SING,N2,HN22,no,N,38,,183755,34210,GFL
39,,SING,N3,C4,no,N,39,,183755,34210,GFL
1,,SING,C,CA,no,N,1,,183823,34213,MK8
2,,SING,C,OXT,no,N,2,,183823,34213,MK8
3,,SING,N,HN,no,N,3,,183823,34213,MK8
4,,SING,N,HNA,no,N,4,,183823,34213,MK8
5,,DOUB,O,C,no,N,5,,183823,34213,MK8
6,,SING,CA,N,no,N,6,,183823,34213,MK8
7,,SING,CA,CB,no,N,7,,183823,34213,MK8
8,,SING,CB,HB,no,N,8,,183823,34213,MK8
9,,SING,CB,HBA,no,N,9,,183823,34213,MK8
10,,SING,CD,CG,no,N,10,,183823,34213,MK8
11,,SING,CD,HD,no,N,11,,183823,34213,MK8
12,,SING,CD,HDA,no,N,12,,183823,34213,MK8
13,,SING,CE,CD,no,N,13,,183823,34213,MK8
14,,SING,CE,HE,no,N,14,,183823,34213,MK8
15,,SING,CE,HEA,no,N,15,,183823,34213,MK8
16,,SING,CE,HEB,no,N,16,,183823,34213,MK8
17,,SING,CG,CB,no,N,17,,183823,34213,MK8
18,,SING,CG,HG,no,N,18,,183823,34213,MK8
19,,SING,CG,HGA,no,N,19,,183823,34213,MK8
20,,SING,CB1,CA,no,N,20,,183823,34213,MK8
21,,SING,CB1,HB1,no,N,21,,183823,34213,MK8
22,,SING,CB1,HB1A,no,N,22,,183823,34213,MK8
23,,SING,CB1,HB1B,no,N,23,,183823,34213,MK8
24,,SING,OXT,HXT,no,N,24,,183823,34213,MK8
1,,SING,N,HN1,no,N,1,,183824,34213,NH2
2,,SING,N,HN2,no,N,2,,183824,34213,NH2
1,,DOUB,C,O,no,N,1,,183825,34213,ACE
2,,SING,C,CH3,no,N,2,,183825,34213,ACE
3,,SING,C,H,no,N,3,,183825,34213,ACE
4,,SING,CH3,H1,no,N,4,,183825,34213,ACE
5,,SING,CH3,H2,no,N,5,,183825,34213,ACE
6,,SING,CH3,H3,no,N,6,,183825,34213,ACE
1,,SING,C,CA,no,N,1,,183843,34214,MK8
2,,SING,C,OXT,no,N,2,,183843,34214,MK8
3,,SING,N,HN,no,N,3,,183843,34214,MK8
4,,SING,N,HNA,no,N,4,,183843,34214,MK8
5,,DOUB,O,C,no,N,5,,183843,34214,MK8
6,,SING,CA,N,no,N,6,,183843,34214,MK8
7,,SING,CA,CB,no,N,7,,183843,34214,MK8
8,,SING,CB,HB,no,N,8,,183843,34214,MK8
9,,SING,CB,HBA,no,N,9,,183843,34214,MK8
10,,SING,CD,CG,no,N,10,,183843,34214,MK8
11,,SING,CD,HD,no,N,11,,183843,34214,MK8
12,,SING,CD,HDA,no,N,12,,183843,34214,MK8
13,,SING,CE,CD,no,N,13,,183843,34214,MK8
14,,SING,CE,HE,no,N,14,,183843,34214,MK8
15,,SING,CE,HEA,no,N,15,,183843,34214,MK8
16,,SING,CE,HEB,no,N,16,,183843,34214,MK8
17,,SING,CG,CB,no,N,17,,183843,34214,MK8
18,,SING,CG,HG,no,N,18,,183843,34214,MK8
19,,SING,CG,HGA,no,N,19,,183843,34214,MK8
20,,SING,CB1,CA,no,N,20,,183843,34214,MK8
21,,SING,CB1,HB1,no,N,21,,183843,34214,MK8
22,,SING,CB1,HB1A,no,N,22,,183843,34214,MK8
23,,SING,CB1,HB1B,no,N,23,,183843,34214,MK8
24,,SING,OXT,HXT,no,N,24,,183843,34214,MK8
1,,SING,N,HN1,no,N,1,,183844,34214,NH2
2,,SING,N,HN2,no,N,2,,183844,34214,NH2
1,,DOUB,C,O,no,N,1,,183845,34214,ACE
2,,SING,C,CH3,no,N,2,,183845,34214,ACE
3,,SING,C,H,no,N,3,,183845,34214,ACE
4,,SING,CH3,H1,no,N,4,,183845,34214,ACE
5,,SING,CH3,H2,no,N,5,,183845,34214,ACE
6,,SING,CH3,H3,no,N,6,,183845,34214,ACE
1,,SING,C,CA,no,N,1,,183863,34215,MK8
2,,SING,C,OXT,no,N,2,,183863,34215,MK8
3,,SING,N,HN,no,N,3,,183863,34215,MK8
4,,SING,N,HNA,no,N,4,,183863,34215,MK8
5,,DOUB,O,C,no,N,5,,183863,34215,MK8
6,,SING,CA,N,no,N,6,,183863,34215,MK8
7,,SING,CA,CB,no,N,7,,183863,34215,MK8
8,,SING,CB,HB,no,N,8,,183863,34215,MK8
9,,SING,CB,HBA,no,N,9,,183863,34215,MK8
10,,SING,CD,CG,no,N,10,,183863,34215,MK8
11,,SING,CD,HD,no,N,11,,183863,34215,MK8
12,,SING,CD,HDA,no,N,12,,183863,34215,MK8
13,,SING,CE,CD,no,N,13,,183863,34215,MK8
14,,SING,CE,HE,no,N,14,,183863,34215,MK8
15,,SING,CE,HEA,no,N,15,,183863,34215,MK8
16,,SING,CE,HEB,no,N,16,,183863,34215,MK8
17,,SING,CG,CB,no,N,17,,183863,34215,MK8
18,,SING,CG,HG,no,N,18,,183863,34215,MK8
19,,SING,CG,HGA,no,N,19,,183863,34215,MK8
20,,SING,CB1,CA,no,N,20,,183863,34215,MK8
21,,SING,CB1,HB1,no,N,21,,183863,34215,MK8
22,,SING,CB1,HB1A,no,N,22,,183863,34215,MK8
23,,SING,CB1,HB1B,no,N,23,,183863,34215,MK8
24,,SING,OXT,HXT,no,N,24,,183863,34215,MK8
1,,SING,N,HN1,no,N,1,,183864,34215,NH2
2,,SING,N,HN2,no,N,2,,183864,34215,NH2
1,,DOUB,C,O,no,N,1,,183865,34215,ACE
2,,SING,C,CH3,no,N,2,,183865,34215,ACE
3,,SING,C,H,no,N,3,,183865,34215,ACE
4,,SING,CH3,H1,no,N,4,,183865,34215,ACE
5,,SING,CH3,H2,no,N,5,,183865,34215,ACE
6,,SING,CH3,H3,no,N,6,,183865,34215,ACE
1,,DOUB,C11,C12,yes,N,1,,183987,34221,D5B
2,,SING,C11,C8,yes,N,2,,183987,34221,D5B
3,,SING,N2,C16,no,N,3,,183987,34221,D5B
4,,SING,C12,C13,yes,N,4,,183987,34221,D5B
5,,DOUB,C7,C8,yes,N,5,,183987,34221,D5B
6,,SING,C7,C4,yes,N,6,,183987,34221,D5B
7,,SING,C8,C9,yes,N,7,,183987,34221,D5B
8,,DOUB,C13,C14,yes,N,8,,183987,34221,D5B
9,,DOUB,C4,C3,yes,N,9,,183987,34221,D5B
10,,SING,C4,C5,yes,N,10,,183987,34221,D5B
11,,SING,C3,C2,yes,N,11,,183987,34221,D5B
12,,SING,C9,C14,yes,N,12,,183987,34221,D5B
13,,DOUB,C9,C10,yes,N,13,,183987,34221,D5B
14,,SING,C14,C16,no,N,14,,183987,34221,D5B
15,,SING,C5,C10,yes,N,15,,183987,34221,D5B
16,,DOUB,C5,C6,yes,N,16,,183987,34221,D5B
17,,DOUB,C2,C1,yes,N,17,,183987,34221,D5B
18,,SING,C6,C1,yes,N,18,,183987,34221,D5B
19,,SING,C6,C15,no,N,19,,183987,34221,D5B
20,,SING,C15,N1,no,N,20,,183987,34221,D5B
21,,SING,C1,H1,no,N,21,,183987,34221,D5B
22,,SING,C2,H2,no,N,22,,183987,34221,D5B
23,,SING,C3,H3,no,N,23,,183987,34221,D5B
24,,SING,C7,H7,no,N,24,,183987,34221,D5B
25,,SING,C11,1H1,no,N,25,,183987,34221,D5B
26,,SING,C12,2H1,no,N,26,,183987,34221,D5B
27,,SING,C13,3H1,no,N,27,,183987,34221,D5B
28,,SING,N1,3HN1,no,N,28,,183987,34221,D5B
29,,SING,N1,2HN1,no,N,29,,183987,34221,D5B
30,,SING,N2,1HN2,no,N,30,,183987,34221,D5B
31,,SING,N2,3HN2,no,N,31,,183987,34221,D5B
32,,SING,C10,H10,no,N,32,,183987,34221,D5B
33,,SING,C15,1H15,no,N,33,,183987,34221,D5B
34,,SING,C15,2H15,no,N,34,,183987,34221,D5B
35,,SING,C16,1H16,no,N,35,,183987,34221,D5B
36,,SING,C16,2H16,no,N,36,,183987,34221,D5B
1,,SING,N,CA,no,N,1,,184006,34222,DPN
2,,SING,N,H,no,N,2,,184006,34222,DPN
3,,SING,N,H2,no,N,3,,184006,34222,DPN
4,,SING,CA,C,no,N,4,,184006,34222,DPN
5,,SING,CA,CB,no,N,5,,184006,34222,DPN
6,,SING,CA,HA,no,N,6,,184006,34222,DPN
7,,DOUB,C,O,no,N,7,,184006,34222,DPN
8,,SING,C,OXT,no,N,8,,184006,34222,DPN
9,,SING,OXT,HXT,no,N,9,,184006,34222,DPN
10,,SING,CB,CG,no,N,10,,184006,34222,DPN
11,,SING,CB,HB2,no,N,11,,184006,34222,DPN
12,,SING,CB,HB3,no,N,12,,184006,34222,DPN
13,,DOUB,CG,CD1,yes,N,13,,184006,34222,DPN
14,,SING,CG,CD2,yes,N,14,,184006,34222,DPN
15,,SING,CD1,CE1,yes,N,15,,184006,34222,DPN
16,,SING,CD1,HD1,no,N,16,,184006,34222,DPN
17,,DOUB,CD2,CE2,yes,N,17,,184006,34222,DPN
18,,SING,CD2,HD2,no,N,18,,184006,34222,DPN
19,,DOUB,CE1,CZ,yes,N,19,,184006,34222,DPN
20,,SING,CE1,HE1,no,N,20,,184006,34222,DPN
21,,SING,CE2,CZ,yes,N,21,,184006,34222,DPN
22,,SING,CE2,HE2,no,N,22,,184006,34222,DPN
23,,SING,CZ,HZ,no,N,23,,184006,34222,DPN
1,,SING,N,CA,no,N,1,,184007,34222,AC5
2,,SING,N,H,no,N,2,,184007,34222,AC5
3,,SING,N,HN2,no,N,3,,184007,34222,AC5
4,,DOUB,O,C,no,N,4,,184007,34222,AC5
5,,SING,CA,C,no,N,5,,184007,34222,AC5
6,,SING,CA,CB1,no,N,6,,184007,34222,AC5
7,,SING,CA,CB2,no,N,7,,184007,34222,AC5
8,,SING,C,OXT,no,N,8,,184007,34222,AC5
9,,SING,CB1,CG1,no,N,9,,184007,34222,AC5
10,,SING,CB1,HB11,no,N,10,,184007,34222,AC5
11,,SING,CB1,HB12,no,N,11,,184007,34222,AC5
12,,SING,CB2,CG2,no,N,12,,184007,34222,AC5
13,,SING,CB2,HB21,no,N,13,,184007,34222,AC5
14,,SING,CB2,HB22,no,N,14,,184007,34222,AC5
15,,SING,OXT,HXT,no,N,15,,184007,34222,AC5
16,,SING,CG1,CG2,no,N,16,,184007,34222,AC5
17,,SING,CG1,HG11,no,N,17,,184007,34222,AC5
18,,SING,CG1,HG12,no,N,18,,184007,34222,AC5
19,,SING,CG2,HG21,no,N,19,,184007,34222,AC5
20,,SING,CG2,HG22,no,N,20,,184007,34222,AC5
1,,SING,N,HN1,no,N,1,,184008,34222,NH2
2,,SING,N,HN2,no,N,2,,184008,34222,NH2
1,,SING,N,CA,no,N,1,,184197,34232,TYS
2,,SING,N,H,no,N,2,,184197,34232,TYS
3,,SING,N,HN2,no,N,3,,184197,34232,TYS
4,,SING,CA,CB,no,N,4,,184197,34232,TYS
5,,SING,CA,C,no,N,5,,184197,34232,TYS
6,,SING,CA,HA,no,N,6,,184197,34232,TYS
7,,SING,CB,CG,no,N,7,,184197,34232,TYS
8,,SING,CB,HB2,no,N,8,,184197,34232,TYS
9,,SING,CB,HB3,no,N,9,,184197,34232,TYS
10,,DOUB,CG,CD1,yes,N,10,,184197,34232,TYS
11,,SING,CG,CD2,yes,N,11,,184197,34232,TYS
12,,SING,CD1,CE1,yes,N,12,,184197,34232,TYS
13,,SING,CD1,HD1,no,N,13,,184197,34232,TYS
14,,DOUB,CD2,CE2,yes,N,14,,184197,34232,TYS
15,,SING,CD2,HD2,no,N,15,,184197,34232,TYS
16,,DOUB,CE1,CZ,yes,N,16,,184197,34232,TYS
17,,SING,CE1,HE1,no,N,17,,184197,34232,TYS
18,,SING,CE2,CZ,yes,N,18,,184197,34232,TYS
19,,SING,CE2,HE2,no,N,19,,184197,34232,TYS
20,,SING,CZ,OH,no,N,20,,184197,34232,TYS
21,,SING,OH,S,no,N,21,,184197,34232,TYS
22,,DOUB,S,O1,no,N,22,,184197,34232,TYS
23,,DOUB,S,O2,no,N,23,,184197,34232,TYS
24,,SING,S,O3,no,N,24,,184197,34232,TYS
25,,SING,O3,HO3,no,N,25,,184197,34232,TYS
26,,DOUB,C,O,no,N,26,,184197,34232,TYS
27,,SING,C,OXT,no,N,27,,184197,34232,TYS
28,,SING,OXT,HXT,no,N,28,,184197,34232,TYS
1,,SING,O,H1,no,N,1,,184350,34240,HOH
2,,SING,O,H2,no,N,2,,184350,34240,HOH
1,,DOUB,O34,C33,no,N,1,,184820,34264,EVT
2,,SING,C33,C35,no,N,2,,184820,34264,EVT
3,,SING,C35,C36,no,N,3,,184820,34264,EVT
4,,SING,C36,C37,no,N,4,,184820,34264,EVT
5,,DOUB,O24,C23,no,N,5,,184820,34264,EVT
6,,SING,C12,C13,no,N,6,,184820,34264,EVT
7,,SING,C12,C26,no,N,7,,184820,34264,EVT
8,,SING,N25,C26,no,N,8,,184820,34264,EVT
9,,SING,N25,C11,no,N,9,,184820,34264,EVT
10,,SING,C14,C13,no,N,10,,184820,34264,EVT
11,,SING,C14,C15,no,N,11,,184820,34264,EVT
12,,SING,C37,N6,no,N,12,,184820,34264,EVT
13,,SING,C37,C38,no,N,13,,184820,34264,EVT
14,,DOUB,C26,O27,no,N,14,,184820,34264,EVT
15,,SING,C10,C11,no,N,15,,184820,34264,EVT
16,,SING,C10,C9,no,N,16,,184820,34264,EVT
17,,SING,N6,C7,no,N,17,,184820,34264,EVT
18,,SING,C23,C11,no,N,18,,184820,34264,EVT
19,,SING,C23,O26,no,N,19,,184820,34264,EVT
20,,SING,C15,C16,no,N,20,,184820,34264,EVT
21,,SING,C16,C17,no,N,21,,184820,34264,EVT
22,,SING,C7,C9,no,N,22,,184820,34264,EVT
23,,DOUB,C7,O8,no,N,23,,184820,34264,EVT
24,,SING,C17,C18,no,N,24,,184820,34264,EVT
25,,SING,C18,C19,no,N,25,,184820,34264,EVT
26,,DOUB,C38,O40,no,N,26,,184820,34264,EVT
27,,SING,C38,O39,no,N,27,,184820,34264,EVT
28,,SING,C19,C20,no,N,28,,184820,34264,EVT
29,,SING,C20,C21,no,N,29,,184820,34264,EVT
30,,SING,C21,C22,no,N,30,,184820,34264,EVT
31,,SING,C22,C29,no,N,31,,184820,34264,EVT
32,,SING,C29,C30,no,N,32,,184820,34264,EVT
33,,SING,C30,C31,no,N,33,,184820,34264,EVT
34,,SING,C31,C32,no,N,34,,184820,34264,EVT
35,,SING,C9,H93,no,N,35,,184820,34264,EVT
36,,SING,C9,H92,no,N,36,,184820,34264,EVT
37,,SING,C10,H103,no,N,37,,184820,34264,EVT
38,,SING,C10,H102,no,N,38,,184820,34264,EVT
39,,SING,C11,H11,no,N,39,,184820,34264,EVT
40,,SING,C12,H122,no,N,40,,184820,34264,EVT
41,,SING,C12,H123,no,N,41,,184820,34264,EVT
42,,SING,C13,H133,no,N,42,,184820,34264,EVT
43,,SING,C13,H132,no,N,43,,184820,34264,EVT
44,,SING,C14,H143,no,N,44,,184820,34264,EVT
45,,SING,C14,H142,no,N,45,,184820,34264,EVT
46,,SING,C15,H153,no,N,46,,184820,34264,EVT
47,,SING,C15,H152,no,N,47,,184820,34264,EVT
48,,SING,N6,H6,no,N,48,,184820,34264,EVT
49,,SING,C16,H163,no,N,49,,184820,34264,EVT
50,,SING,C16,H162,no,N,50,,184820,34264,EVT
51,,SING,C17,H173,no,N,51,,184820,34264,EVT
52,,SING,C17,H172,no,N,52,,184820,34264,EVT
53,,SING,C18,H183,no,N,53,,184820,34264,EVT
54,,SING,C18,H182,no,N,54,,184820,34264,EVT
55,,SING,C19,H193,no,N,55,,184820,34264,EVT
56,,SING,C19,H192,no,N,56,,184820,34264,EVT
57,,SING,C20,H203,no,N,57,,184820,34264,EVT
58,,SING,C20,H202,no,N,58,,184820,34264,EVT
59,,SING,C21,H213,no,N,59,,184820,34264,EVT
60,,SING,C21,H212,no,N,60,,184820,34264,EVT
61,,SING,C22,H223,no,N,61,,184820,34264,EVT
62,,SING,C22,H222,no,N,62,,184820,34264,EVT
63,,SING,N25,H25,no,N,63,,184820,34264,EVT
64,,SING,O26,H1,no,N,64,,184820,34264,EVT
65,,SING,C29,H293,no,N,65,,184820,34264,EVT
66,,SING,C29,H292,no,N,66,,184820,34264,EVT
67,,SING,C30,H303,no,N,67,,184820,34264,EVT
68,,SING,C30,H302,no,N,68,,184820,34264,EVT
69,,SING,C31,H313,no,N,69,,184820,34264,EVT
70,,SING,C31,H312,no,N,70,,184820,34264,EVT
71,,SING,C32,H321,no,N,71,,184820,34264,EVT
72,,SING,C32,H323,no,N,72,,184820,34264,EVT
73,,SING,C32,H322,no,N,73,,184820,34264,EVT
74,,SING,C35,H353,no,N,74,,184820,34264,EVT
75,,SING,C35,H352,no,N,75,,184820,34264,EVT
76,,SING,C36,H363,no,N,76,,184820,34264,EVT
77,,SING,C36,H362,no,N,77,,184820,34264,EVT
78,,SING,C37,H37,no,N,78,,184820,34264,EVT
79,,SING,O39,H3,no,N,79,,184820,34264,EVT
80,,SING,C33,OXT,no,N,80,,184820,34264,EVT
81,,SING,OXT,H2,no,N,81,,184820,34264,EVT
1,,SING,N,CA,no,N,1,,184821,34264,AIB
2,,SING,N,H,no,N,2,,184821,34264,AIB
3,,SING,N,H2,no,N,3,,184821,34264,AIB
4,,SING,CA,C,no,N,4,,184821,34264,AIB
5,,SING,CA,CB1,no,N,5,,184821,34264,AIB
6,,SING,CA,CB2,no,N,6,,184821,34264,AIB
7,,DOUB,C,O,no,N,7,,184821,34264,AIB
8,,SING,C,OXT,no,N,8,,184821,34264,AIB
9,,SING,OXT,HO2,no,N,9,,184821,34264,AIB
10,,SING,CB1,HB11,no,N,10,,184821,34264,AIB
11,,SING,CB1,HB12,no,N,11,,184821,34264,AIB
12,,SING,CB1,HB13,no,N,12,,184821,34264,AIB
13,,SING,CB2,HB21,no,N,13,,184821,34264,AIB
14,,SING,CB2,HB22,no,N,14,,184821,34264,AIB
15,,SING,CB2,HB23,no,N,15,,184821,34264,AIB
1,,SING,N,HN1,no,N,1,,184822,34264,NH2
2,,SING,N,HN2,no,N,2,,184822,34264,NH2
1,,DOUB,O34,C33,no,N,1,,184862,34266,EVT
2,,SING,C33,C35,no,N,2,,184862,34266,EVT
3,,SING,C35,C36,no,N,3,,184862,34266,EVT
4,,SING,C36,C37,no,N,4,,184862,34266,EVT
5,,DOUB,O24,C23,no,N,5,,184862,34266,EVT
6,,SING,C12,C13,no,N,6,,184862,34266,EVT
7,,SING,C12,C26,no,N,7,,184862,34266,EVT
8,,SING,N25,C26,no,N,8,,184862,34266,EVT
9,,SING,N25,C11,no,N,9,,184862,34266,EVT
10,,SING,C14,C13,no,N,10,,184862,34266,EVT
11,,SING,C14,C15,no,N,11,,184862,34266,EVT
12,,SING,C37,N6,no,N,12,,184862,34266,EVT
13,,SING,C37,C38,no,N,13,,184862,34266,EVT
14,,DOUB,C26,O27,no,N,14,,184862,34266,EVT
15,,SING,C10,C11,no,N,15,,184862,34266,EVT
16,,SING,C10,C9,no,N,16,,184862,34266,EVT
17,,SING,N6,C7,no,N,17,,184862,34266,EVT
18,,SING,C23,C11,no,N,18,,184862,34266,EVT
19,,SING,C23,O26,no,N,19,,184862,34266,EVT
20,,SING,C15,C16,no,N,20,,184862,34266,EVT
21,,SING,C16,C17,no,N,21,,184862,34266,EVT
22,,SING,C7,C9,no,N,22,,184862,34266,EVT
23,,DOUB,C7,O8,no,N,23,,184862,34266,EVT
24,,SING,C17,C18,no,N,24,,184862,34266,EVT
25,,SING,C18,C19,no,N,25,,184862,34266,EVT
26,,DOUB,C38,O40,no,N,26,,184862,34266,EVT
27,,SING,C38,O39,no,N,27,,184862,34266,EVT
28,,SING,C19,C20,no,N,28,,184862,34266,EVT
29,,SING,C20,C21,no,N,29,,184862,34266,EVT
30,,SING,C21,C22,no,N,30,,184862,34266,EVT
31,,SING,C22,C29,no,N,31,,184862,34266,EVT
32,,SING,C29,C30,no,N,32,,184862,34266,EVT
33,,SING,C30,C31,no,N,33,,184862,34266,EVT
34,,SING,C31,C32,no,N,34,,184862,34266,EVT
35,,SING,C9,H93,no,N,35,,184862,34266,EVT
36,,SING,C9,H92,no,N,36,,184862,34266,EVT
37,,SING,C10,H103,no,N,37,,184862,34266,EVT
38,,SING,C10,H102,no,N,38,,184862,34266,EVT
39,,SING,C11,H11,no,N,39,,184862,34266,EVT
40,,SING,C12,H122,no,N,40,,184862,34266,EVT
41,,SING,C12,H123,no,N,41,,184862,34266,EVT
42,,SING,C13,H133,no,N,42,,184862,34266,EVT
43,,SING,C13,H132,no,N,43,,184862,34266,EVT
44,,SING,C14,H143,no,N,44,,184862,34266,EVT
45,,SING,C14,H142,no,N,45,,184862,34266,EVT
46,,SING,C15,H153,no,N,46,,184862,34266,EVT
47,,SING,C15,H152,no,N,47,,184862,34266,EVT
48,,SING,N6,H6,no,N,48,,184862,34266,EVT
49,,SING,C16,H163,no,N,49,,184862,34266,EVT
50,,SING,C16,H162,no,N,50,,184862,34266,EVT
51,,SING,C17,H173,no,N,51,,184862,34266,EVT
52,,SING,C17,H172,no,N,52,,184862,34266,EVT
53,,SING,C18,H183,no,N,53,,184862,34266,EVT
54,,SING,C18,H182,no,N,54,,184862,34266,EVT
55,,SING,C19,H193,no,N,55,,184862,34266,EVT
56,,SING,C19,H192,no,N,56,,184862,34266,EVT
57,,SING,C20,H203,no,N,57,,184862,34266,EVT
58,,SING,C20,H202,no,N,58,,184862,34266,EVT
59,,SING,C21,H213,no,N,59,,184862,34266,EVT
60,,SING,C21,H212,no,N,60,,184862,34266,EVT
61,,SING,C22,H223,no,N,61,,184862,34266,EVT
62,,SING,C22,H222,no,N,62,,184862,34266,EVT
63,,SING,N25,H25,no,N,63,,184862,34266,EVT
64,,SING,O26,H1,no,N,64,,184862,34266,EVT
65,,SING,C29,H293,no,N,65,,184862,34266,EVT
66,,SING,C29,H292,no,N,66,,184862,34266,EVT
67,,SING,C30,H303,no,N,67,,184862,34266,EVT
68,,SING,C30,H302,no,N,68,,184862,34266,EVT
69,,SING,C31,H313,no,N,69,,184862,34266,EVT
70,,SING,C31,H312,no,N,70,,184862,34266,EVT
71,,SING,C32,H321,no,N,71,,184862,34266,EVT
72,,SING,C32,H323,no,N,72,,184862,34266,EVT
73,,SING,C32,H322,no,N,73,,184862,34266,EVT
74,,SING,C35,H353,no,N,74,,184862,34266,EVT
75,,SING,C35,H352,no,N,75,,184862,34266,EVT
76,,SING,C36,H363,no,N,76,,184862,34266,EVT
77,,SING,C36,H362,no,N,77,,184862,34266,EVT
78,,SING,C37,H37,no,N,78,,184862,34266,EVT
79,,SING,O39,H3,no,N,79,,184862,34266,EVT
80,,SING,C33,OXT,no,N,80,,184862,34266,EVT
81,,SING,OXT,H2,no,N,81,,184862,34266,EVT
1,,SING,N,CA,no,N,1,,184863,34266,AIB
2,,SING,N,H,no,N,2,,184863,34266,AIB
3,,SING,N,H2,no,N,3,,184863,34266,AIB
4,,SING,CA,C,no,N,4,,184863,34266,AIB
5,,SING,CA,CB1,no,N,5,,184863,34266,AIB
6,,SING,CA,CB2,no,N,6,,184863,34266,AIB
7,,DOUB,C,O,no,N,7,,184863,34266,AIB
8,,SING,C,OXT,no,N,8,,184863,34266,AIB
9,,SING,OXT,HO2,no,N,9,,184863,34266,AIB
10,,SING,CB1,HB11,no,N,10,,184863,34266,AIB
11,,SING,CB1,HB12,no,N,11,,184863,34266,AIB
12,,SING,CB1,HB13,no,N,12,,184863,34266,AIB
13,,SING,CB2,HB21,no,N,13,,184863,34266,AIB
14,,SING,CB2,HB22,no,N,14,,184863,34266,AIB
15,,SING,CB2,HB23,no,N,15,,184863,34266,AIB
1,,SING,N,HN1,no,N,1,,184864,34266,NH2
2,,SING,N,HN2,no,N,2,,184864,34266,NH2
1,,SING,N,HN1,no,N,1,,184882,34267,NH2
2,,SING,N,HN2,no,N,2,,184882,34267,NH2
1,,SING,N,CA,no,N,1,,184899,34268,PCA
2,,SING,N,CD,no,N,2,,184899,34268,PCA
3,,SING,N,H,no,N,3,,184899,34268,PCA
4,,SING,CA,CB,no,N,4,,184899,34268,PCA
5,,SING,CA,C,no,N,5,,184899,34268,PCA
6,,SING,CA,HA,no,N,6,,184899,34268,PCA
7,,SING,CB,CG,no,N,7,,184899,34268,PCA
8,,SING,CB,HB2,no,N,8,,184899,34268,PCA
9,,SING,CB,HB3,no,N,9,,184899,34268,PCA
10,,SING,CG,CD,no,N,10,,184899,34268,PCA
11,,SING,CG,HG2,no,N,11,,184899,34268,PCA
12,,SING,CG,HG3,no,N,12,,184899,34268,PCA
13,,DOUB,CD,OE,no,N,13,,184899,34268,PCA
14,,DOUB,C,O,no,N,14,,184899,34268,PCA
15,,SING,C,OXT,no,N,15,,184899,34268,PCA
16,,SING,OXT,HXT,no,N,16,,184899,34268,PCA
1,,DOUB,O2,C2,no,N,1,,185039,34276,EAN
2,,DOUB,O1P,P,no,N,2,,185039,34276,EAN
3,,SING,O4',C1',no,N,3,,185039,34276,EAN
4,,SING,O4',C4',no,N,4,,185039,34276,EAN
5,,SING,C2,N3,no,N,5,,185039,34276,EAN
6,,SING,C2,N1,no,N,6,,185039,34276,EAN
7,,SING,C1',N1,no,N,7,,185039,34276,EAN
8,,SING,C1',C2',no,N,8,,185039,34276,EAN
9,,SING,N3,C4,no,N,9,,185039,34276,EAN
10,,SING,N1,C6,no,N,10,,185039,34276,EAN
11,,SING,P,O5',no,N,11,,185039,34276,EAN
12,,SING,P,O2P,no,N,12,,185039,34276,EAN
13,,DOUB,C4,O4,no,N,13,,185039,34276,EAN
14,,SING,C4,C5,no,N,14,,185039,34276,EAN
15,,DOUB,C6,C5,no,N,15,,185039,34276,EAN
16,,SING,C5,C7,no,N,16,,185039,34276,EAN
17,,SING,C4',C5',no,N,17,,185039,34276,EAN
18,,SING,C4',C3',no,N,18,,185039,34276,EAN
19,,SING,O5',C5',no,N,19,,185039,34276,EAN
20,,SING,C2',C3',no,N,20,,185039,34276,EAN
21,,SING,C5',C6',no,N,21,,185039,34276,EAN
22,,SING,C5',C8',no,N,22,,185039,34276,EAN
23,,SING,C3',O3',no,N,23,,185039,34276,EAN
24,,SING,C3',C7',no,N,24,,185039,34276,EAN
25,,SING,C6',C8',no,N,25,,185039,34276,EAN
26,,SING,C6',C7',no,N,26,,185039,34276,EAN
27,,SING,P,O3P,no,N,27,,185039,34276,EAN
28,,SING,C7,H73,no,N,28,,185039,34276,EAN
29,,SING,C7,H71,no,N,29,,185039,34276,EAN
30,,SING,C7,H72,no,N,30,,185039,34276,EAN
31,,SING,C6,H6,no,N,31,,185039,34276,EAN
32,,SING,O2P,H1,no,N,32,,185039,34276,EAN
33,,SING,C4',H4',no,N,33,,185039,34276,EAN
34,,SING,C1',H1',no,N,34,,185039,34276,EAN
35,,SING,N3,H3,no,N,35,,185039,34276,EAN
36,,SING,C2',H2',no,N,36,,185039,34276,EAN
37,,SING,C2',H2'',no,N,37,,185039,34276,EAN
38,,SING,C7',H7',no,N,38,,185039,34276,EAN
39,,SING,C7',H7'',no,N,39,,185039,34276,EAN
40,,SING,C6',H6',no,N,40,,185039,34276,EAN
41,,SING,C8',H8',no,N,41,,185039,34276,EAN
42,,SING,C8',H8'',no,N,42,,185039,34276,EAN
43,,SING,O3',H2,no,N,43,,185039,34276,EAN
44,,SING,O3P,H4,no,N,44,,185039,34276,EAN
1,,DOUB,O1P,P,no,N,1,,185040,34276,F4Q
2,,SING,O4',C1',no,N,2,,185040,34276,F4Q
3,,SING,O4',C4',no,N,3,,185040,34276,F4Q
4,,SING,P,O2P,no,N,4,,185040,34276,F4Q
5,,SING,P,O5',no,N,5,,185040,34276,F4Q
6,,SING,C1',N9,no,N,6,,185040,34276,F4Q
7,,SING,C1',C2',no,N,7,,185040,34276,F4Q
8,,DOUB,N3,C2,no,N,8,,185040,34276,F4Q
9,,SING,N3,C4,no,N,9,,185040,34276,F4Q
10,,SING,N2,C2,no,N,10,,185040,34276,F4Q
11,,SING,C2,N1,no,N,11,,185040,34276,F4Q
12,,SING,N9,C4,yes,N,12,,185040,34276,F4Q
13,,SING,N9,C8,yes,N,13,,185040,34276,F4Q
14,,DOUB,C4,C5,yes,N,14,,185040,34276,F4Q
15,,DOUB,C8,N7,yes,N,15,,185040,34276,F4Q
16,,SING,N1,C6,no,N,16,,185040,34276,F4Q
17,,SING,C5,C6,no,N,17,,185040,34276,F4Q
18,,SING,C5,N7,yes,N,18,,185040,34276,F4Q
19,,DOUB,C6,O6,no,N,19,,185040,34276,F4Q
20,,SING,O5',C5',no,N,20,,185040,34276,F4Q
21,,SING,C4',C5',no,N,21,,185040,34276,F4Q
22,,SING,C4',C3',no,N,22,,185040,34276,F4Q
23,,SING,C2',C3',no,N,23,,185040,34276,F4Q
24,,SING,C5',C6',no,N,24,,185040,34276,F4Q
25,,SING,C5',C8',no,N,25,,185040,34276,F4Q
26,,SING,C3',O3',no,N,26,,185040,34276,F4Q
27,,SING,C3',C7',no,N,27,,185040,34276,F4Q
28,,SING,C6',C8',no,N,28,,185040,34276,F4Q
29,,SING,C6',C7',no,N,29,,185040,34276,F4Q
30,,SING,C8,H8,no,N,30,,185040,34276,F4Q
31,,SING,O2P,H3,no,N,31,,185040,34276,F4Q
32,,SING,C4',H4',no,N,32,,185040,34276,F4Q
33,,SING,C1',H1',no,N,33,,185040,34276,F4Q
34,,SING,N1,H1,no,N,34,,185040,34276,F4Q
35,,SING,N2,H22,no,N,35,,185040,34276,F4Q
36,,SING,N2,H21,no,N,36,,185040,34276,F4Q
37,,SING,C2',H2',no,N,37,,185040,34276,F4Q
38,,SING,C2',H2'',no,N,38,,185040,34276,F4Q
39,,SING,C7',H7',no,N,39,,185040,34276,F4Q
40,,SING,C7',H7'',no,N,40,,185040,34276,F4Q
41,,SING,C6',H6',no,N,41,,185040,34276,F4Q
42,,SING,C8',H8',no,N,42,,185040,34276,F4Q
43,,SING,C8',H8'',no,N,43,,185040,34276,F4Q
44,,SING,O3',H4,no,N,44,,185040,34276,F4Q
45,,SING,P,OP3,no,N,45,,185040,34276,F4Q
46,,SING,OP3,H6,no,N,46,,185040,34276,F4Q
1,,DOUB,O2,C2,no,N,1,,185041,34276,TCJ
2,,SING,N3,C2,no,N,2,,185041,34276,TCJ
3,,DOUB,N3,C4,no,N,3,,185041,34276,TCJ
4,,SING,C2,N1,no,N,4,,185041,34276,TCJ
5,,SING,N4,C4,no,N,5,,185041,34276,TCJ
6,,SING,C4,C5,no,N,6,,185041,34276,TCJ
7,,SING,N1,C1',no,N,7,,185041,34276,TCJ
8,,SING,N1,C6,no,N,8,,185041,34276,TCJ
9,,SING,C1',O4',no,N,9,,185041,34276,TCJ
10,,SING,C1',C2',no,N,10,,185041,34276,TCJ
11,,DOUB,C5,C6,no,N,11,,185041,34276,TCJ
12,,SING,C5,C7,no,N,12,,185041,34276,TCJ
13,,SING,O4',C4',no,N,13,,185041,34276,TCJ
14,,DOUB,O1P,P,no,N,14,,185041,34276,TCJ
15,,SING,C2',C3',no,N,15,,185041,34276,TCJ
16,,SING,P,O5',no,N,16,,185041,34276,TCJ
17,,SING,P,O2P,no,N,17,,185041,34276,TCJ
18,,SING,C4',C3',no,N,18,,185041,34276,TCJ
19,,SING,C4',C5',no,N,19,,185041,34276,TCJ
20,,SING,O5',C5',no,N,20,,185041,34276,TCJ
21,,SING,C3',O3',no,N,21,,185041,34276,TCJ
22,,SING,C3',C7',no,N,22,,185041,34276,TCJ
23,,SING,C5',C6',no,N,23,,185041,34276,TCJ
24,,SING,C5',C8',no,N,24,,185041,34276,TCJ
25,,SING,C7',C6',no,N,25,,185041,34276,TCJ
26,,SING,C6',C8',no,N,26,,185041,34276,TCJ
27,,SING,O2P,H2,no,N,27,,185041,34276,TCJ
28,,SING,C4',H4',no,N,28,,185041,34276,TCJ
29,,SING,C1',H1',no,N,29,,185041,34276,TCJ
30,,SING,C6,H6,no,N,30,,185041,34276,TCJ
31,,SING,C7,H73,no,N,31,,185041,34276,TCJ
32,,SING,C7,H71,no,N,32,,185041,34276,TCJ
33,,SING,C7,H72,no,N,33,,185041,34276,TCJ
34,,SING,N4,H41,no,N,34,,185041,34276,TCJ
35,,SING,N4,H42,no,N,35,,185041,34276,TCJ
36,,SING,C2',H2',no,N,36,,185041,34276,TCJ
37,,SING,C2',H2'',no,N,37,,185041,34276,TCJ
38,,SING,C7',H7',no,N,38,,185041,34276,TCJ
39,,SING,C7',H7'',no,N,39,,185041,34276,TCJ
40,,SING,C6',H6',no,N,40,,185041,34276,TCJ
41,,SING,C8',H8',no,N,41,,185041,34276,TCJ
42,,SING,C8',H8'',no,N,42,,185041,34276,TCJ
43,,SING,O3',H3T,no,N,43,,185041,34276,TCJ
44,,SING,P,OP3,no,N,44,,185041,34276,TCJ
45,,SING,OP3,H1,no,N,45,,185041,34276,TCJ
1,,SING,O3P,P,no,N,1,,185042,34276,TCY
2,,DOUB,O1P,P,no,N,2,,185042,34276,TCY
3,,SING,P,O2P,no,N,3,,185042,34276,TCY
4,,SING,P,O5',no,N,4,,185042,34276,TCY
5,,SING,C8',C5',no,N,5,,185042,34276,TCY
6,,SING,C8',C6',no,N,6,,185042,34276,TCY
7,,SING,O5',C5',no,N,7,,185042,34276,TCY
8,,SING,C5',C6',no,N,8,,185042,34276,TCY
9,,SING,C5',C4',no,N,9,,185042,34276,TCY
10,,SING,C6',C7',no,N,10,,185042,34276,TCY
11,,SING,C4',C3',no,N,11,,185042,34276,TCY
12,,SING,C4',O4',no,N,12,,185042,34276,TCY
13,,SING,C3',C7',no,N,13,,185042,34276,TCY
14,,SING,C3',O3',no,N,14,,185042,34276,TCY
15,,SING,C3',C2',no,N,15,,185042,34276,TCY
16,,SING,C2',C1',no,N,16,,185042,34276,TCY
17,,SING,C1',O4',no,N,17,,185042,34276,TCY
18,,SING,C1',N9,no,N,18,,185042,34276,TCY
19,,SING,N9,C4,yes,N,19,,185042,34276,TCY
20,,SING,N9,C8,yes,N,20,,185042,34276,TCY
21,,DOUB,C4,N3,yes,N,21,,185042,34276,TCY
22,,SING,C4,C5,yes,N,22,,185042,34276,TCY
23,,SING,N3,C2,yes,N,23,,185042,34276,TCY
24,,DOUB,C2,N1,yes,N,24,,185042,34276,TCY
25,,SING,N1,C6,yes,N,25,,185042,34276,TCY
26,,SING,C6,N6,no,N,26,,185042,34276,TCY
27,,DOUB,C6,C5,yes,N,27,,185042,34276,TCY
28,,SING,C5,N7,yes,N,28,,185042,34276,TCY
29,,DOUB,N7,C8,yes,N,29,,185042,34276,TCY
30,,SING,C8',H8',no,N,30,,185042,34276,TCY
31,,SING,C8',H8'A,no,N,31,,185042,34276,TCY
32,,SING,C6',H6',no,N,32,,185042,34276,TCY
33,,SING,C4',H4',no,N,33,,185042,34276,TCY
34,,SING,C7',H7',no,N,34,,185042,34276,TCY
35,,SING,C7',H7'A,no,N,35,,185042,34276,TCY
36,,SING,O3',HO3',no,N,36,,185042,34276,TCY
37,,SING,C2',H2',no,N,37,,185042,34276,TCY
38,,SING,C2',H2'A,no,N,38,,185042,34276,TCY
39,,SING,C1',H1',no,N,39,,185042,34276,TCY
40,,SING,C2,H2,no,N,40,,185042,34276,TCY
41,,SING,N6,HN6,no,N,41,,185042,34276,TCY
42,,SING,N6,HN6A,no,N,42,,185042,34276,TCY
43,,SING,C8,H8,no,N,43,,185042,34276,TCY
44,,SING,O3P,HO3P,no,N,44,,185042,34276,TCY
45,,SING,O2P,HO2P,no,N,45,,185042,34276,TCY
1,,DOUB,O2,C2,no,N,1,,185064,34277,EAN
2,,DOUB,O1P,P,no,N,2,,185064,34277,EAN
3,,SING,O4',C1',no,N,3,,185064,34277,EAN
4,,SING,O4',C4',no,N,4,,185064,34277,EAN
5,,SING,C2,N3,no,N,5,,185064,34277,EAN
6,,SING,C2,N1,no,N,6,,185064,34277,EAN
7,,SING,C1',N1,no,N,7,,185064,34277,EAN
8,,SING,C1',C2',no,N,8,,185064,34277,EAN
9,,SING,N3,C4,no,N,9,,185064,34277,EAN
10,,SING,N1,C6,no,N,10,,185064,34277,EAN
11,,SING,P,O5',no,N,11,,185064,34277,EAN
12,,SING,P,O2P,no,N,12,,185064,34277,EAN
13,,DOUB,C4,O4,no,N,13,,185064,34277,EAN
14,,SING,C4,C5,no,N,14,,185064,34277,EAN
15,,DOUB,C6,C5,no,N,15,,185064,34277,EAN
16,,SING,C5,C7,no,N,16,,185064,34277,EAN
17,,SING,C4',C5',no,N,17,,185064,34277,EAN
18,,SING,C4',C3',no,N,18,,185064,34277,EAN
19,,SING,O5',C5',no,N,19,,185064,34277,EAN
20,,SING,C2',C3',no,N,20,,185064,34277,EAN
21,,SING,C5',C6',no,N,21,,185064,34277,EAN
22,,SING,C5',C8',no,N,22,,185064,34277,EAN
23,,SING,C3',O3',no,N,23,,185064,34277,EAN
24,,SING,C3',C7',no,N,24,,185064,34277,EAN
25,,SING,C6',C8',no,N,25,,185064,34277,EAN
26,,SING,C6',C7',no,N,26,,185064,34277,EAN
27,,SING,P,O3P,no,N,27,,185064,34277,EAN
28,,SING,C7,H73,no,N,28,,185064,34277,EAN
29,,SING,C7,H71,no,N,29,,185064,34277,EAN
30,,SING,C7,H72,no,N,30,,185064,34277,EAN
31,,SING,C6,H6,no,N,31,,185064,34277,EAN
32,,SING,O2P,H1,no,N,32,,185064,34277,EAN
33,,SING,C4',H4',no,N,33,,185064,34277,EAN
34,,SING,C1',H1',no,N,34,,185064,34277,EAN
35,,SING,N3,H3,no,N,35,,185064,34277,EAN
36,,SING,C2',H2',no,N,36,,185064,34277,EAN
37,,SING,C2',H2'',no,N,37,,185064,34277,EAN
38,,SING,C7',H7',no,N,38,,185064,34277,EAN
39,,SING,C7',H7'',no,N,39,,185064,34277,EAN
40,,SING,C6',H6',no,N,40,,185064,34277,EAN
41,,SING,C8',H8',no,N,41,,185064,34277,EAN
42,,SING,C8',H8'',no,N,42,,185064,34277,EAN
43,,SING,O3',H2,no,N,43,,185064,34277,EAN
44,,SING,O3P,H4,no,N,44,,185064,34277,EAN
1,,DOUB,O1P,P,no,N,1,,185065,34277,F4Q
2,,SING,O4',C1',no,N,2,,185065,34277,F4Q
3,,SING,O4',C4',no,N,3,,185065,34277,F4Q
4,,SING,P,O2P,no,N,4,,185065,34277,F4Q
5,,SING,P,O5',no,N,5,,185065,34277,F4Q
6,,SING,C1',N9,no,N,6,,185065,34277,F4Q
7,,SING,C1',C2',no,N,7,,185065,34277,F4Q
8,,DOUB,N3,C2,no,N,8,,185065,34277,F4Q
9,,SING,N3,C4,no,N,9,,185065,34277,F4Q
10,,SING,N2,C2,no,N,10,,185065,34277,F4Q
11,,SING,C2,N1,no,N,11,,185065,34277,F4Q
12,,SING,N9,C4,yes,N,12,,185065,34277,F4Q
13,,SING,N9,C8,yes,N,13,,185065,34277,F4Q
14,,DOUB,C4,C5,yes,N,14,,185065,34277,F4Q
15,,DOUB,C8,N7,yes,N,15,,185065,34277,F4Q
16,,SING,N1,C6,no,N,16,,185065,34277,F4Q
17,,SING,C5,C6,no,N,17,,185065,34277,F4Q
18,,SING,C5,N7,yes,N,18,,185065,34277,F4Q
19,,DOUB,C6,O6,no,N,19,,185065,34277,F4Q
20,,SING,O5',C5',no,N,20,,185065,34277,F4Q
21,,SING,C4',C5',no,N,21,,185065,34277,F4Q
22,,SING,C4',C3',no,N,22,,185065,34277,F4Q
23,,SING,C2',C3',no,N,23,,185065,34277,F4Q
24,,SING,C5',C6',no,N,24,,185065,34277,F4Q
25,,SING,C5',C8',no,N,25,,185065,34277,F4Q
26,,SING,C3',O3',no,N,26,,185065,34277,F4Q
27,,SING,C3',C7',no,N,27,,185065,34277,F4Q
28,,SING,C6',C8',no,N,28,,185065,34277,F4Q
29,,SING,C6',C7',no,N,29,,185065,34277,F4Q
30,,SING,C8,H8,no,N,30,,185065,34277,F4Q
31,,SING,O2P,H3,no,N,31,,185065,34277,F4Q
32,,SING,C4',H4',no,N,32,,185065,34277,F4Q
33,,SING,C1',H1',no,N,33,,185065,34277,F4Q
34,,SING,N1,H1,no,N,34,,185065,34277,F4Q
35,,SING,N2,H22,no,N,35,,185065,34277,F4Q
36,,SING,N2,H21,no,N,36,,185065,34277,F4Q
37,,SING,C2',H2',no,N,37,,185065,34277,F4Q
38,,SING,C2',H2'',no,N,38,,185065,34277,F4Q
39,,SING,C7',H7',no,N,39,,185065,34277,F4Q
40,,SING,C7',H7'',no,N,40,,185065,34277,F4Q
41,,SING,C6',H6',no,N,41,,185065,34277,F4Q
42,,SING,C8',H8',no,N,42,,185065,34277,F4Q
43,,SING,C8',H8'',no,N,43,,185065,34277,F4Q
44,,SING,O3',H4,no,N,44,,185065,34277,F4Q
45,,SING,P,OP3,no,N,45,,185065,34277,F4Q
46,,SING,OP3,H6,no,N,46,,185065,34277,F4Q
1,,DOUB,O2,C2,no,N,1,,185066,34277,TCJ
2,,SING,N3,C2,no,N,2,,185066,34277,TCJ
3,,DOUB,N3,C4,no,N,3,,185066,34277,TCJ
4,,SING,C2,N1,no,N,4,,185066,34277,TCJ
5,,SING,N4,C4,no,N,5,,185066,34277,TCJ
6,,SING,C4,C5,no,N,6,,185066,34277,TCJ
7,,SING,N1,C1',no,N,7,,185066,34277,TCJ
8,,SING,N1,C6,no,N,8,,185066,34277,TCJ
9,,SING,C1',O4',no,N,9,,185066,34277,TCJ
10,,SING,C1',C2',no,N,10,,185066,34277,TCJ
11,,DOUB,C5,C6,no,N,11,,185066,34277,TCJ
12,,SING,C5,C7,no,N,12,,185066,34277,TCJ
13,,SING,O4',C4',no,N,13,,185066,34277,TCJ
14,,DOUB,O1P,P,no,N,14,,185066,34277,TCJ
15,,SING,C2',C3',no,N,15,,185066,34277,TCJ
16,,SING,P,O5',no,N,16,,185066,34277,TCJ
17,,SING,P,O2P,no,N,17,,185066,34277,TCJ
18,,SING,C4',C3',no,N,18,,185066,34277,TCJ
19,,SING,C4',C5',no,N,19,,185066,34277,TCJ
20,,SING,O5',C5',no,N,20,,185066,34277,TCJ
21,,SING,C3',O3',no,N,21,,185066,34277,TCJ
22,,SING,C3',C7',no,N,22,,185066,34277,TCJ
23,,SING,C5',C6',no,N,23,,185066,34277,TCJ
24,,SING,C5',C8',no,N,24,,185066,34277,TCJ
25,,SING,C7',C6',no,N,25,,185066,34277,TCJ
26,,SING,C6',C8',no,N,26,,185066,34277,TCJ
27,,SING,O2P,H2,no,N,27,,185066,34277,TCJ
28,,SING,C4',H4',no,N,28,,185066,34277,TCJ
29,,SING,C1',H1',no,N,29,,185066,34277,TCJ
30,,SING,C6,H6,no,N,30,,185066,34277,TCJ
31,,SING,C7,H73,no,N,31,,185066,34277,TCJ
32,,SING,C7,H71,no,N,32,,185066,34277,TCJ
33,,SING,C7,H72,no,N,33,,185066,34277,TCJ
34,,SING,N4,H41,no,N,34,,185066,34277,TCJ
35,,SING,N4,H42,no,N,35,,185066,34277,TCJ
36,,SING,C2',H2',no,N,36,,185066,34277,TCJ
37,,SING,C2',H2'',no,N,37,,185066,34277,TCJ
38,,SING,C7',H7',no,N,38,,185066,34277,TCJ
39,,SING,C7',H7'',no,N,39,,185066,34277,TCJ
40,,SING,C6',H6',no,N,40,,185066,34277,TCJ
41,,SING,C8',H8',no,N,41,,185066,34277,TCJ
42,,SING,C8',H8'',no,N,42,,185066,34277,TCJ
43,,SING,O3',H3T,no,N,43,,185066,34277,TCJ
44,,SING,P,OP3,no,N,44,,185066,34277,TCJ
45,,SING,OP3,H1,no,N,45,,185066,34277,TCJ
1,,SING,O3P,P,no,N,1,,185067,34277,TCY
2,,DOUB,O1P,P,no,N,2,,185067,34277,TCY
3,,SING,P,O2P,no,N,3,,185067,34277,TCY
4,,SING,P,O5',no,N,4,,185067,34277,TCY
5,,SING,C8',C5',no,N,5,,185067,34277,TCY
6,,SING,C8',C6',no,N,6,,185067,34277,TCY
7,,SING,O5',C5',no,N,7,,185067,34277,TCY
8,,SING,C5',C6',no,N,8,,185067,34277,TCY
9,,SING,C5',C4',no,N,9,,185067,34277,TCY
10,,SING,C6',C7',no,N,10,,185067,34277,TCY
11,,SING,C4',C3',no,N,11,,185067,34277,TCY
12,,SING,C4',O4',no,N,12,,185067,34277,TCY
13,,SING,C3',C7',no,N,13,,185067,34277,TCY
14,,SING,C3',O3',no,N,14,,185067,34277,TCY
15,,SING,C3',C2',no,N,15,,185067,34277,TCY
16,,SING,C2',C1',no,N,16,,185067,34277,TCY
17,,SING,C1',O4',no,N,17,,185067,34277,TCY
18,,SING,C1',N9,no,N,18,,185067,34277,TCY
19,,SING,N9,C4,yes,N,19,,185067,34277,TCY
20,,SING,N9,C8,yes,N,20,,185067,34277,TCY
21,,DOUB,C4,N3,yes,N,21,,185067,34277,TCY
22,,SING,C4,C5,yes,N,22,,185067,34277,TCY
23,,SING,N3,C2,yes,N,23,,185067,34277,TCY
24,,DOUB,C2,N1,yes,N,24,,185067,34277,TCY
25,,SING,N1,C6,yes,N,25,,185067,34277,TCY
26,,SING,C6,N6,no,N,26,,185067,34277,TCY
27,,DOUB,C6,C5,yes,N,27,,185067,34277,TCY
28,,SING,C5,N7,yes,N,28,,185067,34277,TCY
29,,DOUB,N7,C8,yes,N,29,,185067,34277,TCY
30,,SING,C8',H8',no,N,30,,185067,34277,TCY
31,,SING,C8',H8'A,no,N,31,,185067,34277,TCY
32,,SING,C6',H6',no,N,32,,185067,34277,TCY
33,,SING,C4',H4',no,N,33,,185067,34277,TCY
34,,SING,C7',H7',no,N,34,,185067,34277,TCY
35,,SING,C7',H7'A,no,N,35,,185067,34277,TCY
36,,SING,O3',HO3',no,N,36,,185067,34277,TCY
37,,SING,C2',H2',no,N,37,,185067,34277,TCY
38,,SING,C2',H2'A,no,N,38,,185067,34277,TCY
39,,SING,C1',H1',no,N,39,,185067,34277,TCY
40,,SING,C2,H2,no,N,40,,185067,34277,TCY
41,,SING,N6,HN6,no,N,41,,185067,34277,TCY
42,,SING,N6,HN6A,no,N,42,,185067,34277,TCY
43,,SING,C8,H8,no,N,43,,185067,34277,TCY
44,,SING,O3P,HO3P,no,N,44,,185067,34277,TCY
45,,SING,O2P,HO2P,no,N,45,,185067,34277,TCY
1,,DOUB,O2,C2,no,N,1,,185126,34280,EAN
2,,DOUB,O1P,P,no,N,2,,185126,34280,EAN
3,,SING,O4',C1',no,N,3,,185126,34280,EAN
4,,SING,O4',C4',no,N,4,,185126,34280,EAN
5,,SING,C2,N3,no,N,5,,185126,34280,EAN
6,,SING,C2,N1,no,N,6,,185126,34280,EAN
7,,SING,C1',N1,no,N,7,,185126,34280,EAN
8,,SING,C1',C2',no,N,8,,185126,34280,EAN
9,,SING,N3,C4,no,N,9,,185126,34280,EAN
10,,SING,N1,C6,no,N,10,,185126,34280,EAN
11,,SING,P,O5',no,N,11,,185126,34280,EAN
12,,SING,P,O2P,no,N,12,,185126,34280,EAN
13,,DOUB,C4,O4,no,N,13,,185126,34280,EAN
14,,SING,C4,C5,no,N,14,,185126,34280,EAN
15,,DOUB,C6,C5,no,N,15,,185126,34280,EAN
16,,SING,C5,C7,no,N,16,,185126,34280,EAN
17,,SING,C4',C5',no,N,17,,185126,34280,EAN
18,,SING,C4',C3',no,N,18,,185126,34280,EAN
19,,SING,O5',C5',no,N,19,,185126,34280,EAN
20,,SING,C2',C3',no,N,20,,185126,34280,EAN
21,,SING,C5',C6',no,N,21,,185126,34280,EAN
22,,SING,C5',C8',no,N,22,,185126,34280,EAN
23,,SING,C3',O3',no,N,23,,185126,34280,EAN
24,,SING,C3',C7',no,N,24,,185126,34280,EAN
25,,SING,C6',C8',no,N,25,,185126,34280,EAN
26,,SING,C6',C7',no,N,26,,185126,34280,EAN
27,,SING,P,O3P,no,N,27,,185126,34280,EAN
28,,SING,C7,H73,no,N,28,,185126,34280,EAN
29,,SING,C7,H71,no,N,29,,185126,34280,EAN
30,,SING,C7,H72,no,N,30,,185126,34280,EAN
31,,SING,C6,H6,no,N,31,,185126,34280,EAN
32,,SING,O2P,H1,no,N,32,,185126,34280,EAN
33,,SING,C4',H4',no,N,33,,185126,34280,EAN
34,,SING,C1',H1',no,N,34,,185126,34280,EAN
35,,SING,N3,H3,no,N,35,,185126,34280,EAN
36,,SING,C2',H2',no,N,36,,185126,34280,EAN
37,,SING,C2',H2'',no,N,37,,185126,34280,EAN
38,,SING,C7',H7',no,N,38,,185126,34280,EAN
39,,SING,C7',H7'',no,N,39,,185126,34280,EAN
40,,SING,C6',H6',no,N,40,,185126,34280,EAN
41,,SING,C8',H8',no,N,41,,185126,34280,EAN
42,,SING,C8',H8'',no,N,42,,185126,34280,EAN
43,,SING,O3',H2,no,N,43,,185126,34280,EAN
44,,SING,O3P,H4,no,N,44,,185126,34280,EAN
1,,DOUB,O1P,P,no,N,1,,185127,34280,F4Q
2,,SING,O4',C1',no,N,2,,185127,34280,F4Q
3,,SING,O4',C4',no,N,3,,185127,34280,F4Q
4,,SING,P,O2P,no,N,4,,185127,34280,F4Q
5,,SING,P,O5',no,N,5,,185127,34280,F4Q
6,,SING,C1',N9,no,N,6,,185127,34280,F4Q
7,,SING,C1',C2',no,N,7,,185127,34280,F4Q
8,,DOUB,N3,C2,no,N,8,,185127,34280,F4Q
9,,SING,N3,C4,no,N,9,,185127,34280,F4Q
10,,SING,N2,C2,no,N,10,,185127,34280,F4Q
11,,SING,C2,N1,no,N,11,,185127,34280,F4Q
12,,SING,N9,C4,yes,N,12,,185127,34280,F4Q
13,,SING,N9,C8,yes,N,13,,185127,34280,F4Q
14,,DOUB,C4,C5,yes,N,14,,185127,34280,F4Q
15,,DOUB,C8,N7,yes,N,15,,185127,34280,F4Q
16,,SING,N1,C6,no,N,16,,185127,34280,F4Q
17,,SING,C5,C6,no,N,17,,185127,34280,F4Q
18,,SING,C5,N7,yes,N,18,,185127,34280,F4Q
19,,DOUB,C6,O6,no,N,19,,185127,34280,F4Q
20,,SING,O5',C5',no,N,20,,185127,34280,F4Q
21,,SING,C4',C5',no,N,21,,185127,34280,F4Q
22,,SING,C4',C3',no,N,22,,185127,34280,F4Q
23,,SING,C2',C3',no,N,23,,185127,34280,F4Q
24,,SING,C5',C6',no,N,24,,185127,34280,F4Q
25,,SING,C5',C8',no,N,25,,185127,34280,F4Q
26,,SING,C3',O3',no,N,26,,185127,34280,F4Q
27,,SING,C3',C7',no,N,27,,185127,34280,F4Q
28,,SING,C6',C8',no,N,28,,185127,34280,F4Q
29,,SING,C6',C7',no,N,29,,185127,34280,F4Q
30,,SING,C8,H8,no,N,30,,185127,34280,F4Q
31,,SING,O2P,H3,no,N,31,,185127,34280,F4Q
32,,SING,C4',H4',no,N,32,,185127,34280,F4Q
33,,SING,C1',H1',no,N,33,,185127,34280,F4Q
34,,SING,N1,H1,no,N,34,,185127,34280,F4Q
35,,SING,N2,H22,no,N,35,,185127,34280,F4Q
36,,SING,N2,H21,no,N,36,,185127,34280,F4Q
37,,SING,C2',H2',no,N,37,,185127,34280,F4Q
38,,SING,C2',H2'',no,N,38,,185127,34280,F4Q
39,,SING,C7',H7',no,N,39,,185127,34280,F4Q
40,,SING,C7',H7'',no,N,40,,185127,34280,F4Q
41,,SING,C6',H6',no,N,41,,185127,34280,F4Q
42,,SING,C8',H8',no,N,42,,185127,34280,F4Q
43,,SING,C8',H8'',no,N,43,,185127,34280,F4Q
44,,SING,O3',H4,no,N,44,,185127,34280,F4Q
45,,SING,P,OP3,no,N,45,,185127,34280,F4Q
46,,SING,OP3,H6,no,N,46,,185127,34280,F4Q
1,,SING,O4',C1',no,N,1,,185128,34280,F7H
2,,SING,O4',C4',no,N,2,,185128,34280,F7H
3,,SING,C1',N1,no,N,3,,185128,34280,F7H
4,,SING,C1',C2',no,N,4,,185128,34280,F7H
5,,SING,O5',C5',no,N,5,,185128,34280,F7H
6,,DOUB,O2,C2,no,N,6,,185128,34280,F7H
7,,SING,C4',C5',no,N,7,,185128,34280,F7H
8,,SING,C4',C3',no,N,8,,185128,34280,F7H
9,,SING,N1,C2,no,N,9,,185128,34280,F7H
10,,SING,N1,C6,no,N,10,,185128,34280,F7H
11,,SING,C2,N3,no,N,11,,185128,34280,F7H
12,,DOUB,C6,C5,no,N,12,,185128,34280,F7H
13,,SING,C5',C8',no,N,13,,185128,34280,F7H
14,,SING,C5',C6',no,N,14,,185128,34280,F7H
15,,DOUB,N3,C4,no,N,15,,185128,34280,F7H
16,,SING,C2',C3',no,N,16,,185128,34280,F7H
17,,SING,C5,C4,no,N,17,,185128,34280,F7H
18,,SING,C5,C7,no,N,18,,185128,34280,F7H
19,,SING,C4,N4,no,N,19,,185128,34280,F7H
20,,SING,C3',O3',no,N,20,,185128,34280,F7H
21,,SING,C3',C7',no,N,21,,185128,34280,F7H
22,,SING,C8',C6',no,N,22,,185128,34280,F7H
23,,SING,C6',C7',no,N,23,,185128,34280,F7H
24,,SING,O5',HO5',no,N,24,,185128,34280,F7H
25,,SING,C4',H4',no,N,25,,185128,34280,F7H
26,,SING,C1',H1',no,N,26,,185128,34280,F7H
27,,SING,C6,H6,no,N,27,,185128,34280,F7H
28,,SING,C7,H71,no,N,28,,185128,34280,F7H
29,,SING,C7,H72,no,N,29,,185128,34280,F7H
30,,SING,C7,H73,no,N,30,,185128,34280,F7H
31,,SING,N4,H41,no,N,31,,185128,34280,F7H
32,,SING,N4,H42,no,N,32,,185128,34280,F7H
33,,SING,C2',H2',no,N,33,,185128,34280,F7H
34,,SING,C2',H2'',no,N,34,,185128,34280,F7H
35,,SING,C7',H7',no,N,35,,185128,34280,F7H
36,,SING,C7',H7'',no,N,36,,185128,34280,F7H
37,,SING,C6',H6',no,N,37,,185128,34280,F7H
38,,SING,C8',H8',no,N,38,,185128,34280,F7H
39,,SING,C8',H8'',no,N,39,,185128,34280,F7H
40,,SING,O3',H1,no,N,40,,185128,34280,F7H
1,,DOUB,O2,C2,no,N,1,,185129,34280,TCJ
2,,SING,N3,C2,no,N,2,,185129,34280,TCJ
3,,DOUB,N3,C4,no,N,3,,185129,34280,TCJ
4,,SING,C2,N1,no,N,4,,185129,34280,TCJ
5,,SING,N4,C4,no,N,5,,185129,34280,TCJ
6,,SING,C4,C5,no,N,6,,185129,34280,TCJ
7,,SING,N1,C1',no,N,7,,185129,34280,TCJ
8,,SING,N1,C6,no,N,8,,185129,34280,TCJ
9,,SING,C1',O4',no,N,9,,185129,34280,TCJ
10,,SING,C1',C2',no,N,10,,185129,34280,TCJ
11,,DOUB,C5,C6,no,N,11,,185129,34280,TCJ
12,,SING,C5,C7,no,N,12,,185129,34280,TCJ
13,,SING,O4',C4',no,N,13,,185129,34280,TCJ
14,,DOUB,O1P,P,no,N,14,,185129,34280,TCJ
15,,SING,C2',C3',no,N,15,,185129,34280,TCJ
16,,SING,P,O5',no,N,16,,185129,34280,TCJ
17,,SING,P,O2P,no,N,17,,185129,34280,TCJ
18,,SING,C4',C3',no,N,18,,185129,34280,TCJ
19,,SING,C4',C5',no,N,19,,185129,34280,TCJ
20,,SING,O5',C5',no,N,20,,185129,34280,TCJ
21,,SING,C3',O3',no,N,21,,185129,34280,TCJ
22,,SING,C3',C7',no,N,22,,185129,34280,TCJ
23,,SING,C5',C6',no,N,23,,185129,34280,TCJ
24,,SING,C5',C8',no,N,24,,185129,34280,TCJ
25,,SING,C7',C6',no,N,25,,185129,34280,TCJ
26,,SING,C6',C8',no,N,26,,185129,34280,TCJ
27,,SING,O2P,H2,no,N,27,,185129,34280,TCJ
28,,SING,C4',H4',no,N,28,,185129,34280,TCJ
29,,SING,C1',H1',no,N,29,,185129,34280,TCJ
30,,SING,C6,H6,no,N,30,,185129,34280,TCJ
31,,SING,C7,H73,no,N,31,,185129,34280,TCJ
32,,SING,C7,H71,no,N,32,,185129,34280,TCJ
33,,SING,C7,H72,no,N,33,,185129,34280,TCJ
34,,SING,N4,H41,no,N,34,,185129,34280,TCJ
35,,SING,N4,H42,no,N,35,,185129,34280,TCJ
36,,SING,C2',H2',no,N,36,,185129,34280,TCJ
37,,SING,C2',H2'',no,N,37,,185129,34280,TCJ
38,,SING,C7',H7',no,N,38,,185129,34280,TCJ
39,,SING,C7',H7'',no,N,39,,185129,34280,TCJ
40,,SING,C6',H6',no,N,40,,185129,34280,TCJ
41,,SING,C8',H8',no,N,41,,185129,34280,TCJ
42,,SING,C8',H8'',no,N,42,,185129,34280,TCJ
43,,SING,O3',H3T,no,N,43,,185129,34280,TCJ
44,,SING,P,OP3,no,N,44,,185129,34280,TCJ
45,,SING,OP3,H1,no,N,45,,185129,34280,TCJ
1,,SING,O3P,P,no,N,1,,185130,34280,TCY
2,,DOUB,O1P,P,no,N,2,,185130,34280,TCY
3,,SING,P,O2P,no,N,3,,185130,34280,TCY
4,,SING,P,O5',no,N,4,,185130,34280,TCY
5,,SING,C8',C5',no,N,5,,185130,34280,TCY
6,,SING,C8',C6',no,N,6,,185130,34280,TCY
7,,SING,O5',C5',no,N,7,,185130,34280,TCY
8,,SING,C5',C6',no,N,8,,185130,34280,TCY
9,,SING,C5',C4',no,N,9,,185130,34280,TCY
10,,SING,C6',C7',no,N,10,,185130,34280,TCY
11,,SING,C4',C3',no,N,11,,185130,34280,TCY
12,,SING,C4',O4',no,N,12,,185130,34280,TCY
13,,SING,C3',C7',no,N,13,,185130,34280,TCY
14,,SING,C3',O3',no,N,14,,185130,34280,TCY
15,,SING,C3',C2',no,N,15,,185130,34280,TCY
16,,SING,C2',C1',no,N,16,,185130,34280,TCY
17,,SING,C1',O4',no,N,17,,185130,34280,TCY
18,,SING,C1',N9,no,N,18,,185130,34280,TCY
19,,SING,N9,C4,yes,N,19,,185130,34280,TCY
20,,SING,N9,C8,yes,N,20,,185130,34280,TCY
21,,DOUB,C4,N3,yes,N,21,,185130,34280,TCY
22,,SING,C4,C5,yes,N,22,,185130,34280,TCY
23,,SING,N3,C2,yes,N,23,,185130,34280,TCY
24,,DOUB,C2,N1,yes,N,24,,185130,34280,TCY
25,,SING,N1,C6,yes,N,25,,185130,34280,TCY
26,,SING,C6,N6,no,N,26,,185130,34280,TCY
27,,DOUB,C6,C5,yes,N,27,,185130,34280,TCY
28,,SING,C5,N7,yes,N,28,,185130,34280,TCY
29,,DOUB,N7,C8,yes,N,29,,185130,34280,TCY
30,,SING,C8',H8',no,N,30,,185130,34280,TCY
31,,SING,C8',H8'A,no,N,31,,185130,34280,TCY
32,,SING,C6',H6',no,N,32,,185130,34280,TCY
33,,SING,C4',H4',no,N,33,,185130,34280,TCY
34,,SING,C7',H7',no,N,34,,185130,34280,TCY
35,,SING,C7',H7'A,no,N,35,,185130,34280,TCY
36,,SING,O3',HO3',no,N,36,,185130,34280,TCY
37,,SING,C2',H2',no,N,37,,185130,34280,TCY
38,,SING,C2',H2'A,no,N,38,,185130,34280,TCY
39,,SING,C1',H1',no,N,39,,185130,34280,TCY
40,,SING,C2,H2,no,N,40,,185130,34280,TCY
41,,SING,N6,HN6,no,N,41,,185130,34280,TCY
42,,SING,N6,HN6A,no,N,42,,185130,34280,TCY
43,,SING,C8,H8,no,N,43,,185130,34280,TCY
44,,SING,O3P,HO3P,no,N,44,,185130,34280,TCY
45,,SING,O2P,HO2P,no,N,45,,185130,34280,TCY
1,,DOUB,PG,O1G,no,N,1,,185347,34290,ATP
2,,SING,PG,O2G,no,N,2,,185347,34290,ATP
3,,SING,PG,O3G,no,N,3,,185347,34290,ATP
4,,SING,PG,O3B,no,N,4,,185347,34290,ATP
5,,SING,O2G,HOG2,no,N,5,,185347,34290,ATP
6,,SING,O3G,HOG3,no,N,6,,185347,34290,ATP
7,,DOUB,PB,O1B,no,N,7,,185347,34290,ATP
8,,SING,PB,O2B,no,N,8,,185347,34290,ATP
9,,SING,PB,O3B,no,N,9,,185347,34290,ATP
10,,SING,PB,O3A,no,N,10,,185347,34290,ATP
11,,SING,O2B,HOB2,no,N,11,,185347,34290,ATP
12,,DOUB,PA,O1A,no,N,12,,185347,34290,ATP
13,,SING,PA,O2A,no,N,13,,185347,34290,ATP
14,,SING,PA,O3A,no,N,14,,185347,34290,ATP
15,,SING,PA,O5',no,N,15,,185347,34290,ATP
16,,SING,O2A,HOA2,no,N,16,,185347,34290,ATP
17,,SING,O5',C5',no,N,17,,185347,34290,ATP
18,,SING,C5',C4',no,N,18,,185347,34290,ATP
19,,SING,C5',H5'1,no,N,19,,185347,34290,ATP
20,,SING,C5',H5'2,no,N,20,,185347,34290,ATP
21,,SING,C4',O4',no,N,21,,185347,34290,ATP
22,,SING,C4',C3',no,N,22,,185347,34290,ATP
23,,SING,C4',H4',no,N,23,,185347,34290,ATP
24,,SING,O4',C1',no,N,24,,185347,34290,ATP
25,,SING,C3',O3',no,N,25,,185347,34290,ATP
26,,SING,C3',C2',no,N,26,,185347,34290,ATP
27,,SING,C3',H3',no,N,27,,185347,34290,ATP
28,,SING,O3',HO3',no,N,28,,185347,34290,ATP
29,,SING,C2',O2',no,N,29,,185347,34290,ATP
30,,SING,C2',C1',no,N,30,,185347,34290,ATP
31,,SING,C2',H2',no,N,31,,185347,34290,ATP
32,,SING,O2',HO2',no,N,32,,185347,34290,ATP
33,,SING,C1',N9,no,N,33,,185347,34290,ATP
34,,SING,C1',H1',no,N,34,,185347,34290,ATP
35,,SING,N9,C8,yes,N,35,,185347,34290,ATP
36,,SING,N9,C4,yes,N,36,,185347,34290,ATP
37,,DOUB,C8,N7,yes,N,37,,185347,34290,ATP
38,,SING,C8,H8,no,N,38,,185347,34290,ATP
39,,SING,N7,C5,yes,N,39,,185347,34290,ATP
40,,SING,C5,C6,yes,N,40,,185347,34290,ATP
41,,DOUB,C5,C4,yes,N,41,,185347,34290,ATP
42,,SING,C6,N6,no,N,42,,185347,34290,ATP
43,,DOUB,C6,N1,yes,N,43,,185347,34290,ATP
44,,SING,N6,HN61,no,N,44,,185347,34290,ATP
45,,SING,N6,HN62,no,N,45,,185347,34290,ATP
46,,SING,N1,C2,yes,N,46,,185347,34290,ATP
47,,DOUB,C2,N3,yes,N,47,,185347,34290,ATP
48,,SING,C2,H2,no,N,48,,185347,34290,ATP
49,,SING,N3,C4,yes,N,49,,185347,34290,ATP
1,,DOUB,C,O,no,N,1,,185472,34295,ACE
2,,SING,C,CH3,no,N,2,,185472,34295,ACE
3,,SING,C,H,no,N,3,,185472,34295,ACE
4,,SING,CH3,H1,no,N,4,,185472,34295,ACE
5,,SING,CH3,H2,no,N,5,,185472,34295,ACE
6,,SING,CH3,H3,no,N,6,,185472,34295,ACE
1,,SING,N,HN1,no,N,1,,185473,34295,NH2
2,,SING,N,HN2,no,N,2,,185473,34295,NH2
1,,DOUB,O91,C91,no,N,1,,185496,34296,FGW
2,,SING,CM4,N41,no,N,2,,185496,34296,FGW
3,,SING,C44,N41,yes,N,3,,185496,34296,FGW
4,,DOUB,C44,C43,yes,N,4,,185496,34296,FGW
5,,DOUB,O51,C51,no,N,5,,185496,34296,FGW
6,,SING,C91,C92,no,N,6,,185496,34296,FGW
7,,SING,C91,N43,no,N,7,,185496,34296,FGW
8,,SING,C93,C92,no,N,8,,185496,34296,FGW
9,,SING,C93,C94,no,N,9,,185496,34296,FGW
10,,SING,N41,C42,yes,N,10,,185496,34296,FGW
11,,SING,CM5,N51,no,N,11,,185496,34296,FGW
12,,SING,N43,C43,no,N,12,,185496,34296,FGW
13,,SING,C43,N42,yes,N,13,,185496,34296,FGW
14,,SING,C94,N91,no,N,14,,185496,34296,FGW
15,,SING,C51,N91,no,N,15,,185496,34296,FGW
16,,SING,C51,C52,no,N,16,,185496,34296,FGW
17,,SING,N51,C52,yes,N,17,,185496,34296,FGW
18,,SING,N51,C55,yes,N,18,,185496,34296,FGW
19,,DOUB,C42,N42,yes,N,19,,185496,34296,FGW
20,,SING,C42,C41,no,N,20,,185496,34296,FGW
21,,DOUB,C52,C53,yes,N,21,,185496,34296,FGW
22,,DOUB,O41,C41,no,N,22,,185496,34296,FGW
23,,SING,C41,N32,no,N,23,,185496,34296,FGW
24,,DOUB,C55,C54,yes,N,24,,185496,34296,FGW
25,,SING,C53,C54,yes,N,25,,185496,34296,FGW
26,,SING,C54,N52,no,N,26,,185496,34296,FGW
27,,SING,N32,C34,no,N,27,,185496,34296,FGW
28,,DOUB,C34,C35,yes,N,28,,185496,34296,FGW
29,,SING,C34,C33,yes,N,29,,185496,34296,FGW
30,,SING,C35,N31,yes,N,30,,185496,34296,FGW
31,,SING,N52,C61,no,N,31,,185496,34296,FGW
32,,DOUB,O61,C61,no,N,32,,185496,34296,FGW
33,,SING,C61,C62,no,N,33,,185496,34296,FGW
34,,DOUB,C33,C32,yes,N,34,,185496,34296,FGW
35,,SING,N31,CM3,no,N,35,,185496,34296,FGW
36,,SING,N31,C32,yes,N,36,,185496,34296,FGW
37,,SING,C32,C31,no,N,37,,185496,34296,FGW
38,,DOUB,C62,C63,yes,N,38,,185496,34296,FGW
39,,SING,C62,N61,yes,N,39,,185496,34296,FGW
40,,SING,CM6,N61,no,N,40,,185496,34296,FGW
41,,SING,C63,C64,yes,N,41,,185496,34296,FGW
42,,SING,N61,C65,yes,N,42,,185496,34296,FGW
43,,SING,C31,N22,no,N,43,,185496,34296,FGW
44,,DOUB,C31,O31,no,N,44,,185496,34296,FGW
45,,SING,N22,C24,no,N,45,,185496,34296,FGW
46,,DOUB,C64,C65,yes,N,46,,185496,34296,FGW
47,,SING,C64,N62,no,N,47,,185496,34296,FGW
48,,SING,N62,C71,no,N,48,,185496,34296,FGW
49,,SING,C24,C23,yes,N,49,,185496,34296,FGW
50,,DOUB,C24,C25,yes,N,50,,185496,34296,FGW
51,,SING,C04,C05,no,N,51,,185496,34296,FGW
52,,SING,C04,C03,no,N,52,,185496,34296,FGW
53,,DOUB,C23,C22,yes,N,53,,185496,34296,FGW
54,,SING,N02,C05,no,N,54,,185496,34296,FGW
55,,SING,N02,C06,no,N,55,,185496,34296,FGW
56,,SING,C02,N01,no,N,56,,185496,34296,FGW
57,,SING,C25,N21,yes,N,57,,185496,34296,FGW
58,,DOUB,C71,O71,no,N,58,,185496,34296,FGW
59,,SING,C71,C72,no,N,59,,185496,34296,FGW
60,,SING,N01,C03,no,N,60,,185496,34296,FGW
61,,SING,N01,C01,no,N,61,,185496,34296,FGW
62,,SING,C07,C06,no,N,62,,185496,34296,FGW
63,,SING,C07,C08,no,N,63,,185496,34296,FGW
64,,DOUB,C06,O01,no,N,64,,185496,34296,FGW
65,,DOUB,C73,C72,yes,N,65,,185496,34296,FGW
66,,SING,C73,C74,yes,N,66,,185496,34296,FGW
67,,SING,C08,N03,no,N,67,,185496,34296,FGW
68,,SING,C22,N21,yes,N,68,,185496,34296,FGW
69,,SING,C22,C21,no,N,69,,185496,34296,FGW
70,,SING,C72,N71,yes,N,70,,185496,34296,FGW
71,,SING,N03,C11,no,N,71,,185496,34296,FGW
72,,SING,N21,CM2,no,N,72,,185496,34296,FGW
73,,SING,N12,C21,no,N,73,,185496,34296,FGW
74,,SING,N12,C14,no,N,74,,185496,34296,FGW
75,,SING,C13,C14,yes,N,75,,185496,34296,FGW
76,,DOUB,C13,C12,yes,N,76,,185496,34296,FGW
77,,DOUB,C21,O21,no,N,77,,185496,34296,FGW
78,,SING,C74,N72,no,N,78,,185496,34296,FGW
79,,DOUB,C74,C75,yes,N,79,,185496,34296,FGW
80,,SING,N82,C84,yes,N,80,,185496,34296,FGW
81,,DOUB,N82,C82,yes,N,81,,185496,34296,FGW
82,,DOUB,C14,C15,yes,N,82,,185496,34296,FGW
83,,SING,N72,C81,no,N,83,,185496,34296,FGW
84,,DOUB,C84,C83,yes,N,84,,185496,34296,FGW
85,,SING,N71,C75,yes,N,85,,185496,34296,FGW
86,,SING,N71,CM7,no,N,86,,185496,34296,FGW
87,,SING,C11,C12,no,N,87,,185496,34296,FGW
88,,DOUB,C11,O11,no,N,88,,185496,34296,FGW
89,,SING,C12,N11,yes,N,89,,185496,34296,FGW
90,,SING,C82,C81,no,N,90,,185496,34296,FGW
91,,SING,C82,N81,yes,N,91,,185496,34296,FGW
92,,DOUB,C81,O81,no,N,92,,185496,34296,FGW
93,,SING,C15,N11,yes,N,93,,185496,34296,FGW
94,,SING,C83,N81,yes,N,94,,185496,34296,FGW
95,,SING,N11,CM1,no,N,95,,185496,34296,FGW
96,,SING,N81,C88,no,N,96,,185496,34296,FGW
97,,SING,C88,C8,no,N,97,,185496,34296,FGW
98,,SING,C88,C9,no,N,98,,185496,34296,FGW
99,,SING,C03,H032,no,N,99,,185496,34296,FGW
100,,SING,C03,H031,no,N,100,,185496,34296,FGW
101,,SING,C04,H041,no,N,101,,185496,34296,FGW
102,,SING,C04,H042,no,N,102,,185496,34296,FGW
103,,SING,C05,H052,no,N,103,,185496,34296,FGW
104,,SING,C05,H051,no,N,104,,185496,34296,FGW
105,,SING,N02,HN02,no,N,105,,185496,34296,FGW
106,,SING,C01,H005,no,N,106,,185496,34296,FGW
107,,SING,C01,H006,no,N,107,,185496,34296,FGW
108,,SING,C01,H004,no,N,108,,185496,34296,FGW
109,,SING,C02,H002,no,N,109,,185496,34296,FGW
110,,SING,C02,H003,no,N,110,,185496,34296,FGW
111,,SING,C02,H001,no,N,111,,185496,34296,FGW
112,,SING,N03,HN03,no,N,112,,185496,34296,FGW
113,,SING,C13,H13,no,N,113,,185496,34296,FGW
114,,SING,N12,HN1,no,N,114,,185496,34296,FGW
115,,SING,C15,H15,no,N,115,,185496,34296,FGW
116,,SING,CM1,H111,no,N,116,,185496,34296,FGW
117,,SING,CM1,H113,no,N,117,,185496,34296,FGW
118,,SING,CM1,H112,no,N,118,,185496,34296,FGW
119,,SING,N22,HN2,no,N,119,,185496,34296,FGW
120,,SING,N32,HN3,no,N,120,,185496,34296,FGW
121,,SING,C25,H25,no,N,121,,185496,34296,FGW
122,,SING,CM2,H222,no,N,122,,185496,34296,FGW
123,,SING,CM2,H221,no,N,123,,185496,34296,FGW
124,,SING,CM2,H223,no,N,124,,185496,34296,FGW
125,,SING,N43,HN4,no,N,125,,185496,34296,FGW
126,,SING,C23,H23,no,N,126,,185496,34296,FGW
127,,SING,N91,HN9,no,N,127,,185496,34296,FGW
128,,SING,C35,H35,no,N,128,,185496,34296,FGW
129,,SING,N52,HN5,no,N,129,,185496,34296,FGW
130,,SING,CM3,H333,no,N,130,,185496,34296,FGW
131,,SING,CM3,H332,no,N,131,,185496,34296,FGW
132,,SING,CM3,H331,no,N,132,,185496,34296,FGW
133,,SING,N62,HN6,no,N,133,,185496,34296,FGW
134,,SING,N72,HN7,no,N,134,,185496,34296,FGW
135,,SING,C44,H44,no,N,135,,185496,34296,FGW
136,,SING,CM4,H441,no,N,136,,185496,34296,FGW
137,,SING,CM4,H443,no,N,137,,185496,34296,FGW
138,,SING,CM4,H442,no,N,138,,185496,34296,FGW
139,,SING,C08,H081,no,N,139,,185496,34296,FGW
140,,SING,C08,H082,no,N,140,,185496,34296,FGW
141,,SING,C53,H53,no,N,141,,185496,34296,FGW
142,,SING,C55,H55,no,N,142,,185496,34296,FGW
143,,SING,CM5,H552,no,N,143,,185496,34296,FGW
144,,SING,CM5,H553,no,N,144,,185496,34296,FGW
145,,SING,CM5,H551,no,N,145,,185496,34296,FGW
146,,SING,C63,H63,no,N,146,,185496,34296,FGW
147,,SING,C65,H65,no,N,147,,185496,34296,FGW
148,,SING,CM6,H662,no,N,148,,185496,34296,FGW
149,,SING,CM6,H663,no,N,149,,185496,34296,FGW
150,,SING,CM6,H661,no,N,150,,185496,34296,FGW
151,,SING,C75,H75,no,N,151,,185496,34296,FGW
152,,SING,CM7,H773,no,N,152,,185496,34296,FGW
153,,SING,CM7,H772,no,N,153,,185496,34296,FGW
154,,SING,CM7,H771,no,N,154,,185496,34296,FGW
155,,SING,C92,H922,no,N,155,,185496,34296,FGW
156,,SING,C92,H921,no,N,156,,185496,34296,FGW
157,,SING,C93,H932,no,N,157,,185496,34296,FGW
158,,SING,C93,H931,no,N,158,,185496,34296,FGW
159,,SING,C94,H942,no,N,159,,185496,34296,FGW
160,,SING,C94,H943,no,N,160,,185496,34296,FGW
161,,SING,C33,H33,no,N,161,,185496,34296,FGW
162,,SING,C73,H73,no,N,162,,185496,34296,FGW
163,,SING,C07,H072,no,N,163,,185496,34296,FGW
164,,SING,C07,H071,no,N,164,,185496,34296,FGW
165,,SING,C83,H84,no,N,165,,185496,34296,FGW
166,,SING,C88,H10,no,N,166,,185496,34296,FGW
167,,SING,C84,H83,no,N,167,,185496,34296,FGW
168,,SING,C9,H993,no,N,168,,185496,34296,FGW
169,,SING,C9,H991,no,N,169,,185496,34296,FGW
170,,SING,C9,H992,no,N,170,,185496,34296,FGW
171,,SING,C8,H883,no,N,171,,185496,34296,FGW
172,,SING,C8,H882,no,N,172,,185496,34296,FGW
173,,SING,C8,H881,no,N,173,,185496,34296,FGW
1,,SING,C,CA,no,N,1,,185497,34296,PA9
2,,SING,CA,N1,no,N,2,,185497,34296,PA9
3,,SING,CA,CB,no,N,3,,185497,34296,PA9
4,,SING,CA,HA,no,N,4,,185497,34296,PA9
5,,SING,CG,CB,no,N,5,,185497,34296,PA9
6,,SING,CB,HB,no,N,6,,185497,34296,PA9
7,,SING,CB,HBA,no,N,7,,185497,34296,PA9
8,,SING,CG,CD,no,N,8,,185497,34296,PA9
9,,SING,CG,HG,no,N,9,,185497,34296,PA9
10,,SING,CG,HGA,no,N,10,,185497,34296,PA9
11,,SING,CD,N2,no,N,11,,185497,34296,PA9
12,,SING,CD,HD,no,N,12,,185497,34296,PA9
13,,SING,CD,HDA,no,N,13,,185497,34296,PA9
14,,DOUB,O,C,no,N,14,,185497,34296,PA9
15,,SING,OXT,C,no,N,15,,185497,34296,PA9
16,,SING,OXT,HOXT,no,N,16,,185497,34296,PA9
17,,DOUB,O1,C1,no,N,17,,185497,34296,PA9
18,,SING,C1,C2,no,N,18,,185497,34296,PA9
19,,SING,C1,N1,no,N,19,,185497,34296,PA9
20,,DOUB,O1P,P,no,N,20,,185497,34296,PA9
21,,SING,C4,P,no,N,21,,185497,34296,PA9
22,,SING,P,O2P,no,N,22,,185497,34296,PA9
23,,SING,P,O3P,no,N,23,,185497,34296,PA9
24,,SING,O2P,HO2P,no,N,24,,185497,34296,PA9
25,,SING,O3P,HO3P,no,N,25,,185497,34296,PA9
26,,SING,N1,HN1,no,N,26,,185497,34296,PA9
27,,SING,C2,H2,no,N,27,,185497,34296,PA9
28,,SING,C2,H2A,no,N,28,,185497,34296,PA9
29,,SING,C2,H2B,no,N,29,,185497,34296,PA9
30,,SING,N2,C3,no,N,30,,185497,34296,PA9
31,,SING,N2,HN2,no,N,31,,185497,34296,PA9
32,,DOUB,O2,C3,no,N,32,,185497,34296,PA9
33,,SING,C3,C4,no,N,33,,185497,34296,PA9
34,,SING,C4,H4,no,N,34,,185497,34296,PA9
35,,SING,C4,H4A,no,N,35,,185497,34296,PA9
1,,SING,C5,C4,no,N,1,,185634,34303,FKZ
2,,SING,C5,C6,no,N,2,,185634,34303,FKZ
3,,SING,C4,C3,no,N,3,,185634,34303,FKZ
4,,SING,C7,C6,no,N,4,,185634,34303,FKZ
5,,SING,C7,C8,no,N,5,,185634,34303,FKZ
6,,SING,C1,N,no,N,6,,185634,34303,FKZ
7,,SING,C1,C2,no,N,7,,185634,34303,FKZ
8,,SING,C3,C2,no,N,8,,185634,34303,FKZ
9,,SING,C1,H12,no,N,9,,185634,34303,FKZ
10,,SING,C1,H11,no,N,10,,185634,34303,FKZ
11,,SING,C2,H22,no,N,11,,185634,34303,FKZ
12,,SING,C2,H21,no,N,12,,185634,34303,FKZ
13,,SING,C3,H31,no,N,13,,185634,34303,FKZ
14,,SING,C3,H32,no,N,14,,185634,34303,FKZ
15,,SING,C4,H41,no,N,15,,185634,34303,FKZ
16,,SING,C4,H42,no,N,16,,185634,34303,FKZ
17,,SING,C5,H52,no,N,17,,185634,34303,FKZ
18,,SING,C5,H51,no,N,18,,185634,34303,FKZ
19,,SING,C6,H62,no,N,19,,185634,34303,FKZ
20,,SING,C6,H61,no,N,20,,185634,34303,FKZ
21,,SING,C7,H72,no,N,21,,185634,34303,FKZ
22,,SING,C7,H71,no,N,22,,185634,34303,FKZ
23,,SING,C8,H81,no,N,23,,185634,34303,FKZ
24,,SING,C8,H83,no,N,24,,185634,34303,FKZ
25,,SING,C8,H82,no,N,25,,185634,34303,FKZ
26,,SING,N,H,no,N,26,,185634,34303,FKZ
27,,SING,N,H1,no,N,27,,185634,34303,FKZ
1,,SING,N,HN1,no,N,1,,185635,34303,NH2
2,,SING,N,HN2,no,N,2,,185635,34303,NH2
1,,SING,N,HN1,no,N,1,,185675,34305,NH2
2,,SING,N,HN2,no,N,2,,185675,34305,NH2
1,,SING,N,HN1,no,N,1,,185692,34306,NH2
2,,SING,N,HN2,no,N,2,,185692,34306,NH2
1,,SING,O,H1,no,N,1,,185736,34308,HOH
2,,SING,O,H2,no,N,2,,185736,34308,HOH
1,,SING,N1,C2,no,N,1,,185776,34311,PSU
2,,SING,N1,C6,no,N,2,,185776,34311,PSU
3,,SING,N1,HN1,no,N,3,,185776,34311,PSU
4,,SING,C2,N3,no,N,4,,185776,34311,PSU
5,,DOUB,C2,O2,no,N,5,,185776,34311,PSU
6,,SING,N3,C4,no,N,6,,185776,34311,PSU
7,,SING,N3,HN3,no,N,7,,185776,34311,PSU
8,,SING,C4,C5,no,N,8,,185776,34311,PSU
9,,DOUB,C4,O4,no,N,9,,185776,34311,PSU
10,,DOUB,C5,C6,no,N,10,,185776,34311,PSU
11,,SING,C5,C1',no,N,11,,185776,34311,PSU
12,,SING,C6,H6,no,N,12,,185776,34311,PSU
13,,SING,C1',C2',no,N,13,,185776,34311,PSU
14,,SING,C1',O4',no,N,14,,185776,34311,PSU
15,,SING,C1',H1',no,N,15,,185776,34311,PSU
16,,SING,C2',O2',no,N,16,,185776,34311,PSU
17,,SING,C2',C3',no,N,17,,185776,34311,PSU
18,,SING,C2',H2',no,N,18,,185776,34311,PSU
19,,SING,O2',HO2',no,N,19,,185776,34311,PSU
20,,SING,C3',C4',no,N,20,,185776,34311,PSU
21,,SING,C3',O3',no,N,21,,185776,34311,PSU
22,,SING,C3',H3',no,N,22,,185776,34311,PSU
23,,SING,C4',O4',no,N,23,,185776,34311,PSU
24,,SING,C4',C5',no,N,24,,185776,34311,PSU
25,,SING,C4',H4',no,N,25,,185776,34311,PSU
26,,SING,O3',HO3',no,N,26,,185776,34311,PSU
27,,SING,C5',O5',no,N,27,,185776,34311,PSU
28,,SING,C5',H5',no,N,28,,185776,34311,PSU
29,,SING,C5',H5'',no,N,29,,185776,34311,PSU
30,,SING,O5',P,no,N,30,,185776,34311,PSU
31,,DOUB,P,OP1,no,N,31,,185776,34311,PSU
32,,SING,P,OP2,no,N,32,,185776,34311,PSU
33,,SING,P,OP3,no,N,33,,185776,34311,PSU
34,,SING,OP2,HOP2,no,N,34,,185776,34311,PSU
35,,SING,OP3,HOP3,no,N,35,,185776,34311,PSU
1,,SING,F4,C3,no,N,1,,185797,34312,GDZ
2,,DOUB,N11,C5,yes,N,2,,185797,34312,GDZ
3,,SING,N11,C9,yes,N,3,,185797,34312,GDZ
4,,SING,C10,C9,no,N,4,,185797,34312,GDZ
5,,SING,C3,C5,yes,N,5,,185797,34312,GDZ
6,,DOUB,C3,C2,yes,N,6,,185797,34312,GDZ
7,,SING,C5,N6,yes,N,7,,185797,34312,GDZ
8,,DOUB,C9,C8,yes,N,8,,185797,34312,GDZ
9,,SING,C2,C1,yes,N,9,,185797,34312,GDZ
10,,SING,N6,C8,yes,N,10,,185797,34312,GDZ
11,,SING,N6,C7,yes,N,11,,185797,34312,GDZ
12,,DOUB,C1,C7,yes,N,12,,185797,34312,GDZ
13,,SING,C1,C19,no,N,13,,185797,34312,GDZ
14,,SING,N18,C19,no,N,14,,185797,34312,GDZ
15,,DOUB,N18,C16,no,N,15,,185797,34312,GDZ
16,,DOUB,C19,C20,no,N,16,,185797,34312,GDZ
17,,SING,C17,C16,no,N,17,,185797,34312,GDZ
18,,DOUB,C17,C12,no,N,18,,185797,34312,GDZ
19,,SING,C16,N15,no,N,19,,185797,34312,GDZ
20,,SING,C20,C21,no,N,20,,185797,34312,GDZ
21,,SING,C12,C13,no,N,21,,185797,34312,GDZ
22,,SING,N15,C21,no,N,22,,185797,34312,GDZ
23,,SING,N15,C14,no,N,23,,185797,34312,GDZ
24,,DOUB,C21,O22,no,N,24,,185797,34312,GDZ
25,,DOUB,C14,C13,no,N,25,,185797,34312,GDZ
26,,SING,C13,N25,no,N,26,,185797,34312,GDZ
27,,SING,C24,N25,no,N,27,,185797,34312,GDZ
28,,SING,C24,C23,no,N,28,,185797,34312,GDZ
29,,SING,N25,C26,no,N,29,,185797,34312,GDZ
30,,SING,C23,N28,no,N,30,,185797,34312,GDZ
31,,SING,C26,C27,no,N,31,,185797,34312,GDZ
32,,SING,N28,C27,no,N,32,,185797,34312,GDZ
33,,SING,N28,C29,no,N,33,,185797,34312,GDZ
34,,SING,C24,H24B,no,N,34,,185797,34312,GDZ
35,,SING,C24,H24A,no,N,35,,185797,34312,GDZ
36,,SING,C23,H23A,no,N,36,,185797,34312,GDZ
37,,SING,C23,H23B,no,N,37,,185797,34312,GDZ
38,,SING,C29,H29A,no,N,38,,185797,34312,GDZ
39,,SING,C29,H29C,no,N,39,,185797,34312,GDZ
40,,SING,C29,H29B,no,N,40,,185797,34312,GDZ
41,,SING,C27,H27A,no,N,41,,185797,34312,GDZ
42,,SING,C27,H27B,no,N,42,,185797,34312,GDZ
43,,SING,C26,H26A,no,N,43,,185797,34312,GDZ
44,,SING,C26,H26B,no,N,44,,185797,34312,GDZ
45,,SING,C14,H14,no,N,45,,185797,34312,GDZ
46,,SING,C12,H12,no,N,46,,185797,34312,GDZ
47,,SING,C17,H17,no,N,47,,185797,34312,GDZ
48,,SING,C20,H20,no,N,48,,185797,34312,GDZ
49,,SING,C7,H7,no,N,49,,185797,34312,GDZ
50,,SING,C2,H2,no,N,50,,185797,34312,GDZ
51,,SING,C8,H8,no,N,51,,185797,34312,GDZ
52,,SING,C10,H10C,no,N,52,,185797,34312,GDZ
53,,SING,C10,H10B,no,N,53,,185797,34312,GDZ
54,,SING,C10,H10A,no,N,54,,185797,34312,GDZ
1,,SING,N1,C2,no,N,1,,185798,34312,PSU
2,,SING,N1,C6,no,N,2,,185798,34312,PSU
3,,SING,N1,HN1,no,N,3,,185798,34312,PSU
4,,SING,C2,N3,no,N,4,,185798,34312,PSU
5,,DOUB,C2,O2,no,N,5,,185798,34312,PSU
6,,SING,N3,C4,no,N,6,,185798,34312,PSU
7,,SING,N3,HN3,no,N,7,,185798,34312,PSU
8,,SING,C4,C5,no,N,8,,185798,34312,PSU
9,,DOUB,C4,O4,no,N,9,,185798,34312,PSU
10,,DOUB,C5,C6,no,N,10,,185798,34312,PSU
11,,SING,C5,C1',no,N,11,,185798,34312,PSU
12,,SING,C6,H6,no,N,12,,185798,34312,PSU
13,,SING,C1',C2',no,N,13,,185798,34312,PSU
14,,SING,C1',O4',no,N,14,,185798,34312,PSU
15,,SING,C1',H1',no,N,15,,185798,34312,PSU
16,,SING,C2',O2',no,N,16,,185798,34312,PSU
17,,SING,C2',C3',no,N,17,,185798,34312,PSU
18,,SING,C2',H2',no,N,18,,185798,34312,PSU
19,,SING,O2',HO2',no,N,19,,185798,34312,PSU
20,,SING,C3',C4',no,N,20,,185798,34312,PSU
21,,SING,C3',O3',no,N,21,,185798,34312,PSU
22,,SING,C3',H3',no,N,22,,185798,34312,PSU
23,,SING,C4',O4',no,N,23,,185798,34312,PSU
24,,SING,C4',C5',no,N,24,,185798,34312,PSU
25,,SING,C4',H4',no,N,25,,185798,34312,PSU
26,,SING,O3',HO3',no,N,26,,185798,34312,PSU
27,,SING,C5',O5',no,N,27,,185798,34312,PSU
28,,SING,C5',H5',no,N,28,,185798,34312,PSU
29,,SING,C5',H5'',no,N,29,,185798,34312,PSU
30,,SING,O5',P,no,N,30,,185798,34312,PSU
31,,DOUB,P,OP1,no,N,31,,185798,34312,PSU
32,,SING,P,OP2,no,N,32,,185798,34312,PSU
33,,SING,P,OP3,no,N,33,,185798,34312,PSU
34,,SING,OP2,HOP2,no,N,34,,185798,34312,PSU
35,,SING,OP3,HOP3,no,N,35,,185798,34312,PSU
1,,SING,N,HN1,no,N,1,,185834,34314,NH2
2,,SING,N,HN2,no,N,2,,185834,34314,NH2
1,,SING,N,HN1,no,N,1,,185851,34315,NH2
2,,SING,N,HN2,no,N,2,,185851,34315,NH2
1,,SING,N,HN1,no,N,1,,185868,34316,NH2
2,,SING,N,HN2,no,N,2,,185868,34316,NH2
1,,SING,C,CA,no,N,1,,185907,34319,E9M
2,,DOUB,C,O,no,N,2,,185907,34319,E9M
3,,SING,CA,N,no,N,3,,185907,34319,E9M
4,,SING,CA,CB,no,N,4,,185907,34319,E9M
5,,SING,N,CN2,no,N,5,,185907,34319,E9M
6,,DOUB,CE3,CZ3,yes,N,6,,185907,34319,E9M
7,,SING,CE3,CD2,yes,N,7,,185907,34319,E9M
8,,SING,CB,CG,no,N,8,,185907,34319,E9M
9,,SING,CZ3,CH2,yes,N,9,,185907,34319,E9M
10,,SING,CD2,CG,yes,N,10,,185907,34319,E9M
11,,DOUB,CD2,CE2,yes,N,11,,185907,34319,E9M
12,,DOUB,CG,CD1,yes,N,12,,185907,34319,E9M
13,,DOUB,CH2,CZ2,yes,N,13,,185907,34319,E9M
14,,SING,CE2,CZ2,yes,N,14,,185907,34319,E9M
15,,SING,CE2,NE1,yes,N,15,,185907,34319,E9M
16,,SING,CD1,NE1,yes,N,16,,185907,34319,E9M
17,,SING,C,OXT,no,N,17,,185907,34319,E9M
18,,SING,N,H,no,N,18,,185907,34319,E9M
19,,SING,CA,HA,no,N,19,,185907,34319,E9M
20,,SING,CD1,HD1,no,N,20,,185907,34319,E9M
21,,SING,CB,HB3,no,N,21,,185907,34319,E9M
22,,SING,CB,HB2,no,N,22,,185907,34319,E9M
23,,SING,CE3,HE3,no,N,23,,185907,34319,E9M
24,,SING,NE1,HE1,no,N,24,,185907,34319,E9M
25,,SING,CZ3,HZ3,no,N,25,,185907,34319,E9M
26,,SING,CZ2,HZ2,no,N,26,,185907,34319,E9M
27,,SING,CH2,HH2,no,N,27,,185907,34319,E9M
28,,SING,CN2,HN3,no,N,28,,185907,34319,E9M
29,,SING,CN2,HN1,no,N,29,,185907,34319,E9M
30,,SING,CN2,HN2,no,N,30,,185907,34319,E9M
31,,SING,OXT,HXT,no,N,31,,185907,34319,E9M
1,,DOUB,C,O,no,N,1,,185924,34320,ACE
2,,SING,C,CH3,no,N,2,,185924,34320,ACE
3,,SING,C,H,no,N,3,,185924,34320,ACE
4,,SING,CH3,H1,no,N,4,,185924,34320,ACE
5,,SING,CH3,H2,no,N,5,,185924,34320,ACE
6,,SING,CH3,H3,no,N,6,,185924,34320,ACE
1,,SING,N,HN1,no,N,1,,185925,34320,NH2
2,,SING,N,HN2,no,N,2,,185925,34320,NH2
1,,SING,N1,C2,no,N,1,,185985,34323,PSU
2,,SING,N1,C6,no,N,2,,185985,34323,PSU
3,,SING,N1,HN1,no,N,3,,185985,34323,PSU
4,,SING,C2,N3,no,N,4,,185985,34323,PSU
5,,DOUB,C2,O2,no,N,5,,185985,34323,PSU
6,,SING,N3,C4,no,N,6,,185985,34323,PSU
7,,SING,N3,HN3,no,N,7,,185985,34323,PSU
8,,SING,C4,C5,no,N,8,,185985,34323,PSU
9,,DOUB,C4,O4,no,N,9,,185985,34323,PSU
10,,DOUB,C5,C6,no,N,10,,185985,34323,PSU
11,,SING,C5,C1',no,N,11,,185985,34323,PSU
12,,SING,C6,H6,no,N,12,,185985,34323,PSU
13,,SING,C1',C2',no,N,13,,185985,34323,PSU
14,,SING,C1',O4',no,N,14,,185985,34323,PSU
15,,SING,C1',H1',no,N,15,,185985,34323,PSU
16,,SING,C2',O2',no,N,16,,185985,34323,PSU
17,,SING,C2',C3',no,N,17,,185985,34323,PSU
18,,SING,C2',H2',no,N,18,,185985,34323,PSU
19,,SING,O2',HO2',no,N,19,,185985,34323,PSU
20,,SING,C3',C4',no,N,20,,185985,34323,PSU
21,,SING,C3',O3',no,N,21,,185985,34323,PSU
22,,SING,C3',H3',no,N,22,,185985,34323,PSU
23,,SING,C4',O4',no,N,23,,185985,34323,PSU
24,,SING,C4',C5',no,N,24,,185985,34323,PSU
25,,SING,C4',H4',no,N,25,,185985,34323,PSU
26,,SING,O3',HO3',no,N,26,,185985,34323,PSU
27,,SING,C5',O5',no,N,27,,185985,34323,PSU
28,,SING,C5',H5',no,N,28,,185985,34323,PSU
29,,SING,C5',H5'',no,N,29,,185985,34323,PSU
30,,SING,O5',P,no,N,30,,185985,34323,PSU
31,,DOUB,P,OP1,no,N,31,,185985,34323,PSU
32,,SING,P,OP2,no,N,32,,185985,34323,PSU
33,,SING,P,OP3,no,N,33,,185985,34323,PSU
34,,SING,OP2,HOP2,no,N,34,,185985,34323,PSU
35,,SING,OP3,HOP3,no,N,35,,185985,34323,PSU
1,,SING,N1,C2,no,N,1,,186006,34324,PSU
2,,SING,N1,C6,no,N,2,,186006,34324,PSU
3,,SING,N1,HN1,no,N,3,,186006,34324,PSU
4,,SING,C2,N3,no,N,4,,186006,34324,PSU
5,,DOUB,C2,O2,no,N,5,,186006,34324,PSU
6,,SING,N3,C4,no,N,6,,186006,34324,PSU
7,,SING,N3,HN3,no,N,7,,186006,34324,PSU
8,,SING,C4,C5,no,N,8,,186006,34324,PSU
9,,DOUB,C4,O4,no,N,9,,186006,34324,PSU
10,,DOUB,C5,C6,no,N,10,,186006,34324,PSU
11,,SING,C5,C1',no,N,11,,186006,34324,PSU
12,,SING,C6,H6,no,N,12,,186006,34324,PSU
13,,SING,C1',C2',no,N,13,,186006,34324,PSU
14,,SING,C1',O4',no,N,14,,186006,34324,PSU
15,,SING,C1',H1',no,N,15,,186006,34324,PSU
16,,SING,C2',O2',no,N,16,,186006,34324,PSU
17,,SING,C2',C3',no,N,17,,186006,34324,PSU
18,,SING,C2',H2',no,N,18,,186006,34324,PSU
19,,SING,O2',HO2',no,N,19,,186006,34324,PSU
20,,SING,C3',C4',no,N,20,,186006,34324,PSU
21,,SING,C3',O3',no,N,21,,186006,34324,PSU
22,,SING,C3',H3',no,N,22,,186006,34324,PSU
23,,SING,C4',O4',no,N,23,,186006,34324,PSU
24,,SING,C4',C5',no,N,24,,186006,34324,PSU
25,,SING,C4',H4',no,N,25,,186006,34324,PSU
26,,SING,O3',HO3',no,N,26,,186006,34324,PSU
27,,SING,C5',O5',no,N,27,,186006,34324,PSU
28,,SING,C5',H5',no,N,28,,186006,34324,PSU
29,,SING,C5',H5'',no,N,29,,186006,34324,PSU
30,,SING,O5',P,no,N,30,,186006,34324,PSU
31,,DOUB,P,OP1,no,N,31,,186006,34324,PSU
32,,SING,P,OP2,no,N,32,,186006,34324,PSU
33,,SING,P,OP3,no,N,33,,186006,34324,PSU
34,,SING,OP2,HOP2,no,N,34,,186006,34324,PSU
35,,SING,OP3,HOP3,no,N,35,,186006,34324,PSU
1,,SING,O3',C3',no,N,1,,186064,34328,DP
2,,SING,C3',C2',no,N,2,,186064,34328,DP
3,,SING,C3',C4',no,N,3,,186064,34328,DP
4,,SING,C2',C1',no,N,4,,186064,34328,DP
5,,DOUB,OP1,P,no,N,5,,186064,34328,DP
6,,SING,OP2,P,no,N,6,,186064,34328,DP
7,,SING,O5',C5',no,N,7,,186064,34328,DP
8,,SING,O5',P,no,N,8,,186064,34328,DP
9,,SING,C4',C5',no,N,9,,186064,34328,DP
10,,SING,C4',O4',no,N,10,,186064,34328,DP
11,,SING,C1',O4',no,N,11,,186064,34328,DP
12,,SING,C1',N9,no,N,12,,186064,34328,DP
13,,SING,N9,C8,no,N,13,,186064,34328,DP
14,,SING,N9,C4,no,N,14,,186064,34328,DP
15,,DOUB,N3,C4,no,N,15,,186064,34328,DP
16,,SING,N3,C2,no,N,16,,186064,34328,DP
17,,DOUB,C8,C7,no,N,17,,186064,34328,DP
18,,SING,C4,N5,no,N,18,,186064,34328,DP
19,,SING,N2,C2,no,N,19,,186064,34328,DP
20,,DOUB,C2,N1,no,N,20,,186064,34328,DP
21,,SING,C7,N5,no,N,21,,186064,34328,DP
22,,SING,N5,C6,no,N,22,,186064,34328,DP
23,,SING,N1,C6,no,N,23,,186064,34328,DP
24,,DOUB,C6,O6,no,N,24,,186064,34328,DP
25,,SING,P,OP3,no,N,25,,186064,34328,DP
26,,SING,OP2,H1,no,N,26,,186064,34328,DP
27,,SING,C5',H5'',no,N,27,,186064,34328,DP
28,,SING,C5',H5',no,N,28,,186064,34328,DP
29,,SING,C4',H4',no,N,29,,186064,34328,DP
30,,SING,C1',H1',no,N,30,,186064,34328,DP
31,,SING,C8,H8,no,N,31,,186064,34328,DP
32,,SING,C7,H7,no,N,32,,186064,34328,DP
33,,SING,N2,H22,no,N,33,,186064,34328,DP
34,,SING,N2,H21,no,N,34,,186064,34328,DP
35,,SING,C2',H2'',no,N,35,,186064,34328,DP
36,,SING,C2',H2',no,N,36,,186064,34328,DP
37,,SING,C3',H3',no,N,37,,186064,34328,DP
38,,SING,O3',H3,no,N,38,,186064,34328,DP
39,,SING,OP3,H4,no,N,39,,186064,34328,DP
1,,DOUB,OP2,P,no,N,1,,186065,34328,DZ
2,,SING,ON1,N,no,N,2,,186065,34328,DZ
3,,SING,OP1,P,no,N,3,,186065,34328,DZ
4,,SING,P,O5',no,N,4,,186065,34328,DZ
5,,SING,O5',C5',no,N,5,,186065,34328,DZ
6,,DOUB,N,ON2,no,N,6,,186065,34328,DZ
7,,SING,N,C5,no,N,7,,186065,34328,DZ
8,,SING,C3',C2',no,N,8,,186065,34328,DZ
9,,SING,C3',O3',no,N,9,,186065,34328,DZ
10,,SING,C3',C4',no,N,10,,186065,34328,DZ
11,,SING,C2',C1',no,N,11,,186065,34328,DZ
12,,SING,C5',C4',no,N,12,,186065,34328,DZ
13,,SING,C6,C5,no,N,13,,186065,34328,DZ
14,,DOUB,C6,C1,no,N,14,,186065,34328,DZ
15,,DOUB,C5,C4,no,N,15,,186065,34328,DZ
16,,SING,C4',O4',no,N,16,,186065,34328,DZ
17,,SING,C1',C1,no,N,17,,186065,34328,DZ
18,,SING,C1',O4',no,N,18,,186065,34328,DZ
19,,SING,C1,C2,no,N,19,,186065,34328,DZ
20,,SING,C4,N4,no,N,20,,186065,34328,DZ
21,,SING,C4,N3,no,N,21,,186065,34328,DZ
22,,SING,N3,C2,no,N,22,,186065,34328,DZ
23,,DOUB,C2,O2,no,N,23,,186065,34328,DZ
24,,SING,P,OP3,no,N,24,,186065,34328,DZ
25,,SING,OP1,H1,no,N,25,,186065,34328,DZ
26,,SING,C5',H5'',no,N,26,,186065,34328,DZ
27,,SING,C5',H5',no,N,27,,186065,34328,DZ
28,,SING,C4',H4',no,N,28,,186065,34328,DZ
29,,SING,C1',H1',no,N,29,,186065,34328,DZ
30,,SING,N3,H3,no,N,30,,186065,34328,DZ
31,,SING,C6,H6,no,N,31,,186065,34328,DZ
32,,SING,N4,H42,no,N,32,,186065,34328,DZ
33,,SING,N4,H41,no,N,33,,186065,34328,DZ
34,,SING,C2',H2'',no,N,34,,186065,34328,DZ
35,,SING,C2',H2',no,N,35,,186065,34328,DZ
36,,SING,C3',H3',no,N,36,,186065,34328,DZ
37,,SING,O3',H2,no,N,37,,186065,34328,DZ
38,,SING,OP3,H4,no,N,38,,186065,34328,DZ
1,,SING,OP3,P,no,N,1,,186137,34331,8OG
2,,SING,OP3,HOP3,no,N,2,,186137,34331,8OG
3,,DOUB,P,OP1,no,N,3,,186137,34331,8OG
4,,SING,P,OP2,no,N,4,,186137,34331,8OG
5,,SING,P,O5',no,N,5,,186137,34331,8OG
6,,SING,OP2,HOP2,no,N,6,,186137,34331,8OG
7,,SING,O5',C5',no,N,7,,186137,34331,8OG
8,,SING,C5',C4',no,N,8,,186137,34331,8OG
9,,SING,C5',H5',no,N,9,,186137,34331,8OG
10,,SING,C5',H5'',no,N,10,,186137,34331,8OG
11,,SING,C4',O4',no,N,11,,186137,34331,8OG
12,,SING,C4',C3',no,N,12,,186137,34331,8OG
13,,SING,C4',H4',no,N,13,,186137,34331,8OG
14,,SING,O4',C1',no,N,14,,186137,34331,8OG
15,,SING,C3',O3',no,N,15,,186137,34331,8OG
16,,SING,C3',C2',no,N,16,,186137,34331,8OG
17,,SING,C3',H3',no,N,17,,186137,34331,8OG
18,,SING,O3',HO3',no,N,18,,186137,34331,8OG
19,,SING,C2',C1',no,N,19,,186137,34331,8OG
20,,SING,C2',H2',no,N,20,,186137,34331,8OG
21,,SING,C2',H2'',no,N,21,,186137,34331,8OG
22,,SING,C1',N9,no,N,22,,186137,34331,8OG
23,,SING,C1',H1',no,N,23,,186137,34331,8OG
24,,SING,N9,C8,no,N,24,,186137,34331,8OG
25,,SING,N9,C4,no,N,25,,186137,34331,8OG
26,,SING,C8,N7,no,N,26,,186137,34331,8OG
27,,DOUB,C8,O8,no,N,27,,186137,34331,8OG
28,,SING,N7,C5,no,N,28,,186137,34331,8OG
29,,SING,N7,H7,no,N,29,,186137,34331,8OG
30,,SING,C5,C6,no,N,30,,186137,34331,8OG
31,,DOUB,C5,C4,no,N,31,,186137,34331,8OG
32,,DOUB,C6,O6,no,N,32,,186137,34331,8OG
33,,SING,C6,N1,no,N,33,,186137,34331,8OG
34,,SING,N1,C2,no,N,34,,186137,34331,8OG
35,,SING,N1,H1,no,N,35,,186137,34331,8OG
36,,SING,C2,N2,no,N,36,,186137,34331,8OG
37,,DOUB,C2,N3,no,N,37,,186137,34331,8OG
38,,SING,N2,H21,no,N,38,,186137,34331,8OG
39,,SING,N2,H22,no,N,39,,186137,34331,8OG
40,,SING,N3,C4,no,N,40,,186137,34331,8OG
1,,SING,OP3,P,no,N,1,,186154,34332,8OG
2,,SING,OP3,HOP3,no,N,2,,186154,34332,8OG
3,,DOUB,P,OP1,no,N,3,,186154,34332,8OG
4,,SING,P,OP2,no,N,4,,186154,34332,8OG
5,,SING,P,O5',no,N,5,,186154,34332,8OG
6,,SING,OP2,HOP2,no,N,6,,186154,34332,8OG
7,,SING,O5',C5',no,N,7,,186154,34332,8OG
8,,SING,C5',C4',no,N,8,,186154,34332,8OG
9,,SING,C5',H5',no,N,9,,186154,34332,8OG
10,,SING,C5',H5'',no,N,10,,186154,34332,8OG
11,,SING,C4',O4',no,N,11,,186154,34332,8OG
12,,SING,C4',C3',no,N,12,,186154,34332,8OG
13,,SING,C4',H4',no,N,13,,186154,34332,8OG
14,,SING,O4',C1',no,N,14,,186154,34332,8OG
15,,SING,C3',O3',no,N,15,,186154,34332,8OG
16,,SING,C3',C2',no,N,16,,186154,34332,8OG
17,,SING,C3',H3',no,N,17,,186154,34332,8OG
18,,SING,O3',HO3',no,N,18,,186154,34332,8OG
19,,SING,C2',C1',no,N,19,,186154,34332,8OG
20,,SING,C2',H2',no,N,20,,186154,34332,8OG
21,,SING,C2',H2'',no,N,21,,186154,34332,8OG
22,,SING,C1',N9,no,N,22,,186154,34332,8OG
23,,SING,C1',H1',no,N,23,,186154,34332,8OG
24,,SING,N9,C8,no,N,24,,186154,34332,8OG
25,,SING,N9,C4,no,N,25,,186154,34332,8OG
26,,SING,C8,N7,no,N,26,,186154,34332,8OG
27,,DOUB,C8,O8,no,N,27,,186154,34332,8OG
28,,SING,N7,C5,no,N,28,,186154,34332,8OG
29,,SING,N7,H7,no,N,29,,186154,34332,8OG
30,,SING,C5,C6,no,N,30,,186154,34332,8OG
31,,DOUB,C5,C4,no,N,31,,186154,34332,8OG
32,,DOUB,C6,O6,no,N,32,,186154,34332,8OG
33,,SING,C6,N1,no,N,33,,186154,34332,8OG
34,,SING,N1,C2,no,N,34,,186154,34332,8OG
35,,SING,N1,H1,no,N,35,,186154,34332,8OG
36,,SING,C2,N2,no,N,36,,186154,34332,8OG
37,,DOUB,C2,N3,no,N,37,,186154,34332,8OG
38,,SING,N2,H21,no,N,38,,186154,34332,8OG
39,,SING,N2,H22,no,N,39,,186154,34332,8OG
40,,SING,N3,C4,no,N,40,,186154,34332,8OG
1,,DOUB,C,O,no,N,1,,186251,34337,ACE
2,,SING,C,CH3,no,N,2,,186251,34337,ACE
3,,SING,C,H,no,N,3,,186251,34337,ACE
4,,SING,CH3,H1,no,N,4,,186251,34337,ACE
5,,SING,CH3,H2,no,N,5,,186251,34337,ACE
6,,SING,CH3,H3,no,N,6,,186251,34337,ACE
1,,SING,N,HN1,no,N,1,,186252,34337,NH2
2,,SING,N,HN2,no,N,2,,186252,34337,NH2
1,,SING,N,CA,no,N,1,,186285,34339,ABA
2,,SING,N,H,no,N,2,,186285,34339,ABA
3,,SING,N,HN2,no,N,3,,186285,34339,ABA
4,,SING,CA,C,no,N,4,,186285,34339,ABA
5,,SING,CA,CB,no,N,5,,186285,34339,ABA
6,,SING,CA,HA,no,N,6,,186285,34339,ABA
7,,DOUB,C,O,no,N,7,,186285,34339,ABA
8,,SING,C,OXT,no,N,8,,186285,34339,ABA
9,,SING,CB,CG,no,N,9,,186285,34339,ABA
10,,SING,CB,HB3,no,N,10,,186285,34339,ABA
11,,SING,CB,HB2,no,N,11,,186285,34339,ABA
12,,SING,CG,HG1,no,N,12,,186285,34339,ABA
13,,SING,CG,HG3,no,N,13,,186285,34339,ABA
14,,SING,CG,HG2,no,N,14,,186285,34339,ABA
15,,SING,OXT,HXT,no,N,15,,186285,34339,ABA
1,,SING,N,HN1,no,N,1,,186286,34339,NH2
2,,SING,N,HN2,no,N,2,,186286,34339,NH2
1,,SING,N,CA,no,N,1,,186287,34339,NLE
2,,SING,N,H,no,N,2,,186287,34339,NLE
3,,SING,N,HN2,no,N,3,,186287,34339,NLE
4,,SING,CA,C,no,N,4,,186287,34339,NLE
5,,SING,CA,CB,no,N,5,,186287,34339,NLE
6,,SING,CA,HA,no,N,6,,186287,34339,NLE
7,,DOUB,C,O,no,N,7,,186287,34339,NLE
8,,SING,C,OXT,no,N,8,,186287,34339,NLE
9,,SING,OXT,HXT,no,N,9,,186287,34339,NLE
10,,SING,CB,CG,no,N,10,,186287,34339,NLE
11,,SING,CB,HB2,no,N,11,,186287,34339,NLE
12,,SING,CB,HB3,no,N,12,,186287,34339,NLE
13,,SING,CG,CD,no,N,13,,186287,34339,NLE
14,,SING,CG,HG2,no,N,14,,186287,34339,NLE
15,,SING,CG,HG3,no,N,15,,186287,34339,NLE
16,,SING,CD,CE,no,N,16,,186287,34339,NLE
17,,SING,CD,HD2,no,N,17,,186287,34339,NLE
18,,SING,CD,HD3,no,N,18,,186287,34339,NLE
19,,SING,CE,HE1,no,N,19,,186287,34339,NLE
20,,SING,CE,HE2,no,N,20,,186287,34339,NLE
21,,SING,CE,HE3,no,N,21,,186287,34339,NLE
1,,SING,N,CA,no,N,1,,186394,34345,AAR
2,,SING,N,H,no,N,2,,186394,34345,AAR
3,,SING,N,H2,no,N,3,,186394,34345,AAR
4,,SING,CA,CB,no,N,4,,186394,34345,AAR
5,,SING,CA,C,no,N,5,,186394,34345,AAR
6,,SING,CA,HA,no,N,6,,186394,34345,AAR
7,,SING,CB,CG,no,N,7,,186394,34345,AAR
8,,SING,CB,HB2,no,N,8,,186394,34345,AAR
9,,SING,CB,HB3,no,N,9,,186394,34345,AAR
10,,SING,CG,CD,no,N,10,,186394,34345,AAR
11,,SING,CG,HG2,no,N,11,,186394,34345,AAR
12,,SING,CG,HG3,no,N,12,,186394,34345,AAR
13,,SING,CD,NE,no,N,13,,186394,34345,AAR
14,,SING,CD,HD2,no,N,14,,186394,34345,AAR
15,,SING,CD,HD3,no,N,15,,186394,34345,AAR
16,,SING,NE,CZ,no,N,16,,186394,34345,AAR
17,,SING,NE,HE,no,N,17,,186394,34345,AAR
18,,SING,CZ,NH1,no,N,18,,186394,34345,AAR
19,,DOUB,CZ,NH2,no,N,19,,186394,34345,AAR
20,,SING,NH1,HH11,no,N,20,,186394,34345,AAR
21,,SING,NH1,HH12,no,N,21,,186394,34345,AAR
22,,SING,NH2,HH21,no,N,22,,186394,34345,AAR
23,,SING,NH2,HH22,no,N,23,,186394,34345,AAR
24,,DOUB,C,O,no,N,24,,186394,34345,AAR
25,,SING,C,NT,no,N,25,,186394,34345,AAR
26,,SING,NT,HNT1,no,N,26,,186394,34345,AAR
27,,SING,NT,HNT2,no,N,27,,186394,34345,AAR
1,,SING,N,CA,no,N,1,,186411,34346,AAR
2,,SING,N,H,no,N,2,,186411,34346,AAR
3,,SING,N,H2,no,N,3,,186411,34346,AAR
4,,SING,CA,CB,no,N,4,,186411,34346,AAR
5,,SING,CA,C,no,N,5,,186411,34346,AAR
6,,SING,CA,HA,no,N,6,,186411,34346,AAR
7,,SING,CB,CG,no,N,7,,186411,34346,AAR
8,,SING,CB,HB2,no,N,8,,186411,34346,AAR
9,,SING,CB,HB3,no,N,9,,186411,34346,AAR
10,,SING,CG,CD,no,N,10,,186411,34346,AAR
11,,SING,CG,HG2,no,N,11,,186411,34346,AAR
12,,SING,CG,HG3,no,N,12,,186411,34346,AAR
13,,SING,CD,NE,no,N,13,,186411,34346,AAR
14,,SING,CD,HD2,no,N,14,,186411,34346,AAR
15,,SING,CD,HD3,no,N,15,,186411,34346,AAR
16,,SING,NE,CZ,no,N,16,,186411,34346,AAR
17,,SING,NE,HE,no,N,17,,186411,34346,AAR
18,,SING,CZ,NH1,no,N,18,,186411,34346,AAR
19,,DOUB,CZ,NH2,no,N,19,,186411,34346,AAR
20,,SING,NH1,HH11,no,N,20,,186411,34346,AAR
21,,SING,NH1,HH12,no,N,21,,186411,34346,AAR
22,,SING,NH2,HH21,no,N,22,,186411,34346,AAR
23,,SING,NH2,HH22,no,N,23,,186411,34346,AAR
24,,DOUB,C,O,no,N,24,,186411,34346,AAR
25,,SING,C,NT,no,N,25,,186411,34346,AAR
26,,SING,NT,HNT1,no,N,26,,186411,34346,AAR
27,,SING,NT,HNT2,no,N,27,,186411,34346,AAR
1,,SING,N,CA,no,N,1,,186412,34346,PCA
2,,SING,N,CD,no,N,2,,186412,34346,PCA
3,,SING,N,H,no,N,3,,186412,34346,PCA
4,,SING,CA,CB,no,N,4,,186412,34346,PCA
5,,SING,CA,C,no,N,5,,186412,34346,PCA
6,,SING,CA,HA,no,N,6,,186412,34346,PCA
7,,SING,CB,CG,no,N,7,,186412,34346,PCA
8,,SING,CB,HB2,no,N,8,,186412,34346,PCA
9,,SING,CB,HB3,no,N,9,,186412,34346,PCA
10,,SING,CG,CD,no,N,10,,186412,34346,PCA
11,,SING,CG,HG2,no,N,11,,186412,34346,PCA
12,,SING,CG,HG3,no,N,12,,186412,34346,PCA
13,,DOUB,CD,OE,no,N,13,,186412,34346,PCA
14,,DOUB,C,O,no,N,14,,186412,34346,PCA
15,,SING,C,OXT,no,N,15,,186412,34346,PCA
16,,SING,OXT,HXT,no,N,16,,186412,34346,PCA
1,,DOUB,C1,N3,yes,N,1,,186431,34347,AZM
2,,SING,C1,S1,no,N,2,,186431,34347,AZM
3,,SING,C1,S2,yes,N,3,,186431,34347,AZM
4,,DOUB,C2,N2,yes,N,4,,186431,34347,AZM
5,,SING,C2,N4,no,N,5,,186431,34347,AZM
6,,SING,C2,S2,yes,N,6,,186431,34347,AZM
7,,SING,C3,C4,no,N,7,,186431,34347,AZM
8,,SING,C3,N4,no,N,8,,186431,34347,AZM
9,,DOUB,C3,O3,no,N,9,,186431,34347,AZM
10,,SING,C4,H41,no,N,10,,186431,34347,AZM
11,,SING,C4,H42,no,N,11,,186431,34347,AZM
12,,SING,C4,H43,no,N,12,,186431,34347,AZM
13,,SING,N1,S1,no,N,13,,186431,34347,AZM
14,,SING,N1,HN11,no,N,14,,186431,34347,AZM
15,,SING,N1,HN12,no,N,15,,186431,34347,AZM
16,,SING,N2,N3,yes,N,16,,186431,34347,AZM
17,,SING,N4,HN4,no,N,17,,186431,34347,AZM
18,,DOUB,O1,S1,no,N,18,,186431,34347,AZM
19,,DOUB,O2,S1,no,N,19,,186431,34347,AZM
1,,SING,N,CA,no,N,1,,186481,3435,AYA
2,,SING,N,CT,no,N,2,,186481,3435,AYA
3,,SING,N,H,no,N,3,,186481,3435,AYA
4,,SING,CA,CB,no,N,4,,186481,3435,AYA
5,,SING,CA,C,no,N,5,,186481,3435,AYA
6,,SING,CA,HA,no,N,6,,186481,3435,AYA
7,,SING,CB,HB1,no,N,7,,186481,3435,AYA
8,,SING,CB,HB2,no,N,8,,186481,3435,AYA
9,,SING,CB,HB3,no,N,9,,186481,3435,AYA
10,,DOUB,C,O,no,N,10,,186481,3435,AYA
11,,SING,C,OXT,no,N,11,,186481,3435,AYA
12,,SING,OXT,HXT,no,N,12,,186481,3435,AYA
13,,DOUB,CT,OT,no,N,13,,186481,3435,AYA
14,,SING,CT,CM,no,N,14,,186481,3435,AYA
15,,SING,CM,HM1,no,N,15,,186481,3435,AYA
16,,SING,CM,HM2,no,N,16,,186481,3435,AYA
17,,SING,CM,HM3,no,N,17,,186481,3435,AYA
1,,DOUB,C3,C2,yes,N,1,,186553,34353,J32
2,,SING,C3,C3A,yes,N,2,,186553,34353,J32
3,,SING,C2,C1,yes,N,3,,186553,34353,J32
4,,DOUB,C4,C3A,yes,N,4,,186553,34353,J32
5,,SING,C4,C5,yes,N,5,,186553,34353,J32
6,,SING,C3A,C1A,yes,N,6,,186553,34353,J32
7,,DOUB,C1,C1C,yes,N,7,,186553,34353,J32
8,,DOUB,C5,C5A,yes,N,8,,186553,34353,J32
9,,SING,C1A,C1C,yes,N,9,,186553,34353,J32
10,,DOUB,C1A,C1B,yes,N,10,,186553,34353,J32
11,,SING,C1C,C10,yes,N,11,,186553,34353,J32
12,,SING,C5A,C1B,yes,N,12,,186553,34353,J32
13,,SING,C5A,C6,yes,N,13,,186553,34353,J32
14,,SING,C1B,C8A,yes,N,14,,186553,34353,J32
15,,DOUB,C11,C12,yes,N,15,,186553,34353,J32
16,,SING,C11,C4A,yes,N,16,,186553,34353,J32
17,,DOUB,C10,C9,yes,N,17,,186553,34353,J32
18,,SING,C12,C2A,yes,N,18,,186553,34353,J32
19,,SING,C6,C16,no,N,19,,186553,34353,J32
20,,DOUB,C6,C7,yes,N,20,,186553,34353,J32
21,,TRIP,C16,C15,no,N,21,,186553,34353,J32
22,,SING,C15,C4A,no,N,22,,186553,34353,J32
23,,DOUB,C4A,C14,yes,N,23,,186553,34353,J32
24,,SING,C8A,C9,yes,N,24,,186553,34353,J32
25,,DOUB,C8A,C8,yes,N,25,,186553,34353,J32
26,,SING,C2A,C4',no,N,26,,186553,34353,J32
27,,DOUB,C2A,C13,yes,N,27,,186553,34353,J32
28,,SING,C7,C8,yes,N,28,,186553,34353,J32
29,,SING,C4',O1,no,N,29,,186553,34353,J32
30,,SING,C14,C13,yes,N,30,,186553,34353,J32
31,,SING,O1,C3',no,N,31,,186553,34353,J32
32,,SING,C3',C2',no,N,32,,186553,34353,J32
33,,SING,C2',C1',no,N,33,,186553,34353,J32
34,,SING,C2',O5',no,N,34,,186553,34353,J32
35,,SING,C1',O3',no,N,35,,186553,34353,J32
36,,SING,O5',P,no,N,36,,186553,34353,J32
37,,SING,P,OP2,no,N,37,,186553,34353,J32
38,,DOUB,P,OP1,no,N,38,,186553,34353,J32
39,,SING,C1,H1,no,N,39,,186553,34353,J32
40,,SING,C2,H2,no,N,40,,186553,34353,J32
41,,SING,C3,H3,no,N,41,,186553,34353,J32
42,,SING,C4,H4,no,N,42,,186553,34353,J32
43,,SING,C5,H5,no,N,43,,186553,34353,J32
44,,SING,C7,H7,no,N,44,,186553,34353,J32
45,,SING,OP2,H15,no,N,45,,186553,34353,J32
46,,SING,C2',H2',no,N,46,,186553,34353,J32
47,,SING,C3',H3',no,N,47,,186553,34353,J32
48,,SING,C3',H3'',no,N,48,,186553,34353,J32
49,,SING,C4',H4',no,N,49,,186553,34353,J32
50,,SING,C4',H4'',no,N,50,,186553,34353,J32
51,,SING,C12,H12,no,N,51,,186553,34353,J32
52,,SING,C11,H11,no,N,52,,186553,34353,J32
53,,SING,C14,H14,no,N,53,,186553,34353,J32
54,,SING,C13,H13,no,N,54,,186553,34353,J32
55,,SING,C8,H8,no,N,55,,186553,34353,J32
56,,SING,C10,H10,no,N,56,,186553,34353,J32
57,,SING,C9,H9,no,N,57,,186553,34353,J32
58,,SING,C1',H1'',no,N,58,,186553,34353,J32
59,,SING,C1',H1',no,N,59,,186553,34353,J32
60,,SING,O3',H16,no,N,60,,186553,34353,J32
61,,SING,P,OP3,no,N,61,,186553,34353,J32
62,,SING,OP3,HP3,no,N,62,,186553,34353,J32
1,,SING,N,CA,no,N,1,,186691,3436,AYA
2,,SING,N,CT,no,N,2,,186691,3436,AYA
3,,SING,N,H,no,N,3,,186691,3436,AYA
4,,SING,CA,CB,no,N,4,,186691,3436,AYA
5,,SING,CA,C,no,N,5,,186691,3436,AYA
6,,SING,CA,HA,no,N,6,,186691,3436,AYA
7,,SING,CB,HB1,no,N,7,,186691,3436,AYA
8,,SING,CB,HB2,no,N,8,,186691,3436,AYA
9,,SING,CB,HB3,no,N,9,,186691,3436,AYA
10,,DOUB,C,O,no,N,10,,186691,3436,AYA
11,,SING,C,OXT,no,N,11,,186691,3436,AYA
12,,SING,OXT,HXT,no,N,12,,186691,3436,AYA
13,,DOUB,CT,OT,no,N,13,,186691,3436,AYA
14,,SING,CT,CM,no,N,14,,186691,3436,AYA
15,,SING,CM,HM1,no,N,15,,186691,3436,AYA
16,,SING,CM,HM2,no,N,16,,186691,3436,AYA
17,,SING,CM,HM3,no,N,17,,186691,3436,AYA
1,,SING,N,CA,no,N,1,,186706,34360,DAL
2,,SING,N,H,no,N,2,,186706,34360,DAL
3,,SING,N,H2,no,N,3,,186706,34360,DAL
4,,SING,CA,CB,no,N,4,,186706,34360,DAL
5,,SING,CA,C,no,N,5,,186706,34360,DAL
6,,SING,CA,HA,no,N,6,,186706,34360,DAL
7,,SING,CB,HB1,no,N,7,,186706,34360,DAL
8,,SING,CB,HB2,no,N,8,,186706,34360,DAL
9,,SING,CB,HB3,no,N,9,,186706,34360,DAL
10,,DOUB,C,O,no,N,10,,186706,34360,DAL
11,,SING,C,OXT,no,N,11,,186706,34360,DAL
12,,SING,OXT,HXT,no,N,12,,186706,34360,DAL
1,,SING,N,CA,no,N,1,,186763,34363,DCY
2,,SING,N,H,no,N,2,,186763,34363,DCY
3,,SING,N,H2,no,N,3,,186763,34363,DCY
4,,SING,CA,C,no,N,4,,186763,34363,DCY
5,,SING,CA,CB,no,N,5,,186763,34363,DCY
6,,SING,CA,HA,no,N,6,,186763,34363,DCY
7,,DOUB,C,O,no,N,7,,186763,34363,DCY
8,,SING,C,OXT,no,N,8,,186763,34363,DCY
9,,SING,CB,SG,no,N,9,,186763,34363,DCY
10,,SING,CB,HB2,no,N,10,,186763,34363,DCY
11,,SING,CB,HB3,no,N,11,,186763,34363,DCY
12,,SING,SG,HG,no,N,12,,186763,34363,DCY
13,,SING,OXT,HXT,no,N,13,,186763,34363,DCY
1,,SING,CG,NG2,no,N,1,,186799,34366,JKH
2,,SING,CG,CB,no,N,2,,186799,34366,JKH
3,,SING,CG,CD,no,N,3,,186799,34366,JKH
4,,SING,CB,CA,no,N,4,,186799,34366,JKH
5,,SING,CD,N,no,N,5,,186799,34366,JKH
6,,SING,CA,N,no,N,6,,186799,34366,JKH
7,,SING,CA,C,no,N,7,,186799,34366,JKH
8,,DOUB,O,C,no,N,8,,186799,34366,JKH
9,,SING,C,OXT,no,N,9,,186799,34366,JKH
10,,SING,N,H1,no,N,10,,186799,34366,JKH
11,,SING,CA,HA,no,N,11,,186799,34366,JKH
12,,SING,CD,HD2,no,N,12,,186799,34366,JKH
13,,SING,CD,HD3,no,N,13,,186799,34366,JKH
14,,SING,CB,HB3,no,N,14,,186799,34366,JKH
15,,SING,CB,HB2,no,N,15,,186799,34366,JKH
16,,SING,CG,HG,no,N,16,,186799,34366,JKH
17,,SING,NG2,HG22,no,N,17,,186799,34366,JKH
18,,SING,NG2,HG21,no,N,18,,186799,34366,JKH
19,,SING,OXT,HXT,no,N,19,,186799,34366,JKH
20,,SING,NG2,HG23,no,N,20,,186799,34366,JKH
1,,SING,N,HN1,no,N,1,,186800,34366,NH2
2,,SING,N,HN2,no,N,2,,186800,34366,NH2
1,,DOUB,C,O,no,N,1,,186818,34367,PH6
2,,SING,C,CA,no,N,2,,186818,34367,PH6
3,,SING,C,OXT,no,N,3,,186818,34367,PH6
4,,SING,CA,CB,no,N,4,,186818,34367,PH6
5,,SING,CA,N,no,N,5,,186818,34367,PH6
6,,SING,CB,CG,no,N,6,,186818,34367,PH6
7,,SING,CG,CD,no,N,7,,186818,34367,PH6
8,,SING,CG,C1,no,N,8,,186818,34367,PH6
9,,SING,CD,N,no,N,9,,186818,34367,PH6
10,,SING,C1,C6,no,N,10,,186818,34367,PH6
11,,SING,C1,C2,no,N,11,,186818,34367,PH6
12,,SING,C6,C5,no,N,12,,186818,34367,PH6
13,,SING,C5,C4,no,N,13,,186818,34367,PH6
14,,SING,C4,C3,no,N,14,,186818,34367,PH6
15,,SING,C3,C2,no,N,15,,186818,34367,PH6
16,,SING,CA,HA,no,N,16,,186818,34367,PH6
17,,SING,OXT,HXT,no,N,17,,186818,34367,PH6
18,,SING,CB,HB2,no,N,18,,186818,34367,PH6
19,,SING,CB,HB3,no,N,19,,186818,34367,PH6
20,,SING,N,H,no,N,20,,186818,34367,PH6
21,,SING,CG,HG2,no,N,21,,186818,34367,PH6
22,,SING,CD,HD2,no,N,22,,186818,34367,PH6
23,,SING,CD,HD3,no,N,23,,186818,34367,PH6
24,,SING,C1,H1,no,N,24,,186818,34367,PH6
25,,SING,C6,H61,no,N,25,,186818,34367,PH6
26,,SING,C6,H62,no,N,26,,186818,34367,PH6
27,,SING,C2,H21,no,N,27,,186818,34367,PH6
28,,SING,C2,H22,no,N,28,,186818,34367,PH6
29,,SING,C5,H51,no,N,29,,186818,34367,PH6
30,,SING,C5,H52,no,N,30,,186818,34367,PH6
31,,SING,C4,H41,no,N,31,,186818,34367,PH6
32,,SING,C4,H42,no,N,32,,186818,34367,PH6
33,,SING,C3,H31,no,N,33,,186818,34367,PH6
34,,SING,C3,H32,no,N,34,,186818,34367,PH6
1,,SING,N,HN1,no,N,1,,186819,34367,NH2
2,,SING,N,HN2,no,N,2,,186819,34367,NH2
1,,SING,N,CA,no,N,1,,186838,34369,DAL
2,,SING,N,H,no,N,2,,186838,34369,DAL
3,,SING,N,H2,no,N,3,,186838,34369,DAL
4,,SING,CA,CB,no,N,4,,186838,34369,DAL
5,,SING,CA,C,no,N,5,,186838,34369,DAL
6,,SING,CA,HA,no,N,6,,186838,34369,DAL
7,,SING,CB,HB1,no,N,7,,186838,34369,DAL
8,,SING,CB,HB2,no,N,8,,186838,34369,DAL
9,,SING,CB,HB3,no,N,9,,186838,34369,DAL
10,,DOUB,C,O,no,N,10,,186838,34369,DAL
11,,SING,C,OXT,no,N,11,,186838,34369,DAL
12,,SING,OXT,HXT,no,N,12,,186838,34369,DAL
1,,SING,N,CA,no,N,1,,186855,3437,AYA
2,,SING,N,CT,no,N,2,,186855,3437,AYA
3,,SING,N,H,no,N,3,,186855,3437,AYA
4,,SING,CA,CB,no,N,4,,186855,3437,AYA
5,,SING,CA,C,no,N,5,,186855,3437,AYA
6,,SING,CA,HA,no,N,6,,186855,3437,AYA
7,,SING,CB,HB1,no,N,7,,186855,3437,AYA
8,,SING,CB,HB2,no,N,8,,186855,3437,AYA
9,,SING,CB,HB3,no,N,9,,186855,3437,AYA
10,,DOUB,C,O,no,N,10,,186855,3437,AYA
11,,SING,C,OXT,no,N,11,,186855,3437,AYA
12,,SING,OXT,HXT,no,N,12,,186855,3437,AYA
13,,DOUB,CT,OT,no,N,13,,186855,3437,AYA
14,,SING,CT,CM,no,N,14,,186855,3437,AYA
15,,SING,CM,HM1,no,N,15,,186855,3437,AYA
16,,SING,CM,HM2,no,N,16,,186855,3437,AYA
17,,SING,CM,HM3,no,N,17,,186855,3437,AYA
1,,SING,N,CA,no,N,1,,186870,34370,DBB
2,,SING,CA,C,no,N,2,,186870,34370,DBB
3,,SING,CA,CB,no,N,3,,186870,34370,DBB
4,,DOUB,C,O,no,N,4,,186870,34370,DBB
5,,SING,CB,CG,no,N,5,,186870,34370,DBB
6,,SING,C,OXT,no,N,6,,186870,34370,DBB
7,,SING,N,H,no,N,7,,186870,34370,DBB
8,,SING,N,H1,no,N,8,,186870,34370,DBB
9,,SING,CA,HA,no,N,9,,186870,34370,DBB
10,,SING,CB,HB2,no,N,10,,186870,34370,DBB
11,,SING,CB,HB3,no,N,11,,186870,34370,DBB
12,,SING,CG,HG1,no,N,12,,186870,34370,DBB
13,,SING,CG,HG2,no,N,13,,186870,34370,DBB
14,,SING,CG,HG3,no,N,14,,186870,34370,DBB
15,,SING,OXT,HXT,no,N,15,,186870,34370,DBB
1,,SING,N,CA,no,N,1,,186887,34371,DAL
2,,SING,N,H,no,N,2,,186887,34371,DAL
3,,SING,N,H2,no,N,3,,186887,34371,DAL
4,,SING,CA,CB,no,N,4,,186887,34371,DAL
5,,SING,CA,C,no,N,5,,186887,34371,DAL
6,,SING,CA,HA,no,N,6,,186887,34371,DAL
7,,SING,CB,HB1,no,N,7,,186887,34371,DAL
8,,SING,CB,HB2,no,N,8,,186887,34371,DAL
9,,SING,CB,HB3,no,N,9,,186887,34371,DAL
10,,DOUB,C,O,no,N,10,,186887,34371,DAL
11,,SING,C,OXT,no,N,11,,186887,34371,DAL
12,,SING,OXT,HXT,no,N,12,,186887,34371,DAL
1,,SING,N,CA,no,N,1,,186904,34372,DAL
2,,SING,N,H,no,N,2,,186904,34372,DAL
3,,SING,N,H2,no,N,3,,186904,34372,DAL
4,,SING,CA,CB,no,N,4,,186904,34372,DAL
5,,SING,CA,C,no,N,5,,186904,34372,DAL
6,,SING,CA,HA,no,N,6,,186904,34372,DAL
7,,SING,CB,HB1,no,N,7,,186904,34372,DAL
8,,SING,CB,HB2,no,N,8,,186904,34372,DAL
9,,SING,CB,HB3,no,N,9,,186904,34372,DAL
10,,DOUB,C,O,no,N,10,,186904,34372,DAL
11,,SING,C,OXT,no,N,11,,186904,34372,DAL
12,,SING,OXT,HXT,no,N,12,,186904,34372,DAL
1,,SING,N,CA,no,N,1,,186905,34372,DHA
2,,SING,N,H,no,N,2,,186905,34372,DHA
3,,SING,N,H2,no,N,3,,186905,34372,DHA
4,,DOUB,CA,CB,no,N,4,,186905,34372,DHA
5,,SING,CA,C,no,N,5,,186905,34372,DHA
6,,SING,CB,HB1,no,N,6,,186905,34372,DHA
7,,SING,CB,HB2,no,N,7,,186905,34372,DHA
8,,DOUB,C,O,no,N,8,,186905,34372,DHA
9,,SING,C,OXT,no,N,9,,186905,34372,DHA
10,,SING,OXT,HXT,no,N,10,,186905,34372,DHA
1,,SING,N,CA,no,N,1,,186922,34373,DAL
2,,SING,N,H,no,N,2,,186922,34373,DAL
3,,SING,N,H2,no,N,3,,186922,34373,DAL
4,,SING,CA,CB,no,N,4,,186922,34373,DAL
5,,SING,CA,C,no,N,5,,186922,34373,DAL
6,,SING,CA,HA,no,N,6,,186922,34373,DAL
7,,SING,CB,HB1,no,N,7,,186922,34373,DAL
8,,SING,CB,HB2,no,N,8,,186922,34373,DAL
9,,SING,CB,HB3,no,N,9,,186922,34373,DAL
10,,DOUB,C,O,no,N,10,,186922,34373,DAL
11,,SING,C,OXT,no,N,11,,186922,34373,DAL
12,,SING,OXT,HXT,no,N,12,,186922,34373,DAL
1,,SING,N,CA,no,N,1,,186939,34374,DAL
2,,SING,N,H,no,N,2,,186939,34374,DAL
3,,SING,N,H2,no,N,3,,186939,34374,DAL
4,,SING,CA,CB,no,N,4,,186939,34374,DAL
5,,SING,CA,C,no,N,5,,186939,34374,DAL
6,,SING,CA,HA,no,N,6,,186939,34374,DAL
7,,SING,CB,HB1,no,N,7,,186939,34374,DAL
8,,SING,CB,HB2,no,N,8,,186939,34374,DAL
9,,SING,CB,HB3,no,N,9,,186939,34374,DAL
10,,DOUB,C,O,no,N,10,,186939,34374,DAL
11,,SING,C,OXT,no,N,11,,186939,34374,DAL
12,,SING,OXT,HXT,no,N,12,,186939,34374,DAL
1,,SING,N,CA,no,N,1,,186940,34374,DBU
2,,SING,N,H,no,N,2,,186940,34374,DBU
3,,SING,N,H2,no,N,3,,186940,34374,DBU
4,,DOUB,CA,CB,no,Z,4,,186940,34374,DBU
5,,SING,CA,C,no,N,5,,186940,34374,DBU
6,,SING,CB,CG,no,N,6,,186940,34374,DBU
7,,SING,CB,HB,no,N,7,,186940,34374,DBU
8,,SING,CG,HG1,no,N,8,,186940,34374,DBU
9,,SING,CG,HG2,no,N,9,,186940,34374,DBU
10,,SING,CG,HG3,no,N,10,,186940,34374,DBU
11,,DOUB,C,O,no,N,11,,186940,34374,DBU
12,,SING,C,OXT,no,N,12,,186940,34374,DBU
13,,SING,OXT,HXT,no,N,13,,186940,34374,DBU
1,,SING,N,CA,no,N,1,,186941,34374,DHA
2,,SING,N,H,no,N,2,,186941,34374,DHA
3,,SING,N,H2,no,N,3,,186941,34374,DHA
4,,DOUB,CA,CB,no,N,4,,186941,34374,DHA
5,,SING,CA,C,no,N,5,,186941,34374,DHA
6,,SING,CB,HB1,no,N,6,,186941,34374,DHA
7,,SING,CB,HB2,no,N,7,,186941,34374,DHA
8,,DOUB,C,O,no,N,8,,186941,34374,DHA
9,,SING,C,OXT,no,N,9,,186941,34374,DHA
10,,SING,OXT,HXT,no,N,10,,186941,34374,DHA
1,,SING,C11,C10,no,N,1,,186976,34378,LN8
2,,SING,C11,C12,no,N,2,,186976,34378,LN8
3,,SING,C10,C15,no,N,3,,186976,34378,LN8
4,,SING,C12,N1,no,N,4,,186976,34378,LN8
5,,SING,C12,C13,no,N,5,,186976,34378,LN8
6,,SING,C13,C14,no,N,6,,186976,34378,LN8
7,,SING,C15,C14,no,N,7,,186976,34378,LN8
8,,SING,C10,H7,no,N,8,,186976,34378,LN8
9,,SING,C10,H8,no,N,9,,186976,34378,LN8
10,,SING,C11,H9,no,N,10,,186976,34378,LN8
11,,SING,C11,H10,no,N,11,,186976,34378,LN8
12,,SING,C12,H11,no,N,12,,186976,34378,LN8
13,,SING,C13,H13,no,N,13,,186976,34378,LN8
14,,SING,C13,H12,no,N,14,,186976,34378,LN8
15,,SING,C15,N2,no,N,15,,186976,34378,LN8
16,,SING,C15,H16,no,N,16,,186976,34378,LN8
17,,SING,C14,H15,no,N,17,,186976,34378,LN8
18,,SING,C14,H14,no,N,18,,186976,34378,LN8
19,,SING,N2,PT1,no,N,19,,186976,34378,LN8
20,,SING,N1,PT1,no,N,20,,186976,34378,LN8
21,,SING,CL2,PT1,no,N,21,,186976,34378,LN8
22,,SING,CL1,PT1,no,N,22,,186976,34378,LN8
23,,SING,N2,H3,no,N,23,,186976,34378,LN8
24,,SING,N2,H4,no,N,24,,186976,34378,LN8
25,,SING,N1,H2,no,N,25,,186976,34378,LN8
26,,SING,N1,H1,no,N,26,,186976,34378,LN8
1,,SING,O3,C6,no,N,1,,186996,34379,JPT
2,,SING,C6,C3,no,N,2,,186996,34379,JPT
3,,SING,C3,O1,no,N,3,,186996,34379,JPT
4,,DOUB,C3,C2,no,N,4,,186996,34379,JPT
5,,SING,O1,C4,no,N,5,,186996,34379,JPT
6,,SING,C2,C1,no,N,6,,186996,34379,JPT
7,,DOUB,C13,C12,yes,N,7,,186996,34379,JPT
8,,SING,C13,C8,yes,N,8,,186996,34379,JPT
9,,SING,C12,S2,yes,N,9,,186996,34379,JPT
10,,SING,C4,C7,no,N,10,,186996,34379,JPT
11,,DOUB,C4,C5,no,N,11,,186996,34379,JPT
12,,SING,C1,C5,no,N,12,,186996,34379,JPT
13,,DOUB,C1,O2,no,N,13,,186996,34379,JPT
14,,SING,C8,C7,no,N,14,,186996,34379,JPT
15,,DOUB,C8,C11,yes,N,15,,186996,34379,JPT
16,,SING,C5,O4,no,N,16,,186996,34379,JPT
17,,SING,S2,C11,yes,N,17,,186996,34379,JPT
18,,SING,C7,H7,no,N,18,,186996,34379,JPT
19,,SING,C7,H1,no,N,19,,186996,34379,JPT
20,,SING,C11,H11,no,N,20,,186996,34379,JPT
21,,SING,C12,H12,no,N,21,,186996,34379,JPT
22,,SING,C13,H13,no,N,22,,186996,34379,JPT
23,,SING,C6,H62,no,N,23,,186996,34379,JPT
24,,SING,C6,H61,no,N,24,,186996,34379,JPT
25,,SING,O3,H3,no,N,25,,186996,34379,JPT
26,,SING,O4,H4,no,N,26,,186996,34379,JPT
27,,SING,C2,H2,no,N,27,,186996,34379,JPT
1,,SING,N,CA,no,N,1,,187017,34380,HCS
2,,SING,N,H,no,N,2,,187017,34380,HCS
3,,SING,N,H2,no,N,3,,187017,34380,HCS
4,,SING,CA,CB,no,N,4,,187017,34380,HCS
5,,SING,CA,C,no,N,5,,187017,34380,HCS
6,,SING,CA,HCA,no,N,6,,187017,34380,HCS
7,,SING,CB,CG,no,N,7,,187017,34380,HCS
8,,SING,CB,HB2,no,N,8,,187017,34380,HCS
9,,SING,CB,HB3,no,N,9,,187017,34380,HCS
10,,SING,CG,SD,no,N,10,,187017,34380,HCS
11,,SING,CG,HG2,no,N,11,,187017,34380,HCS
12,,SING,CG,HG3,no,N,12,,187017,34380,HCS
13,,SING,SD,HD,no,N,13,,187017,34380,HCS
14,,SING,C,OXT,no,N,14,,187017,34380,HCS
15,,DOUB,C,O,no,N,15,,187017,34380,HCS
16,,SING,OXT,HXT,no,N,16,,187017,34380,HCS
1,,SING,N,CA,no,N,1,,187071,34384,PTR
2,,SING,N,H,no,N,2,,187071,34384,PTR
3,,SING,N,HN2,no,N,3,,187071,34384,PTR
4,,SING,CA,C,no,N,4,,187071,34384,PTR
5,,SING,CA,CB,no,N,5,,187071,34384,PTR
6,,SING,CA,HA,no,N,6,,187071,34384,PTR
7,,DOUB,C,O,no,N,7,,187071,34384,PTR
8,,SING,C,OXT,no,N,8,,187071,34384,PTR
9,,SING,OXT,HXT,no,N,9,,187071,34384,PTR
10,,SING,CB,CG,no,N,10,,187071,34384,PTR
11,,SING,CB,HB2,no,N,11,,187071,34384,PTR
12,,SING,CB,HB3,no,N,12,,187071,34384,PTR
13,,DOUB,CG,CD1,yes,N,13,,187071,34384,PTR
14,,SING,CG,CD2,yes,N,14,,187071,34384,PTR
15,,SING,CD1,CE1,yes,N,15,,187071,34384,PTR
16,,SING,CD1,HD1,no,N,16,,187071,34384,PTR
17,,DOUB,CD2,CE2,yes,N,17,,187071,34384,PTR
18,,SING,CD2,HD2,no,N,18,,187071,34384,PTR
19,,DOUB,CE1,CZ,yes,N,19,,187071,34384,PTR
20,,SING,CE1,HE1,no,N,20,,187071,34384,PTR
21,,SING,CE2,CZ,yes,N,21,,187071,34384,PTR
22,,SING,CE2,HE2,no,N,22,,187071,34384,PTR
23,,SING,CZ,OH,no,N,23,,187071,34384,PTR
24,,SING,OH,P,no,N,24,,187071,34384,PTR
25,,DOUB,P,O1P,no,N,25,,187071,34384,PTR
26,,SING,P,O2P,no,N,26,,187071,34384,PTR
27,,SING,P,O3P,no,N,27,,187071,34384,PTR
28,,SING,O2P,HO2P,no,N,28,,187071,34384,PTR
29,,SING,O3P,HO3P,no,N,29,,187071,34384,PTR
1,,SING,N,CA,no,N,1,,187111,34387,ABA
2,,SING,N,H,no,N,2,,187111,34387,ABA
3,,SING,N,HN2,no,N,3,,187111,34387,ABA
4,,SING,CA,C,no,N,4,,187111,34387,ABA
5,,SING,CA,CB,no,N,5,,187111,34387,ABA
6,,SING,CA,HA,no,N,6,,187111,34387,ABA
7,,DOUB,C,O,no,N,7,,187111,34387,ABA
8,,SING,C,OXT,no,N,8,,187111,34387,ABA
9,,SING,CB,CG,no,N,9,,187111,34387,ABA
10,,SING,CB,HB3,no,N,10,,187111,34387,ABA
11,,SING,CB,HB2,no,N,11,,187111,34387,ABA
12,,SING,CG,HG1,no,N,12,,187111,34387,ABA
13,,SING,CG,HG3,no,N,13,,187111,34387,ABA
14,,SING,CG,HG2,no,N,14,,187111,34387,ABA
15,,SING,OXT,HXT,no,N,15,,187111,34387,ABA
1,,SING,N,CA,no,N,1,,187129,34388,ABA
2,,SING,N,H,no,N,2,,187129,34388,ABA
3,,SING,N,HN2,no,N,3,,187129,34388,ABA
4,,SING,CA,C,no,N,4,,187129,34388,ABA
5,,SING,CA,CB,no,N,5,,187129,34388,ABA
6,,SING,CA,HA,no,N,6,,187129,34388,ABA
7,,DOUB,C,O,no,N,7,,187129,34388,ABA
8,,SING,C,OXT,no,N,8,,187129,34388,ABA
9,,SING,CB,CG,no,N,9,,187129,34388,ABA
10,,SING,CB,HB3,no,N,10,,187129,34388,ABA
11,,SING,CB,HB2,no,N,11,,187129,34388,ABA
12,,SING,CG,HG1,no,N,12,,187129,34388,ABA
13,,SING,CG,HG3,no,N,13,,187129,34388,ABA
14,,SING,CG,HG2,no,N,14,,187129,34388,ABA
15,,SING,OXT,HXT,no,N,15,,187129,34388,ABA
1,,DOUB,P,OP1,no,N,1,,187146,34389,BGM
2,,SING,P,OP2,no,N,2,,187146,34389,BGM
3,,SING,P,O5',no,N,3,,187146,34389,BGM
4,,SING,P,OP3,no,N,4,,187146,34389,BGM
5,,SING,OP2,HOP2,no,N,5,,187146,34389,BGM
6,,SING,O5',C5',no,N,6,,187146,34389,BGM
7,,SING,C5',C4',no,N,7,,187146,34389,BGM
8,,SING,C5',H5',no,N,8,,187146,34389,BGM
9,,SING,C5',H5'',no,N,9,,187146,34389,BGM
10,,SING,C4',O4',no,N,10,,187146,34389,BGM
11,,SING,C4',C3',no,N,11,,187146,34389,BGM
12,,SING,C4',H4',no,N,12,,187146,34389,BGM
13,,SING,O4',C1',no,N,13,,187146,34389,BGM
14,,SING,C1',N9,no,N,14,,187146,34389,BGM
15,,SING,C1',C2',no,N,15,,187146,34389,BGM
16,,SING,C1',H1',no,N,16,,187146,34389,BGM
17,,SING,N9,C8,yes,N,17,,187146,34389,BGM
18,,SING,N9,C4,yes,N,18,,187146,34389,BGM
19,,DOUB,C8,N7,yes,N,19,,187146,34389,BGM
20,,SING,C8,BR,no,N,20,,187146,34389,BGM
21,,SING,N7,C5,yes,N,21,,187146,34389,BGM
22,,DOUB,C5,C4,yes,N,22,,187146,34389,BGM
23,,SING,C5,C6,no,N,23,,187146,34389,BGM
24,,SING,C4,N3,no,N,24,,187146,34389,BGM
25,,DOUB,N3,C2,no,N,25,,187146,34389,BGM
26,,SING,C2,N2,no,N,26,,187146,34389,BGM
27,,SING,C2,N1,no,N,27,,187146,34389,BGM
28,,SING,N2,H21,no,N,28,,187146,34389,BGM
29,,SING,N2,H22,no,N,29,,187146,34389,BGM
30,,SING,N1,C6,no,N,30,,187146,34389,BGM
31,,SING,N1,H1,no,N,31,,187146,34389,BGM
32,,DOUB,C6,O6,no,N,32,,187146,34389,BGM
33,,SING,C2',C3',no,N,33,,187146,34389,BGM
34,,SING,C2',H2',no,N,34,,187146,34389,BGM
35,,SING,C2',H2'',no,N,35,,187146,34389,BGM
36,,SING,C3',O3',no,N,36,,187146,34389,BGM
37,,SING,C3',H3',no,N,37,,187146,34389,BGM
38,,SING,O3',HO3',no,N,38,,187146,34389,BGM
39,,SING,OP3,HOP3,no,N,39,,187146,34389,BGM
1,,DOUB,P,OP1,no,N,1,,187165,34390,BGM
2,,SING,P,OP2,no,N,2,,187165,34390,BGM
3,,SING,P,O5',no,N,3,,187165,34390,BGM
4,,SING,P,OP3,no,N,4,,187165,34390,BGM
5,,SING,OP2,HOP2,no,N,5,,187165,34390,BGM
6,,SING,O5',C5',no,N,6,,187165,34390,BGM
7,,SING,C5',C4',no,N,7,,187165,34390,BGM
8,,SING,C5',H5',no,N,8,,187165,34390,BGM
9,,SING,C5',H5'',no,N,9,,187165,34390,BGM
10,,SING,C4',O4',no,N,10,,187165,34390,BGM
11,,SING,C4',C3',no,N,11,,187165,34390,BGM
12,,SING,C4',H4',no,N,12,,187165,34390,BGM
13,,SING,O4',C1',no,N,13,,187165,34390,BGM
14,,SING,C1',N9,no,N,14,,187165,34390,BGM
15,,SING,C1',C2',no,N,15,,187165,34390,BGM
16,,SING,C1',H1',no,N,16,,187165,34390,BGM
17,,SING,N9,C8,yes,N,17,,187165,34390,BGM
18,,SING,N9,C4,yes,N,18,,187165,34390,BGM
19,,DOUB,C8,N7,yes,N,19,,187165,34390,BGM
20,,SING,C8,BR,no,N,20,,187165,34390,BGM
21,,SING,N7,C5,yes,N,21,,187165,34390,BGM
22,,DOUB,C5,C4,yes,N,22,,187165,34390,BGM
23,,SING,C5,C6,no,N,23,,187165,34390,BGM
24,,SING,C4,N3,no,N,24,,187165,34390,BGM
25,,DOUB,N3,C2,no,N,25,,187165,34390,BGM
26,,SING,C2,N2,no,N,26,,187165,34390,BGM
27,,SING,C2,N1,no,N,27,,187165,34390,BGM
28,,SING,N2,H21,no,N,28,,187165,34390,BGM
29,,SING,N2,H22,no,N,29,,187165,34390,BGM
30,,SING,N1,C6,no,N,30,,187165,34390,BGM
31,,SING,N1,H1,no,N,31,,187165,34390,BGM
32,,DOUB,C6,O6,no,N,32,,187165,34390,BGM
33,,SING,C2',C3',no,N,33,,187165,34390,BGM
34,,SING,C2',H2',no,N,34,,187165,34390,BGM
35,,SING,C2',H2'',no,N,35,,187165,34390,BGM
36,,SING,C3',O3',no,N,36,,187165,34390,BGM
37,,SING,C3',H3',no,N,37,,187165,34390,BGM
38,,SING,O3',HO3',no,N,38,,187165,34390,BGM
39,,SING,OP3,HOP3,no,N,39,,187165,34390,BGM
1,,DOUB,C,O,no,N,1,,187184,34391,ACE
2,,SING,C,CH3,no,N,2,,187184,34391,ACE
3,,SING,C,H,no,N,3,,187184,34391,ACE
4,,SING,CH3,H1,no,N,4,,187184,34391,ACE
5,,SING,CH3,H2,no,N,5,,187184,34391,ACE
6,,SING,CH3,H3,no,N,6,,187184,34391,ACE
1,,SING,N,HN1,no,N,1,,187185,34391,NH2
2,,SING,N,HN2,no,N,2,,187185,34391,NH2
1,,SING,N,CA,no,N,1,,187263,34395,TPO
2,,SING,N,H,no,N,2,,187263,34395,TPO
3,,SING,N,H2,no,N,3,,187263,34395,TPO
4,,SING,CA,CB,no,N,4,,187263,34395,TPO
5,,SING,CA,C,no,N,5,,187263,34395,TPO
6,,SING,CA,HA,no,N,6,,187263,34395,TPO
7,,SING,CB,CG2,no,N,7,,187263,34395,TPO
8,,SING,CB,OG1,no,N,8,,187263,34395,TPO
9,,SING,CB,HB,no,N,9,,187263,34395,TPO
10,,SING,CG2,HG21,no,N,10,,187263,34395,TPO
11,,SING,CG2,HG22,no,N,11,,187263,34395,TPO
12,,SING,CG2,HG23,no,N,12,,187263,34395,TPO
13,,SING,OG1,P,no,N,13,,187263,34395,TPO
14,,DOUB,P,O1P,no,N,14,,187263,34395,TPO
15,,SING,P,O2P,no,N,15,,187263,34395,TPO
16,,SING,P,O3P,no,N,16,,187263,34395,TPO
17,,SING,O2P,HOP2,no,N,17,,187263,34395,TPO
18,,SING,O3P,HOP3,no,N,18,,187263,34395,TPO
19,,DOUB,C,O,no,N,19,,187263,34395,TPO
20,,SING,C,OXT,no,N,20,,187263,34395,TPO
21,,SING,OXT,HXT,no,N,21,,187263,34395,TPO
1,,SING,N1,C2,no,N,1,,187310,34397,DCZ
2,,SING,N1,C6,no,N,2,,187310,34397,DCZ
3,,SING,N1,C1',no,N,3,,187310,34397,DCZ
4,,SING,C2,N3,no,N,4,,187310,34397,DCZ
5,,DOUB,C2,O2,no,N,5,,187310,34397,DCZ
6,,DOUB,N3,C4,no,N,6,,187310,34397,DCZ
7,,SING,C4,C5,no,N,7,,187310,34397,DCZ
8,,SING,C4,N4,no,N,8,,187310,34397,DCZ
9,,DOUB,C5,C6,no,N,9,,187310,34397,DCZ
10,,SING,C5,H5,no,N,10,,187310,34397,DCZ
11,,SING,C6,H6,no,N,11,,187310,34397,DCZ
12,,SING,N4,HN41,no,N,12,,187310,34397,DCZ
13,,SING,N4,HN42,no,N,13,,187310,34397,DCZ
14,,SING,C1',C2',no,N,14,,187310,34397,DCZ
15,,SING,C1',O4',no,N,15,,187310,34397,DCZ
16,,SING,C1',H1',no,N,16,,187310,34397,DCZ
17,,SING,C2',C3',no,N,17,,187310,34397,DCZ
18,,SING,C2',H2'1,no,N,18,,187310,34397,DCZ
19,,SING,C2',H2'2,no,N,19,,187310,34397,DCZ
20,,SING,C3',C4',no,N,20,,187310,34397,DCZ
21,,SING,C3',O3',no,N,21,,187310,34397,DCZ
22,,SING,C3',H3',no,N,22,,187310,34397,DCZ
23,,SING,C4',O4',no,N,23,,187310,34397,DCZ
24,,SING,C4',C5',no,N,24,,187310,34397,DCZ
25,,SING,C4',H4',no,N,25,,187310,34397,DCZ
26,,SING,O3',HO3',no,N,26,,187310,34397,DCZ
27,,SING,C5',O5',no,N,27,,187310,34397,DCZ
28,,SING,C5',H5'1,no,N,28,,187310,34397,DCZ
29,,SING,C5',H5'2,no,N,29,,187310,34397,DCZ
30,,SING,O5',HO51,no,N,30,,187310,34397,DCZ
1,,SING,CM6,N61,no,N,1,,187311,34397,K4Z
2,,SING,CM3,N31,no,N,2,,187311,34397,K4Z
3,,DOUB,O61,C61,no,N,3,,187311,34397,K4Z
4,,SING,CM5,N51,no,N,4,,187311,34397,K4Z
5,,SING,CM4,N41,no,N,5,,187311,34397,K4Z
6,,SING,N61,C65,yes,N,6,,187311,34397,K4Z
7,,SING,N61,C62,yes,N,7,,187311,34397,K4Z
8,,DOUB,O41,C41,no,N,8,,187311,34397,K4Z
9,,SING,C55,N51,yes,N,9,,187311,34397,K4Z
10,,DOUB,C55,C54,yes,N,10,,187311,34397,K4Z
11,,SING,C35,N31,yes,N,11,,187311,34397,K4Z
12,,DOUB,C35,C34,yes,N,12,,187311,34397,K4Z
13,,SING,N31,C32,yes,N,13,,187311,34397,K4Z
14,,SING,N51,C52,yes,N,14,,187311,34397,K4Z
15,,SING,C61,C62,no,N,15,,187311,34397,K4Z
16,,SING,C61,N52,no,N,16,,187311,34397,K4Z
17,,DOUB,C65,C64,yes,N,17,,187311,34397,K4Z
18,,DOUB,C62,C63,yes,N,18,,187311,34397,K4Z
19,,DOUB,O31,C31,no,N,19,,187311,34397,K4Z
20,,SING,N41,C42,yes,N,20,,187311,34397,K4Z
21,,SING,N41,C44,yes,N,21,,187311,34397,K4Z
22,,SING,C41,C42,no,N,22,,187311,34397,K4Z
23,,SING,C41,N32,no,N,23,,187311,34397,K4Z
24,,SING,C54,N52,no,N,24,,187311,34397,K4Z
25,,SING,C54,C53,yes,N,25,,187311,34397,K4Z
26,,SING,C34,N32,no,N,26,,187311,34397,K4Z
27,,SING,C34,C33,yes,N,27,,187311,34397,K4Z
28,,DOUB,O71,C71,no,N,28,,187311,34397,K4Z
29,,SING,C32,C31,no,N,29,,187311,34397,K4Z
30,,DOUB,C32,C33,yes,N,30,,187311,34397,K4Z
31,,DOUB,C52,C53,yes,N,31,,187311,34397,K4Z
32,,SING,C52,C51,no,N,32,,187311,34397,K4Z
33,,SING,C31,N22,no,N,33,,187311,34397,K4Z
34,,DOUB,C42,N42,yes,N,34,,187311,34397,K4Z
35,,DOUB,O51,C51,no,N,35,,187311,34397,K4Z
36,,SING,C64,C63,yes,N,36,,187311,34397,K4Z
37,,SING,C64,N62,no,N,37,,187311,34397,K4Z
38,,DOUB,C44,C43,yes,N,38,,187311,34397,K4Z
39,,SING,C51,N91,no,N,39,,187311,34397,K4Z
40,,SING,CM7,N71,no,N,40,,187311,34397,K4Z
41,,SING,C71,N62,no,N,41,,187311,34397,K4Z
42,,SING,C71,C72,no,N,42,,187311,34397,K4Z
43,,SING,C25,N21,yes,N,43,,187311,34397,K4Z
44,,DOUB,C25,C24,yes,N,44,,187311,34397,K4Z
45,,SING,CM2,N21,no,N,45,,187311,34397,K4Z
46,,SING,N42,C43,yes,N,46,,187311,34397,K4Z
47,,SING,C43,N43,no,N,47,,187311,34397,K4Z
48,,SING,N22,C24,no,N,48,,187311,34397,K4Z
49,,SING,N21,C22,yes,N,49,,187311,34397,K4Z
50,,DOUB,O91,C91,no,N,50,,187311,34397,K4Z
51,,SING,C24,C23,yes,N,51,,187311,34397,K4Z
52,,SING,N71,C72,yes,N,52,,187311,34397,K4Z
53,,SING,N71,C75,yes,N,53,,187311,34397,K4Z
54,,SING,N91,C94,no,N,54,,187311,34397,K4Z
55,,DOUB,C72,C73,yes,N,55,,187311,34397,K4Z
56,,SING,N43,C91,no,N,56,,187311,34397,K4Z
57,,SING,C91,C92,no,N,57,,187311,34397,K4Z
58,,SING,C94,C93,no,N,58,,187311,34397,K4Z
59,,DOUB,C22,C23,yes,N,59,,187311,34397,K4Z
60,,SING,C22,C21,no,N,60,,187311,34397,K4Z
61,,DOUB,C75,C74,yes,N,61,,187311,34397,K4Z
62,,SING,C73,C74,yes,N,62,,187311,34397,K4Z
63,,DOUB,O21,C21,no,N,63,,187311,34397,K4Z
64,,SING,C92,C93,no,N,64,,187311,34397,K4Z
65,,SING,C92,N1,no,N,65,,187311,34397,K4Z
66,,SING,C21,N12,no,N,66,,187311,34397,K4Z
67,,SING,C74,N72,no,N,67,,187311,34397,K4Z
68,,SING,N12,C14,no,N,68,,187311,34397,K4Z
69,,SING,N72,C81,no,N,69,,187311,34397,K4Z
70,,DOUB,O81,C81,no,N,70,,187311,34397,K4Z
71,,SING,C81,C82,no,N,71,,187311,34397,K4Z
72,,DOUB,C14,C15,yes,N,72,,187311,34397,K4Z
73,,SING,C14,C13,yes,N,73,,187311,34397,K4Z
74,,SING,C15,N11,yes,N,74,,187311,34397,K4Z
75,,DOUB,C82,N82,yes,N,75,,187311,34397,K4Z
76,,SING,C82,N81,yes,N,76,,187311,34397,K4Z
77,,DOUB,C13,C12,yes,N,77,,187311,34397,K4Z
78,,SING,N11,CM1,no,N,78,,187311,34397,K4Z
79,,SING,N11,C12,yes,N,79,,187311,34397,K4Z
80,,SING,C88,N81,no,N,80,,187311,34397,K4Z
81,,SING,N82,C84,yes,N,81,,187311,34397,K4Z
82,,SING,N81,C83,yes,N,82,,187311,34397,K4Z
83,,SING,C12,C11,no,N,83,,187311,34397,K4Z
84,,DOUB,C84,C83,yes,N,84,,187311,34397,K4Z
85,,SING,C11,N03,no,N,85,,187311,34397,K4Z
86,,DOUB,C11,O11,no,N,86,,187311,34397,K4Z
87,,SING,N03,C08,no,N,87,,187311,34397,K4Z
88,,SING,C08,C07,no,N,88,,187311,34397,K4Z
89,,SING,C07,C06,no,N,89,,187311,34397,K4Z
90,,DOUB,C06,O01,no,N,90,,187311,34397,K4Z
91,,SING,C06,N02,no,N,91,,187311,34397,K4Z
92,,SING,N02,C05,no,N,92,,187311,34397,K4Z
93,,SING,C05,C04,no,N,93,,187311,34397,K4Z
94,,SING,C04,C03,no,N,94,,187311,34397,K4Z
95,,SING,C03,N01,no,N,95,,187311,34397,K4Z
96,,SING,C02,N01,no,N,96,,187311,34397,K4Z
97,,SING,N01,C01,no,N,97,,187311,34397,K4Z
98,,SING,C03,H032,no,N,98,,187311,34397,K4Z
99,,SING,C03,H031,no,N,99,,187311,34397,K4Z
100,,SING,C04,H041,no,N,100,,187311,34397,K4Z
101,,SING,C04,H042,no,N,101,,187311,34397,K4Z
102,,SING,C05,H051,no,N,102,,187311,34397,K4Z
103,,SING,C05,H052,no,N,103,,187311,34397,K4Z
104,,SING,N02,HN02,no,N,104,,187311,34397,K4Z
105,,SING,C01,H006,no,N,105,,187311,34397,K4Z
106,,SING,C01,H004,no,N,106,,187311,34397,K4Z
107,,SING,C01,H005,no,N,107,,187311,34397,K4Z
108,,SING,C02,H002,no,N,108,,187311,34397,K4Z
109,,SING,C02,H003,no,N,109,,187311,34397,K4Z
110,,SING,C02,H001,no,N,110,,187311,34397,K4Z
111,,SING,N03,HN03,no,N,111,,187311,34397,K4Z
112,,SING,C13,H13,no,N,112,,187311,34397,K4Z
113,,SING,N12,HN1,no,N,113,,187311,34397,K4Z
114,,SING,C15,H15,no,N,114,,187311,34397,K4Z
115,,SING,CM1,H113,no,N,115,,187311,34397,K4Z
116,,SING,CM1,H112,no,N,116,,187311,34397,K4Z
117,,SING,CM1,H111,no,N,117,,187311,34397,K4Z
118,,SING,N22,HN2,no,N,118,,187311,34397,K4Z
119,,SING,N32,HN3,no,N,119,,187311,34397,K4Z
120,,SING,C25,H25,no,N,120,,187311,34397,K4Z
121,,SING,CM2,H223,no,N,121,,187311,34397,K4Z
122,,SING,CM2,H222,no,N,122,,187311,34397,K4Z
123,,SING,CM2,H221,no,N,123,,187311,34397,K4Z
124,,SING,N43,HN4,no,N,124,,187311,34397,K4Z
125,,SING,C23,H23,no,N,125,,187311,34397,K4Z
126,,SING,N91,HN9,no,N,126,,187311,34397,K4Z
127,,SING,C35,H35,no,N,127,,187311,34397,K4Z
128,,SING,N52,HN5,no,N,128,,187311,34397,K4Z
129,,SING,CM3,H331,no,N,129,,187311,34397,K4Z
130,,SING,CM3,H333,no,N,130,,187311,34397,K4Z
131,,SING,CM3,H332,no,N,131,,187311,34397,K4Z
132,,SING,N62,HN6,no,N,132,,187311,34397,K4Z
133,,SING,N72,HN7,no,N,133,,187311,34397,K4Z
134,,SING,C44,H44,no,N,134,,187311,34397,K4Z
135,,SING,CM4,H442,no,N,135,,187311,34397,K4Z
136,,SING,CM4,H441,no,N,136,,187311,34397,K4Z
137,,SING,CM4,H443,no,N,137,,187311,34397,K4Z
138,,SING,C08,H082,no,N,138,,187311,34397,K4Z
139,,SING,C08,H081,no,N,139,,187311,34397,K4Z
140,,SING,C53,H53,no,N,140,,187311,34397,K4Z
141,,SING,C55,H55,no,N,141,,187311,34397,K4Z
142,,SING,CM5,H551,no,N,142,,187311,34397,K4Z
143,,SING,CM5,H552,no,N,143,,187311,34397,K4Z
144,,SING,CM5,H553,no,N,144,,187311,34397,K4Z
145,,SING,C63,H63,no,N,145,,187311,34397,K4Z
146,,SING,C65,H65,no,N,146,,187311,34397,K4Z
147,,SING,CM6,H662,no,N,147,,187311,34397,K4Z
148,,SING,CM6,H663,no,N,148,,187311,34397,K4Z
149,,SING,CM6,H661,no,N,149,,187311,34397,K4Z
150,,SING,C75,H75,no,N,150,,187311,34397,K4Z
151,,SING,CM7,H773,no,N,151,,187311,34397,K4Z
152,,SING,CM7,H772,no,N,152,,187311,34397,K4Z
153,,SING,CM7,H771,no,N,153,,187311,34397,K4Z
154,,SING,C92,H922,no,N,154,,187311,34397,K4Z
155,,SING,C93,H931,no,N,155,,187311,34397,K4Z
156,,SING,C93,H932,no,N,156,,187311,34397,K4Z
157,,SING,C94,H943,no,N,157,,187311,34397,K4Z
158,,SING,C94,H942,no,N,158,,187311,34397,K4Z
159,,SING,C33,H33,no,N,159,,187311,34397,K4Z
160,,SING,C73,H73,no,N,160,,187311,34397,K4Z
161,,SING,C07,H071,no,N,161,,187311,34397,K4Z
162,,SING,C07,H072,no,N,162,,187311,34397,K4Z
163,,SING,N1,H3,no,N,163,,187311,34397,K4Z
164,,SING,N1,H1,no,N,164,,187311,34397,K4Z
165,,SING,C83,H84,no,N,165,,187311,34397,K4Z
166,,SING,C88,H881,no,N,166,,187311,34397,K4Z
167,,SING,C88,H883,no,N,167,,187311,34397,K4Z
168,,SING,C88,H882,no,N,168,,187311,34397,K4Z
169,,SING,C84,H83,no,N,169,,187311,34397,K4Z
170,,SING,N1,H2,no,N,170,,187311,34397,K4Z
171,,SING,N01,HN01,no,N,171,,187311,34397,K4Z
1,,DOUB,C11,O11,no,N,1,,187382,34400,BTN
2,,SING,C11,O12,no,N,2,,187382,34400,BTN
3,,SING,C11,C10,no,N,3,,187382,34400,BTN
4,,SING,O12,HO2,no,N,4,,187382,34400,BTN
5,,SING,C10,C9,no,N,5,,187382,34400,BTN
6,,SING,C10,H101,no,N,6,,187382,34400,BTN
7,,SING,C10,H102,no,N,7,,187382,34400,BTN
8,,SING,C9,C8,no,N,8,,187382,34400,BTN
9,,SING,C9,H91,no,N,9,,187382,34400,BTN
10,,SING,C9,H92,no,N,10,,187382,34400,BTN
11,,SING,C8,C7,no,N,11,,187382,34400,BTN
12,,SING,C8,H81,no,N,12,,187382,34400,BTN
13,,SING,C8,H82,no,N,13,,187382,34400,BTN
14,,SING,C7,C2,no,N,14,,187382,34400,BTN
15,,SING,C7,H71,no,N,15,,187382,34400,BTN
16,,SING,C7,H72,no,N,16,,187382,34400,BTN
17,,SING,C2,S1,no,N,17,,187382,34400,BTN
18,,SING,C2,C4,no,N,18,,187382,34400,BTN
19,,SING,C2,H2,no,N,19,,187382,34400,BTN
20,,SING,S1,C6,no,N,20,,187382,34400,BTN
21,,SING,C6,C5,no,N,21,,187382,34400,BTN
22,,SING,C6,H61,no,N,22,,187382,34400,BTN
23,,SING,C6,H62,no,N,23,,187382,34400,BTN
24,,SING,C5,N1,no,N,24,,187382,34400,BTN
25,,SING,C5,C4,no,N,25,,187382,34400,BTN
26,,SING,C5,H5,no,N,26,,187382,34400,BTN
27,,SING,N1,C3,no,N,27,,187382,34400,BTN
28,,SING,N1,HN1,no,N,28,,187382,34400,BTN
29,,DOUB,C3,O3,no,N,29,,187382,34400,BTN
30,,SING,C3,N2,no,N,30,,187382,34400,BTN
31,,SING,N2,C4,no,N,31,,187382,34400,BTN
32,,SING,N2,HN2,no,N,32,,187382,34400,BTN
33,,SING,C4,H4,no,N,33,,187382,34400,BTN
1,,DOUB,O,C,no,N,1,,187383,34400,KFB
2,,SING,C,CA,no,N,2,,187383,34400,KFB
3,,SING,CA,CB,no,N,3,,187383,34400,KFB
4,,SING,CB,CG,no,N,4,,187383,34400,KFB
5,,SING,CG,CD,no,N,5,,187383,34400,KFB
6,,SING,C,O1,no,N,6,,187383,34400,KFB
7,,SING,CA,H4,no,N,7,,187383,34400,KFB
8,,SING,CB,H5,no,N,8,,187383,34400,KFB
9,,SING,CB,H6,no,N,9,,187383,34400,KFB
10,,SING,CG,H7,no,N,10,,187383,34400,KFB
11,,SING,CG,H8,no,N,11,,187383,34400,KFB
12,,SING,CD,H9,no,N,12,,187383,34400,KFB
13,,SING,CD,N1,no,N,13,,187383,34400,KFB
14,,SING,CD,H11,no,N,14,,187383,34400,KFB
15,,SING,O1,H12,no,N,15,,187383,34400,KFB
16,,SING,CA,H1,no,N,16,,187383,34400,KFB
17,,SING,N1,H2,no,N,17,,187383,34400,KFB
18,,SING,N1,H3,no,N,18,,187383,34400,KFB
1,,SING,P,O5',no,N,1,,187441,34403,GF2
2,,SING,N1,C2,no,N,2,,187441,34403,GF2
3,,DOUB,C2,N3,no,N,3,,187441,34403,GF2
4,,SING,C2,N2,no,N,4,,187441,34403,GF2
5,,SING,C4,N3,no,N,5,,187441,34403,GF2
6,,DOUB,C5,C4,yes,N,6,,187441,34403,GF2
7,,SING,C6,N1,no,N,7,,187441,34403,GF2
8,,SING,C6,C5,no,N,8,,187441,34403,GF2
9,,DOUB,O6,C6,no,N,9,,187441,34403,GF2
10,,SING,N7,C5,yes,N,10,,187441,34403,GF2
11,,DOUB,N7,C8,yes,N,11,,187441,34403,GF2
12,,SING,C8,N9,yes,N,12,,187441,34403,GF2
13,,SING,N9,C4,yes,N,13,,187441,34403,GF2
14,,SING,N9,C1',no,N,14,,187441,34403,GF2
15,,SING,C1',O4',no,N,15,,187441,34403,GF2
16,,SING,OP2,P,no,N,16,,187441,34403,GF2
17,,SING,C2',F,no,N,17,,187441,34403,GF2
18,,SING,C2',C1',no,N,18,,187441,34403,GF2
19,,DOUB,OP1,P,no,N,19,,187441,34403,GF2
20,,SING,C3',C2',no,N,20,,187441,34403,GF2
21,,SING,C3',C4',no,N,21,,187441,34403,GF2
22,,SING,O3',C3',no,N,22,,187441,34403,GF2
23,,SING,C4',O4',no,N,23,,187441,34403,GF2
24,,SING,C5',C4',no,N,24,,187441,34403,GF2
25,,SING,O5',C5',no,N,25,,187441,34403,GF2
26,,SING,P,OP3,no,N,26,,187441,34403,GF2
27,,SING,N1,HN1,no,N,27,,187441,34403,GF2
28,,SING,N2,HN2,no,N,28,,187441,34403,GF2
29,,SING,N2,HN2A,no,N,29,,187441,34403,GF2
30,,SING,C8,H8,no,N,30,,187441,34403,GF2
31,,SING,C1',H1',no,N,31,,187441,34403,GF2
32,,SING,OP2,HOP2,no,N,32,,187441,34403,GF2
33,,SING,C2',H2',no,N,33,,187441,34403,GF2
34,,SING,C3',H3',no,N,34,,187441,34403,GF2
35,,SING,O3',HO3',no,N,35,,187441,34403,GF2
36,,SING,C4',H4',no,N,36,,187441,34403,GF2
37,,SING,C5',H5',no,N,37,,187441,34403,GF2
38,,SING,C5',H5'A,no,N,38,,187441,34403,GF2
39,,SING,OP3,HOP3,no,N,39,,187441,34403,GF2
1,,SING,O5',C5',no,N,1,,187921,34428,ADN
2,,SING,O5',HO5',no,N,2,,187921,34428,ADN
3,,SING,C5',C4',no,N,3,,187921,34428,ADN
4,,SING,C5',H5'1,no,N,4,,187921,34428,ADN
5,,SING,C5',H5'2,no,N,5,,187921,34428,ADN
6,,SING,C4',O4',no,N,6,,187921,34428,ADN
7,,SING,C4',C3',no,N,7,,187921,34428,ADN
8,,SING,C4',H4',no,N,8,,187921,34428,ADN
9,,SING,O4',C1',no,N,9,,187921,34428,ADN
10,,SING,C3',O3',no,N,10,,187921,34428,ADN
11,,SING,C3',C2',no,N,11,,187921,34428,ADN
12,,SING,C3',H3',no,N,12,,187921,34428,ADN
13,,SING,O3',HO3',no,N,13,,187921,34428,ADN
14,,SING,C2',O2',no,N,14,,187921,34428,ADN
15,,SING,C2',C1',no,N,15,,187921,34428,ADN
16,,SING,C2',H2',no,N,16,,187921,34428,ADN
17,,SING,O2',HO2',no,N,17,,187921,34428,ADN
18,,SING,C1',N9,no,N,18,,187921,34428,ADN
19,,SING,C1',H1',no,N,19,,187921,34428,ADN
20,,SING,N9,C8,yes,N,20,,187921,34428,ADN
21,,SING,N9,C4,yes,N,21,,187921,34428,ADN
22,,DOUB,C8,N7,yes,N,22,,187921,34428,ADN
23,,SING,C8,H8,no,N,23,,187921,34428,ADN
24,,SING,N7,C5,yes,N,24,,187921,34428,ADN
25,,SING,C5,C6,yes,N,25,,187921,34428,ADN
26,,DOUB,C5,C4,yes,N,26,,187921,34428,ADN
27,,SING,C6,N6,no,N,27,,187921,34428,ADN
28,,DOUB,C6,N1,yes,N,28,,187921,34428,ADN
29,,SING,N6,HN61,no,N,29,,187921,34428,ADN
30,,SING,N6,HN62,no,N,30,,187921,34428,ADN
31,,SING,N1,C2,yes,N,31,,187921,34428,ADN
32,,DOUB,C2,N3,yes,N,32,,187921,34428,ADN
33,,SING,C2,H2,no,N,33,,187921,34428,ADN
34,,SING,N3,C4,yes,N,34,,187921,34428,ADN
1,,SING,C27,N5,no,N,1,,188066,34435,LWQ
2,,DOUB,C25,C24,yes,N,2,,188066,34435,LWQ
3,,SING,C25,C20,yes,N,3,,188066,34435,LWQ
4,,SING,C24,C23,yes,N,4,,188066,34435,LWQ
5,,DOUB,N5,C20,yes,N,5,,188066,34435,LWQ
6,,SING,N5,C21,yes,N,6,,188066,34435,LWQ
7,,SING,C20,C19,yes,N,7,,188066,34435,LWQ
8,,DOUB,C23,C22,yes,N,8,,188066,34435,LWQ
9,,DOUB,C21,C9,yes,N,9,,188066,34435,LWQ
10,,SING,C19,C22,yes,N,10,,188066,34435,LWQ
11,,DOUB,C19,C18,yes,N,11,,188066,34435,LWQ
12,,SING,C9,C18,yes,N,12,,188066,34435,LWQ
13,,SING,C9,N2,no,N,13,,188066,34435,LWQ
14,,DOUB,O2,C7,no,N,14,,188066,34435,LWQ
15,,SING,N2,C7,no,N,15,,188066,34435,LWQ
16,,SING,C7,C3,no,N,16,,188066,34435,LWQ
17,,DOUB,C3,C4,yes,N,17,,188066,34435,LWQ
18,,SING,C3,N1,yes,N,18,,188066,34435,LWQ
19,,SING,C4,C5,yes,N,19,,188066,34435,LWQ
20,,DOUB,N1,C2,yes,N,20,,188066,34435,LWQ
21,,DOUB,C17,C16,yes,N,21,,188066,34435,LWQ
22,,SING,C17,C12,yes,N,22,,188066,34435,LWQ
23,,SING,C16,C15,yes,N,23,,188066,34435,LWQ
24,,DOUB,C13,C12,yes,N,24,,188066,34435,LWQ
25,,SING,C13,C8,yes,N,25,,188066,34435,LWQ
26,,DOUB,C5,C1,yes,N,26,,188066,34435,LWQ
27,,SING,C2,C1,yes,N,27,,188066,34435,LWQ
28,,SING,C2,C6,no,N,28,,188066,34435,LWQ
29,,SING,C12,C11,yes,N,29,,188066,34435,LWQ
30,,SING,N3,C8,no,N,30,,188066,34435,LWQ
31,,SING,N3,C6,no,N,31,,188066,34435,LWQ
32,,DOUB,C8,C10,yes,N,32,,188066,34435,LWQ
33,,DOUB,C15,C14,yes,N,33,,188066,34435,LWQ
34,,DOUB,C6,O1,no,N,34,,188066,34435,LWQ
35,,SING,C11,C14,yes,N,35,,188066,34435,LWQ
36,,DOUB,C11,N4,yes,N,36,,188066,34435,LWQ
37,,SING,C10,N4,yes,N,37,,188066,34435,LWQ
38,,SING,N4,C26,no,N,38,,188066,34435,LWQ
39,,SING,N3,H5,no,N,39,,188066,34435,LWQ
40,,SING,C4,H2,no,N,40,,188066,34435,LWQ
41,,SING,C5,H3,no,N,41,,188066,34435,LWQ
42,,SING,C10,H6,no,N,42,,188066,34435,LWQ
43,,SING,C13,H7,no,N,43,,188066,34435,LWQ
44,,SING,C15,H9,no,N,44,,188066,34435,LWQ
45,,SING,C17,H11,no,N,45,,188066,34435,LWQ
46,,SING,C21,H13,no,N,46,,188066,34435,LWQ
47,,SING,C22,H14,no,N,47,,188066,34435,LWQ
48,,SING,C24,H16,no,N,48,,188066,34435,LWQ
49,,SING,C26,H19,no,N,49,,188066,34435,LWQ
50,,SING,C26,H18,no,N,50,,188066,34435,LWQ
51,,SING,C26,H20,no,N,51,,188066,34435,LWQ
52,,SING,C1,H1,no,N,52,,188066,34435,LWQ
53,,SING,N2,H4,no,N,53,,188066,34435,LWQ
54,,SING,C14,H8,no,N,54,,188066,34435,LWQ
55,,SING,C16,H10,no,N,55,,188066,34435,LWQ
56,,SING,C18,H12,no,N,56,,188066,34435,LWQ
57,,SING,C23,H15,no,N,57,,188066,34435,LWQ
58,,SING,C25,H17,no,N,58,,188066,34435,LWQ
59,,SING,C27,H23,no,N,59,,188066,34435,LWQ
60,,SING,C27,H22,no,N,60,,188066,34435,LWQ
61,,SING,C27,H21,no,N,61,,188066,34435,LWQ
1,,SING,P,O5',no,N,1,,188220,34444,GF2
2,,SING,N1,C2,no,N,2,,188220,34444,GF2
3,,DOUB,C2,N3,no,N,3,,188220,34444,GF2
4,,SING,C2,N2,no,N,4,,188220,34444,GF2
5,,SING,C4,N3,no,N,5,,188220,34444,GF2
6,,DOUB,C5,C4,yes,N,6,,188220,34444,GF2
7,,SING,C6,N1,no,N,7,,188220,34444,GF2
8,,SING,C6,C5,no,N,8,,188220,34444,GF2
9,,DOUB,O6,C6,no,N,9,,188220,34444,GF2
10,,SING,N7,C5,yes,N,10,,188220,34444,GF2
11,,DOUB,N7,C8,yes,N,11,,188220,34444,GF2
12,,SING,C8,N9,yes,N,12,,188220,34444,GF2
13,,SING,N9,C4,yes,N,13,,188220,34444,GF2
14,,SING,N9,C1',no,N,14,,188220,34444,GF2
15,,SING,C1',O4',no,N,15,,188220,34444,GF2
16,,SING,OP2,P,no,N,16,,188220,34444,GF2
17,,SING,C2',F,no,N,17,,188220,34444,GF2
18,,SING,C2',C1',no,N,18,,188220,34444,GF2
19,,DOUB,OP1,P,no,N,19,,188220,34444,GF2
20,,SING,C3',C2',no,N,20,,188220,34444,GF2
21,,SING,C3',C4',no,N,21,,188220,34444,GF2
22,,SING,O3',C3',no,N,22,,188220,34444,GF2
23,,SING,C4',O4',no,N,23,,188220,34444,GF2
24,,SING,C5',C4',no,N,24,,188220,34444,GF2
25,,SING,O5',C5',no,N,25,,188220,34444,GF2
26,,SING,P,OP3,no,N,26,,188220,34444,GF2
27,,SING,N1,HN1,no,N,27,,188220,34444,GF2
28,,SING,N2,HN2,no,N,28,,188220,34444,GF2
29,,SING,N2,HN2A,no,N,29,,188220,34444,GF2
30,,SING,C8,H8,no,N,30,,188220,34444,GF2
31,,SING,C1',H1',no,N,31,,188220,34444,GF2
32,,SING,OP2,HOP2,no,N,32,,188220,34444,GF2
33,,SING,C2',H2',no,N,33,,188220,34444,GF2
34,,SING,C3',H3',no,N,34,,188220,34444,GF2
35,,SING,O3',HO3',no,N,35,,188220,34444,GF2
36,,SING,C4',H4',no,N,36,,188220,34444,GF2
37,,SING,C5',H5',no,N,37,,188220,34444,GF2
38,,SING,C5',H5'A,no,N,38,,188220,34444,GF2
39,,SING,OP3,HOP3,no,N,39,,188220,34444,GF2
1,,SING,O3P,P,no,N,1,,188221,34444,GFL
2,,SING,O3P,HO3P,no,N,2,,188221,34444,GFL
3,,DOUB,P,O1P,no,N,3,,188221,34444,GFL
4,,SING,P,O2P,no,N,4,,188221,34444,GFL
5,,SING,P,O5',no,N,5,,188221,34444,GFL
6,,SING,O2P,HO2P,no,N,6,,188221,34444,GFL
7,,SING,O5',C5',no,N,7,,188221,34444,GFL
8,,SING,C5',C4',no,N,8,,188221,34444,GFL
9,,SING,C5',H5'1,no,N,9,,188221,34444,GFL
10,,SING,C5',H5'2,no,N,10,,188221,34444,GFL
11,,SING,C4',O4',no,N,11,,188221,34444,GFL
12,,SING,C4',C3',no,N,12,,188221,34444,GFL
13,,SING,C4',H4',no,N,13,,188221,34444,GFL
14,,SING,O4',C1',no,N,14,,188221,34444,GFL
15,,SING,C3',O3',no,N,15,,188221,34444,GFL
16,,SING,C3',C2',no,N,16,,188221,34444,GFL
17,,SING,C3',H3',no,N,17,,188221,34444,GFL
18,,SING,O3',HO3',no,N,18,,188221,34444,GFL
19,,SING,C2',C1',no,N,19,,188221,34444,GFL
20,,SING,C2',F,no,N,20,,188221,34444,GFL
21,,SING,C2',H2',no,N,21,,188221,34444,GFL
22,,SING,C1',N9,no,N,22,,188221,34444,GFL
23,,SING,C1',H1',no,N,23,,188221,34444,GFL
24,,SING,N9,C8,yes,N,24,,188221,34444,GFL
25,,SING,N9,C4,yes,N,25,,188221,34444,GFL
26,,DOUB,C8,N7,yes,N,26,,188221,34444,GFL
27,,SING,C8,H8,no,N,27,,188221,34444,GFL
28,,SING,N7,C5,yes,N,28,,188221,34444,GFL
29,,SING,C5,C6,no,N,29,,188221,34444,GFL
30,,DOUB,C5,C4,yes,N,30,,188221,34444,GFL
31,,DOUB,C6,O6,no,N,31,,188221,34444,GFL
32,,SING,C6,N1,no,N,32,,188221,34444,GFL
33,,SING,N1,C2,no,N,33,,188221,34444,GFL
34,,SING,N1,HN1,no,N,34,,188221,34444,GFL
35,,SING,C2,N2,no,N,35,,188221,34444,GFL
36,,DOUB,C2,N3,no,N,36,,188221,34444,GFL
37,,SING,N2,HN21,no,N,37,,188221,34444,GFL
38,,SING,N2,HN22,no,N,38,,188221,34444,GFL
39,,SING,N3,C4,no,N,39,,188221,34444,GFL
1,,SING,P,O5',no,N,1,,188241,34445,GF2
2,,SING,N1,C2,no,N,2,,188241,34445,GF2
3,,DOUB,C2,N3,no,N,3,,188241,34445,GF2
4,,SING,C2,N2,no,N,4,,188241,34445,GF2
5,,SING,C4,N3,no,N,5,,188241,34445,GF2
6,,DOUB,C5,C4,yes,N,6,,188241,34445,GF2
7,,SING,C6,N1,no,N,7,,188241,34445,GF2
8,,SING,C6,C5,no,N,8,,188241,34445,GF2
9,,DOUB,O6,C6,no,N,9,,188241,34445,GF2
10,,SING,N7,C5,yes,N,10,,188241,34445,GF2
11,,DOUB,N7,C8,yes,N,11,,188241,34445,GF2
12,,SING,C8,N9,yes,N,12,,188241,34445,GF2
13,,SING,N9,C4,yes,N,13,,188241,34445,GF2
14,,SING,N9,C1',no,N,14,,188241,34445,GF2
15,,SING,C1',O4',no,N,15,,188241,34445,GF2
16,,SING,OP2,P,no,N,16,,188241,34445,GF2
17,,SING,C2',F,no,N,17,,188241,34445,GF2
18,,SING,C2',C1',no,N,18,,188241,34445,GF2
19,,DOUB,OP1,P,no,N,19,,188241,34445,GF2
20,,SING,C3',C2',no,N,20,,188241,34445,GF2
21,,SING,C3',C4',no,N,21,,188241,34445,GF2
22,,SING,O3',C3',no,N,22,,188241,34445,GF2
23,,SING,C4',O4',no,N,23,,188241,34445,GF2
24,,SING,C5',C4',no,N,24,,188241,34445,GF2
25,,SING,O5',C5',no,N,25,,188241,34445,GF2
26,,SING,P,OP3,no,N,26,,188241,34445,GF2
27,,SING,N1,HN1,no,N,27,,188241,34445,GF2
28,,SING,N2,HN2,no,N,28,,188241,34445,GF2
29,,SING,N2,HN2A,no,N,29,,188241,34445,GF2
30,,SING,C8,H8,no,N,30,,188241,34445,GF2
31,,SING,C1',H1',no,N,31,,188241,34445,GF2
32,,SING,OP2,HOP2,no,N,32,,188241,34445,GF2
33,,SING,C2',H2',no,N,33,,188241,34445,GF2
34,,SING,C3',H3',no,N,34,,188241,34445,GF2
35,,SING,O3',HO3',no,N,35,,188241,34445,GF2
36,,SING,C4',H4',no,N,36,,188241,34445,GF2
37,,SING,C5',H5',no,N,37,,188241,34445,GF2
38,,SING,C5',H5'A,no,N,38,,188241,34445,GF2
39,,SING,OP3,HOP3,no,N,39,,188241,34445,GF2
1,,SING,O3P,P,no,N,1,,188242,34445,GFL
2,,SING,O3P,HO3P,no,N,2,,188242,34445,GFL
3,,DOUB,P,O1P,no,N,3,,188242,34445,GFL
4,,SING,P,O2P,no,N,4,,188242,34445,GFL
5,,SING,P,O5',no,N,5,,188242,34445,GFL
6,,SING,O2P,HO2P,no,N,6,,188242,34445,GFL
7,,SING,O5',C5',no,N,7,,188242,34445,GFL
8,,SING,C5',C4',no,N,8,,188242,34445,GFL
9,,SING,C5',H5'1,no,N,9,,188242,34445,GFL
10,,SING,C5',H5'2,no,N,10,,188242,34445,GFL
11,,SING,C4',O4',no,N,11,,188242,34445,GFL
12,,SING,C4',C3',no,N,12,,188242,34445,GFL
13,,SING,C4',H4',no,N,13,,188242,34445,GFL
14,,SING,O4',C1',no,N,14,,188242,34445,GFL
15,,SING,C3',O3',no,N,15,,188242,34445,GFL
16,,SING,C3',C2',no,N,16,,188242,34445,GFL
17,,SING,C3',H3',no,N,17,,188242,34445,GFL
18,,SING,O3',HO3',no,N,18,,188242,34445,GFL
19,,SING,C2',C1',no,N,19,,188242,34445,GFL
20,,SING,C2',F,no,N,20,,188242,34445,GFL
21,,SING,C2',H2',no,N,21,,188242,34445,GFL
22,,SING,C1',N9,no,N,22,,188242,34445,GFL
23,,SING,C1',H1',no,N,23,,188242,34445,GFL
24,,SING,N9,C8,yes,N,24,,188242,34445,GFL
25,,SING,N9,C4,yes,N,25,,188242,34445,GFL
26,,DOUB,C8,N7,yes,N,26,,188242,34445,GFL
27,,SING,C8,H8,no,N,27,,188242,34445,GFL
28,,SING,N7,C5,yes,N,28,,188242,34445,GFL
29,,SING,C5,C6,no,N,29,,188242,34445,GFL
30,,DOUB,C5,C4,yes,N,30,,188242,34445,GFL
31,,DOUB,C6,O6,no,N,31,,188242,34445,GFL
32,,SING,C6,N1,no,N,32,,188242,34445,GFL
33,,SING,N1,C2,no,N,33,,188242,34445,GFL
34,,SING,N1,HN1,no,N,34,,188242,34445,GFL
35,,SING,C2,N2,no,N,35,,188242,34445,GFL
36,,DOUB,C2,N3,no,N,36,,188242,34445,GFL
37,,SING,N2,HN21,no,N,37,,188242,34445,GFL
38,,SING,N2,HN22,no,N,38,,188242,34445,GFL
39,,SING,N3,C4,no,N,39,,188242,34445,GFL
1,,SING,P,O5',no,N,1,,188996,34499,GF2
2,,SING,N1,C2,no,N,2,,188996,34499,GF2
3,,DOUB,C2,N3,no,N,3,,188996,34499,GF2
4,,SING,C2,N2,no,N,4,,188996,34499,GF2
5,,SING,C4,N3,no,N,5,,188996,34499,GF2
6,,DOUB,C5,C4,yes,N,6,,188996,34499,GF2
7,,SING,C6,N1,no,N,7,,188996,34499,GF2
8,,SING,C6,C5,no,N,8,,188996,34499,GF2
9,,DOUB,O6,C6,no,N,9,,188996,34499,GF2
10,,SING,N7,C5,yes,N,10,,188996,34499,GF2
11,,DOUB,N7,C8,yes,N,11,,188996,34499,GF2
12,,SING,C8,N9,yes,N,12,,188996,34499,GF2
13,,SING,N9,C4,yes,N,13,,188996,34499,GF2
14,,SING,N9,C1',no,N,14,,188996,34499,GF2
15,,SING,C1',O4',no,N,15,,188996,34499,GF2
16,,SING,OP2,P,no,N,16,,188996,34499,GF2
17,,SING,C2',F,no,N,17,,188996,34499,GF2
18,,SING,C2',C1',no,N,18,,188996,34499,GF2
19,,DOUB,OP1,P,no,N,19,,188996,34499,GF2
20,,SING,C3',C2',no,N,20,,188996,34499,GF2
21,,SING,C3',C4',no,N,21,,188996,34499,GF2
22,,SING,O3',C3',no,N,22,,188996,34499,GF2
23,,SING,C4',O4',no,N,23,,188996,34499,GF2
24,,SING,C5',C4',no,N,24,,188996,34499,GF2
25,,SING,O5',C5',no,N,25,,188996,34499,GF2
26,,SING,P,OP3,no,N,26,,188996,34499,GF2
27,,SING,N1,HN1,no,N,27,,188996,34499,GF2
28,,SING,N2,HN2,no,N,28,,188996,34499,GF2
29,,SING,N2,HN2A,no,N,29,,188996,34499,GF2
30,,SING,C8,H8,no,N,30,,188996,34499,GF2
31,,SING,C1',H1',no,N,31,,188996,34499,GF2
32,,SING,OP2,HOP2,no,N,32,,188996,34499,GF2
33,,SING,C2',H2',no,N,33,,188996,34499,GF2
34,,SING,C3',H3',no,N,34,,188996,34499,GF2
35,,SING,O3',HO3',no,N,35,,188996,34499,GF2
36,,SING,C4',H4',no,N,36,,188996,34499,GF2
37,,SING,C5',H5',no,N,37,,188996,34499,GF2
38,,SING,C5',H5'A,no,N,38,,188996,34499,GF2
39,,SING,OP3,HOP3,no,N,39,,188996,34499,GF2
1,,DOUB,P,OP1,no,N,1,,188997,34499,LCG
2,,SING,P,O5',no,N,2,,188997,34499,LCG
3,,SING,P,OP2,no,N,3,,188997,34499,LCG
4,,SING,P,OP3,no,N,4,,188997,34499,LCG
5,,SING,O5',C5',no,N,5,,188997,34499,LCG
6,,SING,C5',C4',no,N,6,,188997,34499,LCG
7,,SING,C5',H5',no,N,7,,188997,34499,LCG
8,,SING,C5',H5'',no,N,8,,188997,34499,LCG
9,,SING,C3',C2',no,N,9,,188997,34499,LCG
10,,SING,C3',C4',no,N,10,,188997,34499,LCG
11,,SING,C3',O3',no,N,11,,188997,34499,LCG
12,,SING,C3',H3',no,N,12,,188997,34499,LCG
13,,SING,C6',C4',no,N,13,,188997,34499,LCG
14,,SING,C6',O2',no,N,14,,188997,34499,LCG
15,,SING,C6',H6'1,no,N,15,,188997,34499,LCG
16,,SING,C6',H6'2,no,N,16,,188997,34499,LCG
17,,SING,N9,C8,yes,N,17,,188997,34499,LCG
18,,SING,N9,C4,yes,N,18,,188997,34499,LCG
19,,SING,N9,C1',no,N,19,,188997,34499,LCG
20,,DOUB,C8,N7,yes,N,20,,188997,34499,LCG
21,,SING,C8,H8,no,N,21,,188997,34499,LCG
22,,DOUB,C4,C5,yes,N,22,,188997,34499,LCG
23,,SING,C4,N3,no,N,23,,188997,34499,LCG
24,,SING,N7,C5,yes,N,24,,188997,34499,LCG
25,,SING,C5,C6,no,N,25,,188997,34499,LCG
26,,DOUB,C6,O6,no,N,26,,188997,34499,LCG
27,,SING,C6,N1,no,N,27,,188997,34499,LCG
28,,SING,C2',C1',no,N,28,,188997,34499,LCG
29,,SING,C2',O2',no,N,29,,188997,34499,LCG
30,,SING,C2',H2',no,N,30,,188997,34499,LCG
31,,SING,C4',O4',no,N,31,,188997,34499,LCG
32,,SING,C1',O4',no,N,32,,188997,34499,LCG
33,,SING,C1',H1',no,N,33,,188997,34499,LCG
34,,SING,C2,N1,no,N,34,,188997,34499,LCG
35,,SING,C2,N2,no,N,35,,188997,34499,LCG
36,,DOUB,C2,N3,no,N,36,,188997,34499,LCG
37,,SING,N1,H1,no,N,37,,188997,34499,LCG
38,,SING,OP2,HOP2,no,N,38,,188997,34499,LCG
39,,SING,N2,H21,no,N,39,,188997,34499,LCG
40,,SING,N2,H22,no,N,40,,188997,34499,LCG
41,,SING,O3',HO3',no,N,41,,188997,34499,LCG
42,,SING,OP3,HOP3,no,N,42,,188997,34499,LCG
1,,SING,FE,NA,no,N,1,,189017,345,HEC
2,,SING,FE,NB,no,N,2,,189017,345,HEC
3,,SING,FE,NC,no,N,3,,189017,345,HEC
4,,SING,FE,ND,no,N,4,,189017,345,HEC
5,,DOUB,CHA,C1A,no,N,5,,189017,345,HEC
6,,SING,CHA,C4D,no,N,6,,189017,345,HEC
7,,SING,CHA,HHA,no,N,7,,189017,345,HEC
8,,DOUB,CHB,C4A,no,N,8,,189017,345,HEC
9,,SING,CHB,C1B,no,N,9,,189017,345,HEC
10,,SING,CHB,HHB,no,N,10,,189017,345,HEC
11,,DOUB,CHC,C4B,no,N,11,,189017,345,HEC
12,,SING,CHC,C1C,no,N,12,,189017,345,HEC
13,,SING,CHC,HHC,no,N,13,,189017,345,HEC
14,,DOUB,CHD,C4C,no,N,14,,189017,345,HEC
15,,SING,CHD,C1D,no,N,15,,189017,345,HEC
16,,SING,CHD,HHD,no,N,16,,189017,345,HEC
17,,SING,NA,C1A,yes,N,17,,189017,345,HEC
18,,SING,NA,C4A,yes,N,18,,189017,345,HEC
19,,SING,C1A,C2A,yes,N,19,,189017,345,HEC
20,,DOUB,C2A,C3A,yes,N,20,,189017,345,HEC
21,,SING,C2A,CAA,no,N,21,,189017,345,HEC
22,,SING,C3A,C4A,yes,N,22,,189017,345,HEC
23,,SING,C3A,CMA,no,N,23,,189017,345,HEC
24,,SING,CMA,HMA1,no,N,24,,189017,345,HEC
25,,SING,CMA,HMA2,no,N,25,,189017,345,HEC
26,,SING,CMA,HMA3,no,N,26,,189017,345,HEC
27,,SING,CAA,CBA,no,N,27,,189017,345,HEC
28,,SING,CAA,HAA1,no,N,28,,189017,345,HEC
29,,SING,CAA,HAA2,no,N,29,,189017,345,HEC
30,,SING,CBA,CGA,no,N,30,,189017,345,HEC
31,,SING,CBA,HBA1,no,N,31,,189017,345,HEC
32,,SING,CBA,HBA2,no,N,32,,189017,345,HEC
33,,DOUB,CGA,O1A,no,N,33,,189017,345,HEC
34,,SING,CGA,O2A,no,N,34,,189017,345,HEC
35,,SING,O2A,H2A,no,N,35,,189017,345,HEC
36,,SING,NB,C1B,yes,N,36,,189017,345,HEC
37,,SING,NB,C4B,yes,N,37,,189017,345,HEC
38,,DOUB,C1B,C2B,yes,N,38,,189017,345,HEC
39,,SING,C2B,C3B,yes,N,39,,189017,345,HEC
40,,SING,C2B,CMB,no,N,40,,189017,345,HEC
41,,SING,C3B,C4B,yes,N,41,,189017,345,HEC
42,,DOUB,C3B,CAB,no,E,42,,189017,345,HEC
43,,SING,CMB,HMB1,no,N,43,,189017,345,HEC
44,,SING,CMB,HMB2,no,N,44,,189017,345,HEC
45,,SING,CMB,HMB3,no,N,45,,189017,345,HEC
46,,SING,CAB,CBB,no,N,46,,189017,345,HEC
47,,SING,CAB,HAB,no,N,47,,189017,345,HEC
48,,SING,CBB,HBB1,no,N,48,,189017,345,HEC
49,,SING,CBB,HBB2,no,N,49,,189017,345,HEC
50,,SING,CBB,HBB3,no,N,50,,189017,345,HEC
51,,SING,NC,C1C,yes,N,51,,189017,345,HEC
52,,SING,NC,C4C,yes,N,52,,189017,345,HEC
53,,DOUB,C1C,C2C,yes,N,53,,189017,345,HEC
54,,SING,C2C,C3C,yes,N,54,,189017,345,HEC
55,,SING,C2C,CMC,no,N,55,,189017,345,HEC
56,,SING,C3C,C4C,yes,N,56,,189017,345,HEC
57,,DOUB,C3C,CAC,no,E,57,,189017,345,HEC
58,,SING,CMC,HMC1,no,N,58,,189017,345,HEC
59,,SING,CMC,HMC2,no,N,59,,189017,345,HEC
60,,SING,CMC,HMC3,no,N,60,,189017,345,HEC
61,,SING,CAC,CBC,no,N,61,,189017,345,HEC
62,,SING,CAC,HAC,no,N,62,,189017,345,HEC
63,,SING,CBC,HBC1,no,N,63,,189017,345,HEC
64,,SING,CBC,HBC2,no,N,64,,189017,345,HEC
65,,SING,CBC,HBC3,no,N,65,,189017,345,HEC
66,,SING,ND,C1D,yes,N,66,,189017,345,HEC
67,,SING,ND,C4D,yes,N,67,,189017,345,HEC
68,,DOUB,C1D,C2D,yes,N,68,,189017,345,HEC
69,,SING,C2D,C3D,yes,N,69,,189017,345,HEC
70,,SING,C2D,CMD,no,N,70,,189017,345,HEC
71,,DOUB,C3D,C4D,yes,N,71,,189017,345,HEC
72,,SING,C3D,CAD,no,N,72,,189017,345,HEC
73,,SING,CMD,HMD1,no,N,73,,189017,345,HEC
74,,SING,CMD,HMD2,no,N,74,,189017,345,HEC
75,,SING,CMD,HMD3,no,N,75,,189017,345,HEC
76,,SING,CAD,CBD,no,N,76,,189017,345,HEC
77,,SING,CAD,HAD1,no,N,77,,189017,345,HEC
78,,SING,CAD,HAD2,no,N,78,,189017,345,HEC
79,,SING,CBD,CGD,no,N,79,,189017,345,HEC
80,,SING,CBD,HBD1,no,N,80,,189017,345,HEC
81,,SING,CBD,HBD2,no,N,81,,189017,345,HEC
82,,DOUB,CGD,O1D,no,N,82,,189017,345,HEC
83,,SING,CGD,O2D,no,N,83,,189017,345,HEC
84,,SING,O2D,H2D,no,N,84,,189017,345,HEC
1,,SING,N,CA,no,N,1,,189018,345,M3L
2,,SING,N,H,no,N,2,,189018,345,M3L
3,,SING,N,H2,no,N,3,,189018,345,M3L
4,,SING,CA,CB,no,N,4,,189018,345,M3L
5,,SING,CA,C,no,N,5,,189018,345,M3L
6,,SING,CA,HA,no,N,6,,189018,345,M3L
7,,SING,CB,CG,no,N,7,,189018,345,M3L
8,,SING,CB,HB2,no,N,8,,189018,345,M3L
9,,SING,CB,HB3,no,N,9,,189018,345,M3L
10,,SING,CG,CD,no,N,10,,189018,345,M3L
11,,SING,CG,HG2,no,N,11,,189018,345,M3L
12,,SING,CG,HG3,no,N,12,,189018,345,M3L
13,,SING,CD,CE,no,N,13,,189018,345,M3L
14,,SING,CD,HD2,no,N,14,,189018,345,M3L
15,,SING,CD,HD3,no,N,15,,189018,345,M3L
16,,SING,CE,NZ,no,N,16,,189018,345,M3L
17,,SING,CE,HE2,no,N,17,,189018,345,M3L
18,,SING,CE,HE3,no,N,18,,189018,345,M3L
19,,SING,NZ,CM1,no,N,19,,189018,345,M3L
20,,SING,NZ,CM2,no,N,20,,189018,345,M3L
21,,SING,NZ,CM3,no,N,21,,189018,345,M3L
22,,DOUB,C,O,no,N,22,,189018,345,M3L
23,,SING,C,OXT,no,N,23,,189018,345,M3L
24,,SING,OXT,HXT,no,N,24,,189018,345,M3L
25,,SING,CM1,HM11,no,N,25,,189018,345,M3L
26,,SING,CM1,HM12,no,N,26,,189018,345,M3L
27,,SING,CM1,HM13,no,N,27,,189018,345,M3L
28,,SING,CM2,HM21,no,N,28,,189018,345,M3L
29,,SING,CM2,HM22,no,N,29,,189018,345,M3L
30,,SING,CM2,HM23,no,N,30,,189018,345,M3L
31,,SING,CM3,HM31,no,N,31,,189018,345,M3L
32,,SING,CM3,HM32,no,N,32,,189018,345,M3L
33,,SING,CM3,HM33,no,N,33,,189018,345,M3L
1,,DOUB,P,OP1,no,N,1,,189058,34502,LCG
2,,SING,P,O5',no,N,2,,189058,34502,LCG
3,,SING,P,OP2,no,N,3,,189058,34502,LCG
4,,SING,P,OP3,no,N,4,,189058,34502,LCG
5,,SING,O5',C5',no,N,5,,189058,34502,LCG
6,,SING,C5',C4',no,N,6,,189058,34502,LCG
7,,SING,C5',H5',no,N,7,,189058,34502,LCG
8,,SING,C5',H5'',no,N,8,,189058,34502,LCG
9,,SING,C3',C2',no,N,9,,189058,34502,LCG
10,,SING,C3',C4',no,N,10,,189058,34502,LCG
11,,SING,C3',O3',no,N,11,,189058,34502,LCG
12,,SING,C3',H3',no,N,12,,189058,34502,LCG
13,,SING,C6',C4',no,N,13,,189058,34502,LCG
14,,SING,C6',O2',no,N,14,,189058,34502,LCG
15,,SING,C6',H6'1,no,N,15,,189058,34502,LCG
16,,SING,C6',H6'2,no,N,16,,189058,34502,LCG
17,,SING,N9,C8,yes,N,17,,189058,34502,LCG
18,,SING,N9,C4,yes,N,18,,189058,34502,LCG
19,,SING,N9,C1',no,N,19,,189058,34502,LCG
20,,DOUB,C8,N7,yes,N,20,,189058,34502,LCG
21,,SING,C8,H8,no,N,21,,189058,34502,LCG
22,,DOUB,C4,C5,yes,N,22,,189058,34502,LCG
23,,SING,C4,N3,no,N,23,,189058,34502,LCG
24,,SING,N7,C5,yes,N,24,,189058,34502,LCG
25,,SING,C5,C6,no,N,25,,189058,34502,LCG
26,,DOUB,C6,O6,no,N,26,,189058,34502,LCG
27,,SING,C6,N1,no,N,27,,189058,34502,LCG
28,,SING,C2',C1',no,N,28,,189058,34502,LCG
29,,SING,C2',O2',no,N,29,,189058,34502,LCG
30,,SING,C2',H2',no,N,30,,189058,34502,LCG
31,,SING,C4',O4',no,N,31,,189058,34502,LCG
32,,SING,C1',O4',no,N,32,,189058,34502,LCG
33,,SING,C1',H1',no,N,33,,189058,34502,LCG
34,,SING,C2,N1,no,N,34,,189058,34502,LCG
35,,SING,C2,N2,no,N,35,,189058,34502,LCG
36,,DOUB,C2,N3,no,N,36,,189058,34502,LCG
37,,SING,N1,H1,no,N,37,,189058,34502,LCG
38,,SING,OP2,HOP2,no,N,38,,189058,34502,LCG
39,,SING,N2,H21,no,N,39,,189058,34502,LCG
40,,SING,N2,H22,no,N,40,,189058,34502,LCG
41,,SING,O3',HO3',no,N,41,,189058,34502,LCG
42,,SING,OP3,HOP3,no,N,42,,189058,34502,LCG
1,,SING,FE,NA,no,N,1,,189177,346,HEC
2,,SING,FE,NB,no,N,2,,189177,346,HEC
3,,SING,FE,NC,no,N,3,,189177,346,HEC
4,,SING,FE,ND,no,N,4,,189177,346,HEC
5,,DOUB,CHA,C1A,no,N,5,,189177,346,HEC
6,,SING,CHA,C4D,no,N,6,,189177,346,HEC
7,,SING,CHA,HHA,no,N,7,,189177,346,HEC
8,,DOUB,CHB,C4A,no,N,8,,189177,346,HEC
9,,SING,CHB,C1B,no,N,9,,189177,346,HEC
10,,SING,CHB,HHB,no,N,10,,189177,346,HEC
11,,DOUB,CHC,C4B,no,N,11,,189177,346,HEC
12,,SING,CHC,C1C,no,N,12,,189177,346,HEC
13,,SING,CHC,HHC,no,N,13,,189177,346,HEC
14,,DOUB,CHD,C4C,no,N,14,,189177,346,HEC
15,,SING,CHD,C1D,no,N,15,,189177,346,HEC
16,,SING,CHD,HHD,no,N,16,,189177,346,HEC
17,,SING,NA,C1A,yes,N,17,,189177,346,HEC
18,,SING,NA,C4A,yes,N,18,,189177,346,HEC
19,,SING,C1A,C2A,yes,N,19,,189177,346,HEC
20,,DOUB,C2A,C3A,yes,N,20,,189177,346,HEC
21,,SING,C2A,CAA,no,N,21,,189177,346,HEC
22,,SING,C3A,C4A,yes,N,22,,189177,346,HEC
23,,SING,C3A,CMA,no,N,23,,189177,346,HEC
24,,SING,CMA,HMA1,no,N,24,,189177,346,HEC
25,,SING,CMA,HMA2,no,N,25,,189177,346,HEC
26,,SING,CMA,HMA3,no,N,26,,189177,346,HEC
27,,SING,CAA,CBA,no,N,27,,189177,346,HEC
28,,SING,CAA,HAA1,no,N,28,,189177,346,HEC
29,,SING,CAA,HAA2,no,N,29,,189177,346,HEC
30,,SING,CBA,CGA,no,N,30,,189177,346,HEC
31,,SING,CBA,HBA1,no,N,31,,189177,346,HEC
32,,SING,CBA,HBA2,no,N,32,,189177,346,HEC
33,,DOUB,CGA,O1A,no,N,33,,189177,346,HEC
34,,SING,CGA,O2A,no,N,34,,189177,346,HEC
35,,SING,O2A,H2A,no,N,35,,189177,346,HEC
36,,SING,NB,C1B,yes,N,36,,189177,346,HEC
37,,SING,NB,C4B,yes,N,37,,189177,346,HEC
38,,DOUB,C1B,C2B,yes,N,38,,189177,346,HEC
39,,SING,C2B,C3B,yes,N,39,,189177,346,HEC
40,,SING,C2B,CMB,no,N,40,,189177,346,HEC
41,,SING,C3B,C4B,yes,N,41,,189177,346,HEC
42,,DOUB,C3B,CAB,no,E,42,,189177,346,HEC
43,,SING,CMB,HMB1,no,N,43,,189177,346,HEC
44,,SING,CMB,HMB2,no,N,44,,189177,346,HEC
45,,SING,CMB,HMB3,no,N,45,,189177,346,HEC
46,,SING,CAB,CBB,no,N,46,,189177,346,HEC
47,,SING,CAB,HAB,no,N,47,,189177,346,HEC
48,,SING,CBB,HBB1,no,N,48,,189177,346,HEC
49,,SING,CBB,HBB2,no,N,49,,189177,346,HEC
50,,SING,CBB,HBB3,no,N,50,,189177,346,HEC
51,,SING,NC,C1C,yes,N,51,,189177,346,HEC
52,,SING,NC,C4C,yes,N,52,,189177,346,HEC
53,,DOUB,C1C,C2C,yes,N,53,,189177,346,HEC
54,,SING,C2C,C3C,yes,N,54,,189177,346,HEC
55,,SING,C2C,CMC,no,N,55,,189177,346,HEC
56,,SING,C3C,C4C,yes,N,56,,189177,346,HEC
57,,DOUB,C3C,CAC,no,E,57,,189177,346,HEC
58,,SING,CMC,HMC1,no,N,58,,189177,346,HEC
59,,SING,CMC,HMC2,no,N,59,,189177,346,HEC
60,,SING,CMC,HMC3,no,N,60,,189177,346,HEC
61,,SING,CAC,CBC,no,N,61,,189177,346,HEC
62,,SING,CAC,HAC,no,N,62,,189177,346,HEC
63,,SING,CBC,HBC1,no,N,63,,189177,346,HEC
64,,SING,CBC,HBC2,no,N,64,,189177,346,HEC
65,,SING,CBC,HBC3,no,N,65,,189177,346,HEC
66,,SING,ND,C1D,yes,N,66,,189177,346,HEC
67,,SING,ND,C4D,yes,N,67,,189177,346,HEC
68,,DOUB,C1D,C2D,yes,N,68,,189177,346,HEC
69,,SING,C2D,C3D,yes,N,69,,189177,346,HEC
70,,SING,C2D,CMD,no,N,70,,189177,346,HEC
71,,DOUB,C3D,C4D,yes,N,71,,189177,346,HEC
72,,SING,C3D,CAD,no,N,72,,189177,346,HEC
73,,SING,CMD,HMD1,no,N,73,,189177,346,HEC
74,,SING,CMD,HMD2,no,N,74,,189177,346,HEC
75,,SING,CMD,HMD3,no,N,75,,189177,346,HEC
76,,SING,CAD,CBD,no,N,76,,189177,346,HEC
77,,SING,CAD,HAD1,no,N,77,,189177,346,HEC
78,,SING,CAD,HAD2,no,N,78,,189177,346,HEC
79,,SING,CBD,CGD,no,N,79,,189177,346,HEC
80,,SING,CBD,HBD1,no,N,80,,189177,346,HEC
81,,SING,CBD,HBD2,no,N,81,,189177,346,HEC
82,,DOUB,CGD,O1D,no,N,82,,189177,346,HEC
83,,SING,CGD,O2D,no,N,83,,189177,346,HEC
84,,SING,O2D,H2D,no,N,84,,189177,346,HEC
1,,SING,N,CA,no,N,1,,189178,346,M3L
2,,SING,N,H,no,N,2,,189178,346,M3L
3,,SING,N,H2,no,N,3,,189178,346,M3L
4,,SING,CA,CB,no,N,4,,189178,346,M3L
5,,SING,CA,C,no,N,5,,189178,346,M3L
6,,SING,CA,HA,no,N,6,,189178,346,M3L
7,,SING,CB,CG,no,N,7,,189178,346,M3L
8,,SING,CB,HB2,no,N,8,,189178,346,M3L
9,,SING,CB,HB3,no,N,9,,189178,346,M3L
10,,SING,CG,CD,no,N,10,,189178,346,M3L
11,,SING,CG,HG2,no,N,11,,189178,346,M3L
12,,SING,CG,HG3,no,N,12,,189178,346,M3L
13,,SING,CD,CE,no,N,13,,189178,346,M3L
14,,SING,CD,HD2,no,N,14,,189178,346,M3L
15,,SING,CD,HD3,no,N,15,,189178,346,M3L
16,,SING,CE,NZ,no,N,16,,189178,346,M3L
17,,SING,CE,HE2,no,N,17,,189178,346,M3L
18,,SING,CE,HE3,no,N,18,,189178,346,M3L
19,,SING,NZ,CM1,no,N,19,,189178,346,M3L
20,,SING,NZ,CM2,no,N,20,,189178,346,M3L
21,,SING,NZ,CM3,no,N,21,,189178,346,M3L
22,,DOUB,C,O,no,N,22,,189178,346,M3L
23,,SING,C,OXT,no,N,23,,189178,346,M3L
24,,SING,OXT,HXT,no,N,24,,189178,346,M3L
25,,SING,CM1,HM11,no,N,25,,189178,346,M3L
26,,SING,CM1,HM12,no,N,26,,189178,346,M3L
27,,SING,CM1,HM13,no,N,27,,189178,346,M3L
28,,SING,CM2,HM21,no,N,28,,189178,346,M3L
29,,SING,CM2,HM22,no,N,29,,189178,346,M3L
30,,SING,CM2,HM23,no,N,30,,189178,346,M3L
31,,SING,CM3,HM31,no,N,31,,189178,346,M3L
32,,SING,CM3,HM32,no,N,32,,189178,346,M3L
33,,SING,CM3,HM33,no,N,33,,189178,346,M3L
1,,SING,N,CA,no,N,1,,189205,3471,AYA
2,,SING,N,CT,no,N,2,,189205,3471,AYA
3,,SING,N,H,no,N,3,,189205,3471,AYA
4,,SING,CA,CB,no,N,4,,189205,3471,AYA
5,,SING,CA,C,no,N,5,,189205,3471,AYA
6,,SING,CA,HA,no,N,6,,189205,3471,AYA
7,,SING,CB,HB1,no,N,7,,189205,3471,AYA
8,,SING,CB,HB2,no,N,8,,189205,3471,AYA
9,,SING,CB,HB3,no,N,9,,189205,3471,AYA
10,,DOUB,C,O,no,N,10,,189205,3471,AYA
11,,SING,C,OXT,no,N,11,,189205,3471,AYA
12,,SING,OXT,HXT,no,N,12,,189205,3471,AYA
13,,DOUB,CT,OT,no,N,13,,189205,3471,AYA
14,,SING,CT,CM,no,N,14,,189205,3471,AYA
15,,SING,CM,HM1,no,N,15,,189205,3471,AYA
16,,SING,CM,HM2,no,N,16,,189205,3471,AYA
17,,SING,CM,HM3,no,N,17,,189205,3471,AYA
1,,SING,N,CA,no,N,1,,189219,3472,AYA
2,,SING,N,CT,no,N,2,,189219,3472,AYA
3,,SING,N,H,no,N,3,,189219,3472,AYA
4,,SING,CA,CB,no,N,4,,189219,3472,AYA
5,,SING,CA,C,no,N,5,,189219,3472,AYA
6,,SING,CA,HA,no,N,6,,189219,3472,AYA
7,,SING,CB,HB1,no,N,7,,189219,3472,AYA
8,,SING,CB,HB2,no,N,8,,189219,3472,AYA
9,,SING,CB,HB3,no,N,9,,189219,3472,AYA
10,,DOUB,C,O,no,N,10,,189219,3472,AYA
11,,SING,C,OXT,no,N,11,,189219,3472,AYA
12,,SING,OXT,HXT,no,N,12,,189219,3472,AYA
13,,DOUB,CT,OT,no,N,13,,189219,3472,AYA
14,,SING,CT,CM,no,N,14,,189219,3472,AYA
15,,SING,CM,HM1,no,N,15,,189219,3472,AYA
16,,SING,CM,HM2,no,N,16,,189219,3472,AYA
17,,SING,CM,HM3,no,N,17,,189219,3472,AYA
1,,SING,N,HN1,no,N,1,,189413,36,NH2
2,,SING,N,HN2,no,N,2,,189413,36,NH2
1,,DOUB,OH,CH,no,N,1,,189440,36000,ALY
2,,SING,CH,CH3,no,N,2,,189440,36000,ALY
3,,SING,CH,NZ,no,N,3,,189440,36000,ALY
4,,SING,CH3,HH31,no,N,4,,189440,36000,ALY
5,,SING,CH3,HH32,no,N,5,,189440,36000,ALY
6,,SING,CH3,HH33,no,N,6,,189440,36000,ALY
7,,SING,NZ,CE,no,N,7,,189440,36000,ALY
8,,SING,NZ,HZ,no,N,8,,189440,36000,ALY
9,,SING,CE,CD,no,N,9,,189440,36000,ALY
10,,SING,CE,HE3,no,N,10,,189440,36000,ALY
11,,SING,CE,HE2,no,N,11,,189440,36000,ALY
12,,SING,CD,CG,no,N,12,,189440,36000,ALY
13,,SING,CD,HD3,no,N,13,,189440,36000,ALY
14,,SING,CD,HD2,no,N,14,,189440,36000,ALY
15,,SING,CG,CB,no,N,15,,189440,36000,ALY
16,,SING,CG,HG3,no,N,16,,189440,36000,ALY
17,,SING,CG,HG2,no,N,17,,189440,36000,ALY
18,,SING,CB,CA,no,N,18,,189440,36000,ALY
19,,SING,CB,HB3,no,N,19,,189440,36000,ALY
20,,SING,CB,HB2,no,N,20,,189440,36000,ALY
21,,SING,CA,N,no,N,21,,189440,36000,ALY
22,,SING,CA,C,no,N,22,,189440,36000,ALY
23,,SING,CA,HCA,no,N,23,,189440,36000,ALY
24,,SING,N,H,no,N,24,,189440,36000,ALY
25,,SING,N,H2,no,N,25,,189440,36000,ALY
26,,DOUB,C,O,no,N,26,,189440,36000,ALY
27,,SING,C,OXT,no,N,27,,189440,36000,ALY
28,,SING,OXT,HXT,no,N,28,,189440,36000,ALY
1,,DOUB,OH,CH,no,N,1,,189509,36006,ALY
2,,SING,CH,CH3,no,N,2,,189509,36006,ALY
3,,SING,CH,NZ,no,N,3,,189509,36006,ALY
4,,SING,CH3,HH31,no,N,4,,189509,36006,ALY
5,,SING,CH3,HH32,no,N,5,,189509,36006,ALY
6,,SING,CH3,HH33,no,N,6,,189509,36006,ALY
7,,SING,NZ,CE,no,N,7,,189509,36006,ALY
8,,SING,NZ,HZ,no,N,8,,189509,36006,ALY
9,,SING,CE,CD,no,N,9,,189509,36006,ALY
10,,SING,CE,HE3,no,N,10,,189509,36006,ALY
11,,SING,CE,HE2,no,N,11,,189509,36006,ALY
12,,SING,CD,CG,no,N,12,,189509,36006,ALY
13,,SING,CD,HD3,no,N,13,,189509,36006,ALY
14,,SING,CD,HD2,no,N,14,,189509,36006,ALY
15,,SING,CG,CB,no,N,15,,189509,36006,ALY
16,,SING,CG,HG3,no,N,16,,189509,36006,ALY
17,,SING,CG,HG2,no,N,17,,189509,36006,ALY
18,,SING,CB,CA,no,N,18,,189509,36006,ALY
19,,SING,CB,HB3,no,N,19,,189509,36006,ALY
20,,SING,CB,HB2,no,N,20,,189509,36006,ALY
21,,SING,CA,N,no,N,21,,189509,36006,ALY
22,,SING,CA,C,no,N,22,,189509,36006,ALY
23,,SING,CA,HCA,no,N,23,,189509,36006,ALY
24,,SING,N,H,no,N,24,,189509,36006,ALY
25,,SING,N,H2,no,N,25,,189509,36006,ALY
26,,DOUB,C,O,no,N,26,,189509,36006,ALY
27,,SING,C,OXT,no,N,27,,189509,36006,ALY
28,,SING,OXT,HXT,no,N,28,,189509,36006,ALY
1,,DOUB,OH,CH,no,N,1,,189533,36007,ALY
2,,SING,CH,CH3,no,N,2,,189533,36007,ALY
3,,SING,CH,NZ,no,N,3,,189533,36007,ALY
4,,SING,CH3,HH31,no,N,4,,189533,36007,ALY
5,,SING,CH3,HH32,no,N,5,,189533,36007,ALY
6,,SING,CH3,HH33,no,N,6,,189533,36007,ALY
7,,SING,NZ,CE,no,N,7,,189533,36007,ALY
8,,SING,NZ,HZ,no,N,8,,189533,36007,ALY
9,,SING,CE,CD,no,N,9,,189533,36007,ALY
10,,SING,CE,HE3,no,N,10,,189533,36007,ALY
11,,SING,CE,HE2,no,N,11,,189533,36007,ALY
12,,SING,CD,CG,no,N,12,,189533,36007,ALY
13,,SING,CD,HD3,no,N,13,,189533,36007,ALY
14,,SING,CD,HD2,no,N,14,,189533,36007,ALY
15,,SING,CG,CB,no,N,15,,189533,36007,ALY
16,,SING,CG,HG3,no,N,16,,189533,36007,ALY
17,,SING,CG,HG2,no,N,17,,189533,36007,ALY
18,,SING,CB,CA,no,N,18,,189533,36007,ALY
19,,SING,CB,HB3,no,N,19,,189533,36007,ALY
20,,SING,CB,HB2,no,N,20,,189533,36007,ALY
21,,SING,CA,N,no,N,21,,189533,36007,ALY
22,,SING,CA,C,no,N,22,,189533,36007,ALY
23,,SING,CA,HCA,no,N,23,,189533,36007,ALY
24,,SING,N,H,no,N,24,,189533,36007,ALY
25,,SING,N,H2,no,N,25,,189533,36007,ALY
26,,DOUB,C,O,no,N,26,,189533,36007,ALY
27,,SING,C,OXT,no,N,27,,189533,36007,ALY
28,,SING,OXT,HXT,no,N,28,,189533,36007,ALY
1,,DOUB,OH,CH,no,N,1,,189557,36008,ALY
2,,SING,CH,CH3,no,N,2,,189557,36008,ALY
3,,SING,CH,NZ,no,N,3,,189557,36008,ALY
4,,SING,CH3,HH31,no,N,4,,189557,36008,ALY
5,,SING,CH3,HH32,no,N,5,,189557,36008,ALY
6,,SING,CH3,HH33,no,N,6,,189557,36008,ALY
7,,SING,NZ,CE,no,N,7,,189557,36008,ALY
8,,SING,NZ,HZ,no,N,8,,189557,36008,ALY
9,,SING,CE,CD,no,N,9,,189557,36008,ALY
10,,SING,CE,HE3,no,N,10,,189557,36008,ALY
11,,SING,CE,HE2,no,N,11,,189557,36008,ALY
12,,SING,CD,CG,no,N,12,,189557,36008,ALY
13,,SING,CD,HD3,no,N,13,,189557,36008,ALY
14,,SING,CD,HD2,no,N,14,,189557,36008,ALY
15,,SING,CG,CB,no,N,15,,189557,36008,ALY
16,,SING,CG,HG3,no,N,16,,189557,36008,ALY
17,,SING,CG,HG2,no,N,17,,189557,36008,ALY
18,,SING,CB,CA,no,N,18,,189557,36008,ALY
19,,SING,CB,HB3,no,N,19,,189557,36008,ALY
20,,SING,CB,HB2,no,N,20,,189557,36008,ALY
21,,SING,CA,N,no,N,21,,189557,36008,ALY
22,,SING,CA,C,no,N,22,,189557,36008,ALY
23,,SING,CA,HCA,no,N,23,,189557,36008,ALY
24,,SING,N,H,no,N,24,,189557,36008,ALY
25,,SING,N,H2,no,N,25,,189557,36008,ALY
26,,DOUB,C,O,no,N,26,,189557,36008,ALY
27,,SING,C,OXT,no,N,27,,189557,36008,ALY
28,,SING,OXT,HXT,no,N,28,,189557,36008,ALY
1,,SING,N,CA,no,N,1,,189581,36009,DSN
2,,SING,N,H,no,N,2,,189581,36009,DSN
3,,SING,N,H2,no,N,3,,189581,36009,DSN
4,,SING,CA,C,no,N,4,,189581,36009,DSN
5,,SING,CA,CB,no,N,5,,189581,36009,DSN
6,,SING,CA,HA,no,N,6,,189581,36009,DSN
7,,DOUB,C,O,no,N,7,,189581,36009,DSN
8,,SING,C,OXT,no,N,8,,189581,36009,DSN
9,,SING,OXT,HXT,no,N,9,,189581,36009,DSN
10,,SING,CB,OG,no,N,10,,189581,36009,DSN
11,,SING,CB,HB2,no,N,11,,189581,36009,DSN
12,,SING,CB,HB3,no,N,12,,189581,36009,DSN
13,,SING,OG,HG,no,N,13,,189581,36009,DSN
1,,SING,C1,C2,no,N,1,,190077,36051,MAN
2,,SING,C1,O1,no,N,2,,190077,36051,MAN
3,,SING,C1,O5,no,N,3,,190077,36051,MAN
4,,SING,C1,H1,no,N,4,,190077,36051,MAN
5,,SING,C2,C3,no,N,5,,190077,36051,MAN
6,,SING,C2,O2,no,N,6,,190077,36051,MAN
7,,SING,C2,H2,no,N,7,,190077,36051,MAN
8,,SING,C3,C4,no,N,8,,190077,36051,MAN
9,,SING,C3,O3,no,N,9,,190077,36051,MAN
10,,SING,C3,H3,no,N,10,,190077,36051,MAN
11,,SING,C4,C5,no,N,11,,190077,36051,MAN
12,,SING,C4,O4,no,N,12,,190077,36051,MAN
13,,SING,C4,H4,no,N,13,,190077,36051,MAN
14,,SING,C5,C6,no,N,14,,190077,36051,MAN
15,,SING,C5,O5,no,N,15,,190077,36051,MAN
16,,SING,C5,H5,no,N,16,,190077,36051,MAN
17,,SING,C6,O6,no,N,17,,190077,36051,MAN
18,,SING,C6,H61,no,N,18,,190077,36051,MAN
19,,SING,C6,H62,no,N,19,,190077,36051,MAN
20,,SING,O1,HO1,no,N,20,,190077,36051,MAN
21,,SING,O2,HO2,no,N,21,,190077,36051,MAN
22,,SING,O3,HO3,no,N,22,,190077,36051,MAN
23,,SING,O4,HO4,no,N,23,,190077,36051,MAN
24,,SING,O6,HO6,no,N,24,,190077,36051,MAN
1,,SING,C1,C2,no,N,1,,190098,36052,MAN
2,,SING,C1,O1,no,N,2,,190098,36052,MAN
3,,SING,C1,O5,no,N,3,,190098,36052,MAN
4,,SING,C1,H1,no,N,4,,190098,36052,MAN
5,,SING,C2,C3,no,N,5,,190098,36052,MAN
6,,SING,C2,O2,no,N,6,,190098,36052,MAN
7,,SING,C2,H2,no,N,7,,190098,36052,MAN
8,,SING,C3,C4,no,N,8,,190098,36052,MAN
9,,SING,C3,O3,no,N,9,,190098,36052,MAN
10,,SING,C3,H3,no,N,10,,190098,36052,MAN
11,,SING,C4,C5,no,N,11,,190098,36052,MAN
12,,SING,C4,O4,no,N,12,,190098,36052,MAN
13,,SING,C4,H4,no,N,13,,190098,36052,MAN
14,,SING,C5,C6,no,N,14,,190098,36052,MAN
15,,SING,C5,O5,no,N,15,,190098,36052,MAN
16,,SING,C5,H5,no,N,16,,190098,36052,MAN
17,,SING,C6,O6,no,N,17,,190098,36052,MAN
18,,SING,C6,H61,no,N,18,,190098,36052,MAN
19,,SING,C6,H62,no,N,19,,190098,36052,MAN
20,,SING,O1,HO1,no,N,20,,190098,36052,MAN
21,,SING,O2,HO2,no,N,21,,190098,36052,MAN
22,,SING,O3,HO3,no,N,22,,190098,36052,MAN
23,,SING,O4,HO4,no,N,23,,190098,36052,MAN
24,,SING,O6,HO6,no,N,24,,190098,36052,MAN
1,,SING,C1,C2,no,N,1,,190119,36053,MAN
2,,SING,C1,O1,no,N,2,,190119,36053,MAN
3,,SING,C1,O5,no,N,3,,190119,36053,MAN
4,,SING,C1,H1,no,N,4,,190119,36053,MAN
5,,SING,C2,C3,no,N,5,,190119,36053,MAN
6,,SING,C2,O2,no,N,6,,190119,36053,MAN
7,,SING,C2,H2,no,N,7,,190119,36053,MAN
8,,SING,C3,C4,no,N,8,,190119,36053,MAN
9,,SING,C3,O3,no,N,9,,190119,36053,MAN
10,,SING,C3,H3,no,N,10,,190119,36053,MAN
11,,SING,C4,C5,no,N,11,,190119,36053,MAN
12,,SING,C4,O4,no,N,12,,190119,36053,MAN
13,,SING,C4,H4,no,N,13,,190119,36053,MAN
14,,SING,C5,C6,no,N,14,,190119,36053,MAN
15,,SING,C5,O5,no,N,15,,190119,36053,MAN
16,,SING,C5,H5,no,N,16,,190119,36053,MAN
17,,SING,C6,O6,no,N,17,,190119,36053,MAN
18,,SING,C6,H61,no,N,18,,190119,36053,MAN
19,,SING,C6,H62,no,N,19,,190119,36053,MAN
20,,SING,O1,HO1,no,N,20,,190119,36053,MAN
21,,SING,O2,HO2,no,N,21,,190119,36053,MAN
22,,SING,O3,HO3,no,N,22,,190119,36053,MAN
23,,SING,O4,HO4,no,N,23,,190119,36053,MAN
24,,SING,O6,HO6,no,N,24,,190119,36053,MAN
1,,SING,C2,C3,no,N,1,,190140,36054,BGC
2,,SING,C2,C1,no,N,2,,190140,36054,BGC
3,,SING,C2,O2,no,N,3,,190140,36054,BGC
4,,SING,C2,H2,no,N,4,,190140,36054,BGC
5,,SING,C3,C4,no,N,5,,190140,36054,BGC
6,,SING,C3,O3,no,N,6,,190140,36054,BGC
7,,SING,C3,H3,no,N,7,,190140,36054,BGC
8,,SING,C4,C5,no,N,8,,190140,36054,BGC
9,,SING,C4,O4,no,N,9,,190140,36054,BGC
10,,SING,C4,H4,no,N,10,,190140,36054,BGC
11,,SING,C5,C6,no,N,11,,190140,36054,BGC
12,,SING,C5,O5,no,N,12,,190140,36054,BGC
13,,SING,C5,H5,no,N,13,,190140,36054,BGC
14,,SING,C6,O6,no,N,14,,190140,36054,BGC
15,,SING,C6,H6C1,no,N,15,,190140,36054,BGC
16,,SING,C6,H6C2,no,N,16,,190140,36054,BGC
17,,SING,C1,O1,no,N,17,,190140,36054,BGC
18,,SING,C1,O5,no,N,18,,190140,36054,BGC
19,,SING,C1,H1,no,N,19,,190140,36054,BGC
20,,SING,O1,HA,no,N,20,,190140,36054,BGC
21,,SING,O2,HB,no,N,21,,190140,36054,BGC
22,,SING,O3,HC,no,N,22,,190140,36054,BGC
23,,SING,O4,HD,no,N,23,,190140,36054,BGC
24,,SING,O6,H6,no,N,24,,190140,36054,BGC
1,,SING,C1,C2,no,N,1,,190161,36055,MAN
2,,SING,C1,O1,no,N,2,,190161,36055,MAN
3,,SING,C1,O5,no,N,3,,190161,36055,MAN
4,,SING,C1,H1,no,N,4,,190161,36055,MAN
5,,SING,C2,C3,no,N,5,,190161,36055,MAN
6,,SING,C2,O2,no,N,6,,190161,36055,MAN
7,,SING,C2,H2,no,N,7,,190161,36055,MAN
8,,SING,C3,C4,no,N,8,,190161,36055,MAN
9,,SING,C3,O3,no,N,9,,190161,36055,MAN
10,,SING,C3,H3,no,N,10,,190161,36055,MAN
11,,SING,C4,C5,no,N,11,,190161,36055,MAN
12,,SING,C4,O4,no,N,12,,190161,36055,MAN
13,,SING,C4,H4,no,N,13,,190161,36055,MAN
14,,SING,C5,C6,no,N,14,,190161,36055,MAN
15,,SING,C5,O5,no,N,15,,190161,36055,MAN
16,,SING,C5,H5,no,N,16,,190161,36055,MAN
17,,SING,C6,O6,no,N,17,,190161,36055,MAN
18,,SING,C6,H61,no,N,18,,190161,36055,MAN
19,,SING,C6,H62,no,N,19,,190161,36055,MAN
20,,SING,O1,HO1,no,N,20,,190161,36055,MAN
21,,SING,O2,HO2,no,N,21,,190161,36055,MAN
22,,SING,O3,HO3,no,N,22,,190161,36055,MAN
23,,SING,O4,HO4,no,N,23,,190161,36055,MAN
24,,SING,O6,HO6,no,N,24,,190161,36055,MAN
1,,SING,C1,C2,no,N,1,,190182,36056,MAN
2,,SING,C1,O1,no,N,2,,190182,36056,MAN
3,,SING,C1,O5,no,N,3,,190182,36056,MAN
4,,SING,C1,H1,no,N,4,,190182,36056,MAN
5,,SING,C2,C3,no,N,5,,190182,36056,MAN
6,,SING,C2,O2,no,N,6,,190182,36056,MAN
7,,SING,C2,H2,no,N,7,,190182,36056,MAN
8,,SING,C3,C4,no,N,8,,190182,36056,MAN
9,,SING,C3,O3,no,N,9,,190182,36056,MAN
10,,SING,C3,H3,no,N,10,,190182,36056,MAN
11,,SING,C4,C5,no,N,11,,190182,36056,MAN
12,,SING,C4,O4,no,N,12,,190182,36056,MAN
13,,SING,C4,H4,no,N,13,,190182,36056,MAN
14,,SING,C5,C6,no,N,14,,190182,36056,MAN
15,,SING,C5,O5,no,N,15,,190182,36056,MAN
16,,SING,C5,H5,no,N,16,,190182,36056,MAN
17,,SING,C6,O6,no,N,17,,190182,36056,MAN
18,,SING,C6,H61,no,N,18,,190182,36056,MAN
19,,SING,C6,H62,no,N,19,,190182,36056,MAN
20,,SING,O1,HO1,no,N,20,,190182,36056,MAN
21,,SING,O2,HO2,no,N,21,,190182,36056,MAN
22,,SING,O3,HO3,no,N,22,,190182,36056,MAN
23,,SING,O4,HO4,no,N,23,,190182,36056,MAN
24,,SING,O6,HO6,no,N,24,,190182,36056,MAN
1,,SING,N,CA,no,N,1,,190552,36081,SEP
2,,SING,N,H,no,N,2,,190552,36081,SEP
3,,SING,N,H2,no,N,3,,190552,36081,SEP
4,,SING,CA,CB,no,N,4,,190552,36081,SEP
5,,SING,CA,C,no,N,5,,190552,36081,SEP
6,,SING,CA,HA,no,N,6,,190552,36081,SEP
7,,SING,CB,OG,no,N,7,,190552,36081,SEP
8,,SING,CB,HB2,no,N,8,,190552,36081,SEP
9,,SING,CB,HB3,no,N,9,,190552,36081,SEP
10,,SING,OG,P,no,N,10,,190552,36081,SEP
11,,DOUB,C,O,no,N,11,,190552,36081,SEP
12,,SING,C,OXT,no,N,12,,190552,36081,SEP
13,,SING,OXT,HXT,no,N,13,,190552,36081,SEP
14,,DOUB,P,O1P,no,N,14,,190552,36081,SEP
15,,SING,P,O2P,no,N,15,,190552,36081,SEP
16,,SING,P,O3P,no,N,16,,190552,36081,SEP
17,,SING,O2P,HOP2,no,N,17,,190552,36081,SEP
18,,SING,O3P,HOP3,no,N,18,,190552,36081,SEP
1,,SING,N,CA,no,N,1,,190569,36082,SEP
2,,SING,N,H,no,N,2,,190569,36082,SEP
3,,SING,N,H2,no,N,3,,190569,36082,SEP
4,,SING,CA,CB,no,N,4,,190569,36082,SEP
5,,SING,CA,C,no,N,5,,190569,36082,SEP
6,,SING,CA,HA,no,N,6,,190569,36082,SEP
7,,SING,CB,OG,no,N,7,,190569,36082,SEP
8,,SING,CB,HB2,no,N,8,,190569,36082,SEP
9,,SING,CB,HB3,no,N,9,,190569,36082,SEP
10,,SING,OG,P,no,N,10,,190569,36082,SEP
11,,DOUB,C,O,no,N,11,,190569,36082,SEP
12,,SING,C,OXT,no,N,12,,190569,36082,SEP
13,,SING,OXT,HXT,no,N,13,,190569,36082,SEP
14,,DOUB,P,O1P,no,N,14,,190569,36082,SEP
15,,SING,P,O2P,no,N,15,,190569,36082,SEP
16,,SING,P,O3P,no,N,16,,190569,36082,SEP
17,,SING,O2P,HOP2,no,N,17,,190569,36082,SEP
18,,SING,O3P,HOP3,no,N,18,,190569,36082,SEP
1,,SING,N,CA,no,N,1,,191229,36157,DAL
2,,SING,N,H,no,N,2,,191229,36157,DAL
3,,SING,N,H2,no,N,3,,191229,36157,DAL
4,,SING,CA,CB,no,N,4,,191229,36157,DAL
5,,SING,CA,C,no,N,5,,191229,36157,DAL
6,,SING,CA,HA,no,N,6,,191229,36157,DAL
7,,SING,CB,HB1,no,N,7,,191229,36157,DAL
8,,SING,CB,HB2,no,N,8,,191229,36157,DAL
9,,SING,CB,HB3,no,N,9,,191229,36157,DAL
10,,DOUB,C,O,no,N,10,,191229,36157,DAL
11,,SING,C,OXT,no,N,11,,191229,36157,DAL
12,,SING,OXT,HXT,no,N,12,,191229,36157,DAL
1,,SING,N,CA,no,N,1,,191230,36157,DBB
2,,SING,CA,C,no,N,2,,191230,36157,DBB
3,,SING,CA,CB,no,N,3,,191230,36157,DBB
4,,DOUB,C,O,no,N,4,,191230,36157,DBB
5,,SING,CB,CG,no,N,5,,191230,36157,DBB
6,,SING,C,OXT,no,N,6,,191230,36157,DBB
7,,SING,N,H,no,N,7,,191230,36157,DBB
8,,SING,N,H1,no,N,8,,191230,36157,DBB
9,,SING,CA,HA,no,N,9,,191230,36157,DBB
10,,SING,CB,HB2,no,N,10,,191230,36157,DBB
11,,SING,CB,HB3,no,N,11,,191230,36157,DBB
12,,SING,CG,HG1,no,N,12,,191230,36157,DBB
13,,SING,CG,HG2,no,N,13,,191230,36157,DBB
14,,SING,CG,HG3,no,N,14,,191230,36157,DBB
15,,SING,OXT,HXT,no,N,15,,191230,36157,DBB
1,,SING,N,CA,no,N,1,,191231,36157,DBU
2,,SING,N,H,no,N,2,,191231,36157,DBU
3,,SING,N,H2,no,N,3,,191231,36157,DBU
4,,DOUB,CA,CB,no,Z,4,,191231,36157,DBU
5,,SING,CA,C,no,N,5,,191231,36157,DBU
6,,SING,CB,CG,no,N,6,,191231,36157,DBU
7,,SING,CB,HB,no,N,7,,191231,36157,DBU
8,,SING,CG,HG1,no,N,8,,191231,36157,DBU
9,,SING,CG,HG2,no,N,9,,191231,36157,DBU
10,,SING,CG,HG3,no,N,10,,191231,36157,DBU
11,,DOUB,C,O,no,N,11,,191231,36157,DBU
12,,SING,C,OXT,no,N,12,,191231,36157,DBU
13,,SING,OXT,HXT,no,N,13,,191231,36157,DBU
1,,SING,N,CA,no,N,1,,191246,36158,DAL
2,,SING,N,H,no,N,2,,191246,36158,DAL
3,,SING,N,H2,no,N,3,,191246,36158,DAL
4,,SING,CA,CB,no,N,4,,191246,36158,DAL
5,,SING,CA,C,no,N,5,,191246,36158,DAL
6,,SING,CA,HA,no,N,6,,191246,36158,DAL
7,,SING,CB,HB1,no,N,7,,191246,36158,DAL
8,,SING,CB,HB2,no,N,8,,191246,36158,DAL
9,,SING,CB,HB3,no,N,9,,191246,36158,DAL
10,,DOUB,C,O,no,N,10,,191246,36158,DAL
11,,SING,C,OXT,no,N,11,,191246,36158,DAL
12,,SING,OXT,HXT,no,N,12,,191246,36158,DAL
1,,SING,N,CA,no,N,1,,191247,36158,DBB
2,,SING,CA,C,no,N,2,,191247,36158,DBB
3,,SING,CA,CB,no,N,3,,191247,36158,DBB
4,,DOUB,C,O,no,N,4,,191247,36158,DBB
5,,SING,CB,CG,no,N,5,,191247,36158,DBB
6,,SING,C,OXT,no,N,6,,191247,36158,DBB
7,,SING,N,H,no,N,7,,191247,36158,DBB
8,,SING,N,H1,no,N,8,,191247,36158,DBB
9,,SING,CA,HA,no,N,9,,191247,36158,DBB
10,,SING,CB,HB2,no,N,10,,191247,36158,DBB
11,,SING,CB,HB3,no,N,11,,191247,36158,DBB
12,,SING,CG,HG1,no,N,12,,191247,36158,DBB
13,,SING,CG,HG2,no,N,13,,191247,36158,DBB
14,,SING,CG,HG3,no,N,14,,191247,36158,DBB
15,,SING,OXT,HXT,no,N,15,,191247,36158,DBB
1,,SING,N,CA,no,N,1,,191248,36158,DBU
2,,SING,N,H,no,N,2,,191248,36158,DBU
3,,SING,N,H2,no,N,3,,191248,36158,DBU
4,,DOUB,CA,CB,no,Z,4,,191248,36158,DBU
5,,SING,CA,C,no,N,5,,191248,36158,DBU
6,,SING,CB,CG,no,N,6,,191248,36158,DBU
7,,SING,CB,HB,no,N,7,,191248,36158,DBU
8,,SING,CG,HG1,no,N,8,,191248,36158,DBU
9,,SING,CG,HG2,no,N,9,,191248,36158,DBU
10,,SING,CG,HG3,no,N,10,,191248,36158,DBU
11,,DOUB,C,O,no,N,11,,191248,36158,DBU
12,,SING,C,OXT,no,N,12,,191248,36158,DBU
13,,SING,OXT,HXT,no,N,13,,191248,36158,DBU
1,,SING,C59,N46,no,N,1,,191264,36159,9F0
2,,SING,C59,C58,no,N,2,,191264,36159,9F0
3,,SING,C61,N46,no,N,3,,191264,36159,9F0
4,,SING,C61,C60,no,N,4,,191264,36159,9F0
5,,SING,N46,PT1,no,N,5,,191264,36159,9F0
6,,SING,C58,N48,no,N,6,,191264,36159,9F0
7,,SING,C60,N47,no,N,7,,191264,36159,9F0
8,,SING,C54,C55,no,N,8,,191264,36159,9F0
9,,SING,C54,N44,no,N,9,,191264,36159,9F0
10,,SING,N48,PT1,no,N,10,,191264,36159,9F0
11,,SING,PT1,N47,no,N,11,,191264,36159,9F0
12,,SING,PT1,N30,no,N,12,,191264,36159,9F0
13,,SING,C55,N45,no,N,13,,191264,36159,9F0
14,,SING,N44,PT3,no,N,14,,191264,36159,9F0
15,,SING,N45,PT3,no,N,15,,191264,36159,9F0
16,,SING,N45,C56,no,N,16,,191264,36159,9F0
17,,DOUB,C31,N30,yes,N,17,,191264,36159,9F0
18,,SING,C31,C32,yes,N,18,,191264,36159,9F0
19,,SING,N30,C29,yes,N,19,,191264,36159,9F0
20,,DOUB,C32,C22,yes,N,20,,191264,36159,9F0
21,,SING,PT3,N43,no,N,21,,191264,36159,9F0
22,,SING,PT3,N25,no,N,22,,191264,36159,9F0
23,,SING,C56,C57,no,N,23,,191264,36159,9F0
24,,DOUB,C26,C27,yes,N,24,,191264,36159,9F0
25,,SING,C26,N25,yes,N,25,,191264,36159,9F0
26,,SING,C57,N43,no,N,26,,191264,36159,9F0
27,,SING,C27,C20,yes,N,27,,191264,36159,9F0
28,,DOUB,N25,C24,yes,N,28,,191264,36159,9F0
29,,DOUB,C29,C28,yes,N,29,,191264,36159,9F0
30,,SING,C22,C28,yes,N,30,,191264,36159,9F0
31,,SING,C22,C12,no,N,31,,191264,36159,9F0
32,,DOUB,C13,C12,yes,N,32,,191264,36159,9F0
33,,SING,C13,C14,yes,N,33,,191264,36159,9F0
34,,SING,C20,C7,no,N,34,,191264,36159,9F0
35,,DOUB,C20,C23,yes,N,35,,191264,36159,9F0
36,,SING,C12,C11,yes,N,36,,191264,36159,9F0
37,,SING,C24,C23,yes,N,37,,191264,36159,9F0
38,,DOUB,C6,C7,yes,N,38,,191264,36159,9F0
39,,SING,C6,C5,yes,N,39,,191264,36159,9F0
40,,SING,C7,C8,yes,N,40,,191264,36159,9F0
41,,DOUB,C14,C4,yes,N,41,,191264,36159,9F0
42,,DOUB,C5,C3,yes,N,42,,191264,36159,9F0
43,,DOUB,C11,C10,yes,N,43,,191264,36159,9F0
44,,SING,C4,C10,yes,N,44,,191264,36159,9F0
45,,SING,C4,N1,no,N,45,,191264,36159,9F0
46,,DOUB,C8,C9,yes,N,46,,191264,36159,9F0
47,,SING,C3,C9,yes,N,47,,191264,36159,9F0
48,,SING,C3,N1,no,N,48,,191264,36159,9F0
49,,SING,N1,C2,no,N,49,,191264,36159,9F0
50,,DOUB,C2,C19,yes,N,50,,191264,36159,9F0
51,,SING,C2,C15,yes,N,51,,191264,36159,9F0
52,,SING,C19,C18,yes,N,52,,191264,36159,9F0
53,,DOUB,C15,C16,yes,N,53,,191264,36159,9F0
54,,DOUB,C18,C17,yes,N,54,,191264,36159,9F0
55,,SING,C16,C17,yes,N,55,,191264,36159,9F0
56,,SING,C17,C21,no,N,56,,191264,36159,9F0
57,,DOUB,C21,C33,yes,N,57,,191264,36159,9F0
58,,SING,C21,C37,yes,N,58,,191264,36159,9F0
59,,SING,C33,C34,yes,N,59,,191264,36159,9F0
60,,DOUB,C37,C36,yes,N,60,,191264,36159,9F0
61,,DOUB,C34,N35,yes,N,61,,191264,36159,9F0
62,,SING,C36,N35,yes,N,62,,191264,36159,9F0
63,,SING,N35,PT2,no,N,63,,191264,36159,9F0
64,,SING,N41,PT2,no,N,64,,191264,36159,9F0
65,,SING,N41,C50,no,N,65,,191264,36159,9F0
66,,SING,PT2,N42,no,N,66,,191264,36159,9F0
67,,SING,PT2,N49,no,N,67,,191264,36159,9F0
68,,SING,N42,C53,no,N,68,,191264,36159,9F0
69,,SING,C50,C51,no,N,69,,191264,36159,9F0
70,,SING,C53,C52,no,N,70,,191264,36159,9F0
71,,SING,N49,C51,no,N,71,,191264,36159,9F0
72,,SING,N49,C52,no,N,72,,191264,36159,9F0
73,,SING,C5,H5,no,N,73,,191264,36159,9F0
74,,SING,C8,H8,no,N,74,,191264,36159,9F0
75,,SING,C10,H10,no,N,75,,191264,36159,9F0
76,,SING,C14,H14,no,N,76,,191264,36159,9F0
77,,SING,C23,H23,no,N,77,,191264,36159,9F0
78,,SING,C24,H24,no,N,78,,191264,36159,9F0
79,,SING,C27,H27,no,N,79,,191264,36159,9F0
80,,SING,C28,H28,no,N,80,,191264,36159,9F0
81,,SING,C32,H32,no,N,81,,191264,36159,9F0
82,,SING,C34,H34,no,N,82,,191264,36159,9F0
83,,SING,N41,H9X,no,N,83,,191264,36159,9F0
84,,SING,C50,H50,no,N,84,,191264,36159,9F0
85,,SING,C50,H9L,no,N,85,,191264,36159,9F0
86,,SING,C51,H51,no,N,86,,191264,36159,9F0
87,,SING,C51,H9M,no,N,87,,191264,36159,9F0
88,,SING,C52,H9N,no,N,88,,191264,36159,9F0
89,,SING,C52,H52,no,N,89,,191264,36159,9F0
90,,SING,C53,H9O,no,N,90,,191264,36159,9F0
91,,SING,C53,H53,no,N,91,,191264,36159,9F0
92,,SING,N42,H9Y,no,N,92,,191264,36159,9F0
93,,SING,C36,H36,no,N,93,,191264,36159,9F0
94,,SING,C37,H37,no,N,94,,191264,36159,9F0
95,,SING,C33,H33,no,N,95,,191264,36159,9F0
96,,SING,C18,H18,no,N,96,,191264,36159,9F0
97,,SING,C19,H19,no,N,97,,191264,36159,9F0
98,,SING,C16,H16,no,N,98,,191264,36159,9F0
99,,SING,C15,H15,no,N,99,,191264,36159,9F0
100,,SING,C13,H13,no,N,100,,191264,36159,9F0
101,,SING,C11,H11,no,N,101,,191264,36159,9F0
102,,SING,C31,H31,no,N,102,,191264,36159,9F0
103,,SING,C29,H29,no,N,103,,191264,36159,9F0
104,,SING,N47,H91,no,N,104,,191264,36159,9F0
105,,SING,C60,H9V,no,N,105,,191264,36159,9F0
106,,SING,C60,H60,no,N,106,,191264,36159,9F0
107,,SING,C61,H9W,no,N,107,,191264,36159,9F0
108,,SING,C61,H61,no,N,108,,191264,36159,9F0
109,,SING,C59,H59,no,N,109,,191264,36159,9F0
110,,SING,C59,H9U,no,N,110,,191264,36159,9F0
111,,SING,C58,H58,no,N,111,,191264,36159,9F0
112,,SING,C58,H9T,no,N,112,,191264,36159,9F0
113,,SING,N48,H48,no,N,113,,191264,36159,9F0
114,,SING,C9,H9,no,N,114,,191264,36159,9F0
115,,SING,C6,H6,no,N,115,,191264,36159,9F0
116,,SING,C26,H26,no,N,116,,191264,36159,9F0
117,,SING,N43,H43,no,N,117,,191264,36159,9F0
118,,SING,C57,H9S,no,N,118,,191264,36159,9F0
119,,SING,C57,H57,no,N,119,,191264,36159,9F0
120,,SING,C56,H9R,no,N,120,,191264,36159,9F0
121,,SING,C56,H56,no,N,121,,191264,36159,9F0
122,,SING,C55,H9Q,no,N,122,,191264,36159,9F0
123,,SING,C55,H55,no,N,123,,191264,36159,9F0
124,,SING,C54,H54,no,N,124,,191264,36159,9F0
125,,SING,C54,H9P,no,N,125,,191264,36159,9F0
126,,SING,N44,H44,no,N,126,,191264,36159,9F0
127,,SING,N41,H41,no,N,127,,191264,36159,9F0
128,,SING,N42,H42,no,N,128,,191264,36159,9F0
129,,SING,N43,H9Z,no,N,129,,191264,36159,9F0
130,,SING,N44,H90,no,N,130,,191264,36159,9F0
131,,SING,N45,H45,no,N,131,,191264,36159,9F0
132,,SING,N46,H46,no,N,132,,191264,36159,9F0
133,,SING,N47,H47,no,N,133,,191264,36159,9F0
134,,SING,N48,H92,no,N,134,,191264,36159,9F0
135,,SING,N49,H49,no,N,135,,191264,36159,9F0
1,,SING,C59,N46,no,N,1,,191287,36160,9F0
2,,SING,C59,C58,no,N,2,,191287,36160,9F0
3,,SING,C61,N46,no,N,3,,191287,36160,9F0
4,,SING,C61,C60,no,N,4,,191287,36160,9F0
5,,SING,N46,PT1,no,N,5,,191287,36160,9F0
6,,SING,C58,N48,no,N,6,,191287,36160,9F0
7,,SING,C60,N47,no,N,7,,191287,36160,9F0
8,,SING,C54,C55,no,N,8,,191287,36160,9F0
9,,SING,C54,N44,no,N,9,,191287,36160,9F0
10,,SING,N48,PT1,no,N,10,,191287,36160,9F0
11,,SING,PT1,N47,no,N,11,,191287,36160,9F0
12,,SING,PT1,N30,no,N,12,,191287,36160,9F0
13,,SING,C55,N45,no,N,13,,191287,36160,9F0
14,,SING,N44,PT3,no,N,14,,191287,36160,9F0
15,,SING,N45,PT3,no,N,15,,191287,36160,9F0
16,,SING,N45,C56,no,N,16,,191287,36160,9F0
17,,DOUB,C31,N30,yes,N,17,,191287,36160,9F0
18,,SING,C31,C32,yes,N,18,,191287,36160,9F0
19,,SING,N30,C29,yes,N,19,,191287,36160,9F0
20,,DOUB,C32,C22,yes,N,20,,191287,36160,9F0
21,,SING,PT3,N43,no,N,21,,191287,36160,9F0
22,,SING,PT3,N25,no,N,22,,191287,36160,9F0
23,,SING,C56,C57,no,N,23,,191287,36160,9F0
24,,DOUB,C26,C27,yes,N,24,,191287,36160,9F0
25,,SING,C26,N25,yes,N,25,,191287,36160,9F0
26,,SING,C57,N43,no,N,26,,191287,36160,9F0
27,,SING,C27,C20,yes,N,27,,191287,36160,9F0
28,,DOUB,N25,C24,yes,N,28,,191287,36160,9F0
29,,DOUB,C29,C28,yes,N,29,,191287,36160,9F0
30,,SING,C22,C28,yes,N,30,,191287,36160,9F0
31,,SING,C22,C12,no,N,31,,191287,36160,9F0
32,,DOUB,C13,C12,yes,N,32,,191287,36160,9F0
33,,SING,C13,C14,yes,N,33,,191287,36160,9F0
34,,SING,C20,C7,no,N,34,,191287,36160,9F0
35,,DOUB,C20,C23,yes,N,35,,191287,36160,9F0
36,,SING,C12,C11,yes,N,36,,191287,36160,9F0
37,,SING,C24,C23,yes,N,37,,191287,36160,9F0
38,,DOUB,C6,C7,yes,N,38,,191287,36160,9F0
39,,SING,C6,C5,yes,N,39,,191287,36160,9F0
40,,SING,C7,C8,yes,N,40,,191287,36160,9F0
41,,DOUB,C14,C4,yes,N,41,,191287,36160,9F0
42,,DOUB,C5,C3,yes,N,42,,191287,36160,9F0
43,,DOUB,C11,C10,yes,N,43,,191287,36160,9F0
44,,SING,C4,C10,yes,N,44,,191287,36160,9F0
45,,SING,C4,N1,no,N,45,,191287,36160,9F0
46,,DOUB,C8,C9,yes,N,46,,191287,36160,9F0
47,,SING,C3,C9,yes,N,47,,191287,36160,9F0
48,,SING,C3,N1,no,N,48,,191287,36160,9F0
49,,SING,N1,C2,no,N,49,,191287,36160,9F0
50,,DOUB,C2,C19,yes,N,50,,191287,36160,9F0
51,,SING,C2,C15,yes,N,51,,191287,36160,9F0
52,,SING,C19,C18,yes,N,52,,191287,36160,9F0
53,,DOUB,C15,C16,yes,N,53,,191287,36160,9F0
54,,DOUB,C18,C17,yes,N,54,,191287,36160,9F0
55,,SING,C16,C17,yes,N,55,,191287,36160,9F0
56,,SING,C17,C21,no,N,56,,191287,36160,9F0
57,,DOUB,C21,C33,yes,N,57,,191287,36160,9F0
58,,SING,C21,C37,yes,N,58,,191287,36160,9F0
59,,SING,C33,C34,yes,N,59,,191287,36160,9F0
60,,DOUB,C37,C36,yes,N,60,,191287,36160,9F0
61,,DOUB,C34,N35,yes,N,61,,191287,36160,9F0
62,,SING,C36,N35,yes,N,62,,191287,36160,9F0
63,,SING,N35,PT2,no,N,63,,191287,36160,9F0
64,,SING,N41,PT2,no,N,64,,191287,36160,9F0
65,,SING,N41,C50,no,N,65,,191287,36160,9F0
66,,SING,PT2,N42,no,N,66,,191287,36160,9F0
67,,SING,PT2,N49,no,N,67,,191287,36160,9F0
68,,SING,N42,C53,no,N,68,,191287,36160,9F0
69,,SING,C50,C51,no,N,69,,191287,36160,9F0
70,,SING,C53,C52,no,N,70,,191287,36160,9F0
71,,SING,N49,C51,no,N,71,,191287,36160,9F0
72,,SING,N49,C52,no,N,72,,191287,36160,9F0
73,,SING,C5,H5,no,N,73,,191287,36160,9F0
74,,SING,C8,H8,no,N,74,,191287,36160,9F0
75,,SING,C10,H10,no,N,75,,191287,36160,9F0
76,,SING,C14,H14,no,N,76,,191287,36160,9F0
77,,SING,C23,H23,no,N,77,,191287,36160,9F0
78,,SING,C24,H24,no,N,78,,191287,36160,9F0
79,,SING,C27,H27,no,N,79,,191287,36160,9F0
80,,SING,C28,H28,no,N,80,,191287,36160,9F0
81,,SING,C32,H32,no,N,81,,191287,36160,9F0
82,,SING,C34,H34,no,N,82,,191287,36160,9F0
83,,SING,N41,H9X,no,N,83,,191287,36160,9F0
84,,SING,C50,H50,no,N,84,,191287,36160,9F0
85,,SING,C50,H9L,no,N,85,,191287,36160,9F0
86,,SING,C51,H51,no,N,86,,191287,36160,9F0
87,,SING,C51,H9M,no,N,87,,191287,36160,9F0
88,,SING,C52,H9N,no,N,88,,191287,36160,9F0
89,,SING,C52,H52,no,N,89,,191287,36160,9F0
90,,SING,C53,H9O,no,N,90,,191287,36160,9F0
91,,SING,C53,H53,no,N,91,,191287,36160,9F0
92,,SING,N42,H9Y,no,N,92,,191287,36160,9F0
93,,SING,C36,H36,no,N,93,,191287,36160,9F0
94,,SING,C37,H37,no,N,94,,191287,36160,9F0
95,,SING,C33,H33,no,N,95,,191287,36160,9F0
96,,SING,C18,H18,no,N,96,,191287,36160,9F0
97,,SING,C19,H19,no,N,97,,191287,36160,9F0
98,,SING,C16,H16,no,N,98,,191287,36160,9F0
99,,SING,C15,H15,no,N,99,,191287,36160,9F0
100,,SING,C13,H13,no,N,100,,191287,36160,9F0
101,,SING,C11,H11,no,N,101,,191287,36160,9F0
102,,SING,C31,H31,no,N,102,,191287,36160,9F0
103,,SING,C29,H29,no,N,103,,191287,36160,9F0
104,,SING,N47,H91,no,N,104,,191287,36160,9F0
105,,SING,C60,H9V,no,N,105,,191287,36160,9F0
106,,SING,C60,H60,no,N,106,,191287,36160,9F0
107,,SING,C61,H9W,no,N,107,,191287,36160,9F0
108,,SING,C61,H61,no,N,108,,191287,36160,9F0
109,,SING,C59,H59,no,N,109,,191287,36160,9F0
110,,SING,C59,H9U,no,N,110,,191287,36160,9F0
111,,SING,C58,H58,no,N,111,,191287,36160,9F0
112,,SING,C58,H9T,no,N,112,,191287,36160,9F0
113,,SING,N48,H48,no,N,113,,191287,36160,9F0
114,,SING,C9,H9,no,N,114,,191287,36160,9F0
115,,SING,C6,H6,no,N,115,,191287,36160,9F0
116,,SING,C26,H26,no,N,116,,191287,36160,9F0
117,,SING,N43,H43,no,N,117,,191287,36160,9F0
118,,SING,C57,H9S,no,N,118,,191287,36160,9F0
119,,SING,C57,H57,no,N,119,,191287,36160,9F0
120,,SING,C56,H9R,no,N,120,,191287,36160,9F0
121,,SING,C56,H56,no,N,121,,191287,36160,9F0
122,,SING,C55,H9Q,no,N,122,,191287,36160,9F0
123,,SING,C55,H55,no,N,123,,191287,36160,9F0
124,,SING,C54,H54,no,N,124,,191287,36160,9F0
125,,SING,C54,H9P,no,N,125,,191287,36160,9F0
126,,SING,N44,H44,no,N,126,,191287,36160,9F0
127,,SING,N41,H41,no,N,127,,191287,36160,9F0
128,,SING,N42,H42,no,N,128,,191287,36160,9F0
129,,SING,N43,H9Z,no,N,129,,191287,36160,9F0
130,,SING,N44,H90,no,N,130,,191287,36160,9F0
131,,SING,N45,H45,no,N,131,,191287,36160,9F0
132,,SING,N46,H46,no,N,132,,191287,36160,9F0
133,,SING,N47,H47,no,N,133,,191287,36160,9F0
134,,SING,N48,H92,no,N,134,,191287,36160,9F0
135,,SING,N49,H49,no,N,135,,191287,36160,9F0
1,,SING,CAA,OAE,no,N,1,,191346,36163,MQO
2,,SING,CAM,NAH,no,N,2,,191346,36163,MQO
3,,DOUB,CAM,CAI,no,N,3,,191346,36163,MQO
4,,SING,NAH,CAO,no,N,4,,191346,36163,MQO
5,,SING,OAE,CAL,no,N,5,,191346,36163,MQO
6,,SING,CAI,CAK,no,N,6,,191346,36163,MQO
7,,DOUB,CAO,CAL,yes,N,7,,191346,36163,MQO
8,,SING,CAO,CAN,yes,N,8,,191346,36163,MQO
9,,SING,CAL,CAJ,yes,N,9,,191346,36163,MQO
10,,SING,CAK,CAN,no,N,10,,191346,36163,MQO
11,,DOUB,CAK,OAC,no,N,11,,191346,36163,MQO
12,,DOUB,CAN,CAG,yes,N,12,,191346,36163,MQO
13,,DOUB,CAJ,CAF,yes,N,13,,191346,36163,MQO
14,,SING,CAG,CAF,yes,N,14,,191346,36163,MQO
15,,SING,CAF,CAB,no,N,15,,191346,36163,MQO
16,,SING,CAA,HA2,no,N,16,,191346,36163,MQO
17,,SING,CAA,HA3,no,N,17,,191346,36163,MQO
18,,SING,CAA,HA1,no,N,18,,191346,36163,MQO
19,,SING,CAB,HB2,no,N,19,,191346,36163,MQO
20,,SING,CAB,HB3,no,N,20,,191346,36163,MQO
21,,SING,CAB,HB1,no,N,21,,191346,36163,MQO
22,,SING,CAG,HAG,no,N,22,,191346,36163,MQO
23,,SING,CAI,HAI,no,N,23,,191346,36163,MQO
24,,SING,CAJ,HAJ,no,N,24,,191346,36163,MQO
25,,SING,CAM,HAM,no,N,25,,191346,36163,MQO
26,,SING,NAH,HAH,no,N,26,,191346,36163,MQO
1,,DOUB,PG,O1G,no,N,1,,191390,36166,GNP
2,,SING,PG,O2G,no,N,2,,191390,36166,GNP
3,,SING,PG,O3G,no,N,3,,191390,36166,GNP
4,,SING,PG,N3B,no,N,4,,191390,36166,GNP
5,,SING,O2G,HOG2,no,N,5,,191390,36166,GNP
6,,SING,O3G,HOG3,no,N,6,,191390,36166,GNP
7,,SING,N3B,PB,no,N,7,,191390,36166,GNP
8,,SING,N3B,HNB3,no,N,8,,191390,36166,GNP
9,,DOUB,PB,O1B,no,N,9,,191390,36166,GNP
10,,SING,PB,O2B,no,N,10,,191390,36166,GNP
11,,SING,PB,O3A,no,N,11,,191390,36166,GNP
12,,SING,O2B,HOB2,no,N,12,,191390,36166,GNP
13,,SING,O3A,PA,no,N,13,,191390,36166,GNP
14,,DOUB,PA,O1A,no,N,14,,191390,36166,GNP
15,,SING,PA,O2A,no,N,15,,191390,36166,GNP
16,,SING,PA,O5',no,N,16,,191390,36166,GNP
17,,SING,O2A,HOA2,no,N,17,,191390,36166,GNP
18,,SING,O5',C5',no,N,18,,191390,36166,GNP
19,,SING,C5',C4',no,N,19,,191390,36166,GNP
20,,SING,C5',H5'2,no,N,20,,191390,36166,GNP
21,,SING,C5',H5'1,no,N,21,,191390,36166,GNP
22,,SING,C4',O4',no,N,22,,191390,36166,GNP
23,,SING,C4',C3',no,N,23,,191390,36166,GNP
24,,SING,C4',H4',no,N,24,,191390,36166,GNP
25,,SING,O4',C1',no,N,25,,191390,36166,GNP
26,,SING,C3',O3',no,N,26,,191390,36166,GNP
27,,SING,C3',C2',no,N,27,,191390,36166,GNP
28,,SING,C3',H3',no,N,28,,191390,36166,GNP
29,,SING,O3',HO3',no,N,29,,191390,36166,GNP
30,,SING,C2',O2',no,N,30,,191390,36166,GNP
31,,SING,C2',C1',no,N,31,,191390,36166,GNP
32,,SING,C2',H2',no,N,32,,191390,36166,GNP
33,,SING,O2',HO2',no,N,33,,191390,36166,GNP
34,,SING,C1',N9,no,N,34,,191390,36166,GNP
35,,SING,C1',H1',no,N,35,,191390,36166,GNP
36,,SING,N9,C8,yes,N,36,,191390,36166,GNP
37,,SING,N9,C4,yes,N,37,,191390,36166,GNP
38,,DOUB,C8,N7,yes,N,38,,191390,36166,GNP
39,,SING,C8,H8,no,N,39,,191390,36166,GNP
40,,SING,N7,C5,yes,N,40,,191390,36166,GNP
41,,SING,C5,C6,yes,N,41,,191390,36166,GNP
42,,DOUB,C5,C4,yes,N,42,,191390,36166,GNP
43,,DOUB,C6,O6,no,N,43,,191390,36166,GNP
44,,SING,C6,N1,yes,N,44,,191390,36166,GNP
45,,SING,N1,C2,yes,N,45,,191390,36166,GNP
46,,SING,N1,HN1,no,N,46,,191390,36166,GNP
47,,SING,C2,N2,no,N,47,,191390,36166,GNP
48,,DOUB,C2,N3,yes,N,48,,191390,36166,GNP
49,,SING,N2,HN21,no,N,49,,191390,36166,GNP
50,,SING,N2,HN22,no,N,50,,191390,36166,GNP
51,,SING,N3,C4,yes,N,51,,191390,36166,GNP
1,,DOUB,C4,C5,yes,N,1,,191391,36166,KBF
2,,SING,C4,C3,yes,N,2,,191391,36166,KBF
3,,SING,C15,C16,no,N,3,,191391,36166,KBF
4,,SING,C15,C14,no,N,4,,191391,36166,KBF
5,,SING,C5,C6,yes,N,5,,191391,36166,KBF
6,,DOUB,C2,C3,yes,N,6,,191391,36166,KBF
7,,SING,C2,C1,yes,N,7,,191391,36166,KBF
8,,SING,C3,C8,yes,N,8,,191391,36166,KBF
9,,SING,O1,C1,no,N,9,,191391,36166,KBF
10,,SING,C16,O3,no,N,10,,191391,36166,KBF
11,,DOUB,C1,C10,yes,N,11,,191391,36166,KBF
12,,SING,C14,C13,no,N,12,,191391,36166,KBF
13,,DOUB,C6,C7,yes,N,13,,191391,36166,KBF
14,,SING,C8,C7,yes,N,14,,191391,36166,KBF
15,,DOUB,C8,C9,yes,N,15,,191391,36166,KBF
16,,SING,C10,C9,yes,N,16,,191391,36166,KBF
17,,SING,C10,C11,no,N,17,,191391,36166,KBF
18,,SING,O3,C13,no,N,18,,191391,36166,KBF
19,,SING,C13,C12,no,N,19,,191391,36166,KBF
20,,SING,N,C11,no,N,20,,191391,36166,KBF
21,,SING,N,C12,no,N,21,,191391,36166,KBF
22,,DOUB,C11,O2,no,N,22,,191391,36166,KBF
23,,SING,C4,H2,no,N,23,,191391,36166,KBF
24,,SING,C5,H3,no,N,24,,191391,36166,KBF
25,,SING,C6,H4,no,N,25,,191391,36166,KBF
26,,SING,C7,H5,no,N,26,,191391,36166,KBF
27,,SING,C9,H6,no,N,27,,191391,36166,KBF
28,,SING,O1,H22,no,N,28,,191391,36166,KBF
29,,SING,C2,H1,no,N,29,,191391,36166,KBF
30,,SING,N,H21,no,N,30,,191391,36166,KBF
31,,SING,C12,H8,no,N,31,,191391,36166,KBF
32,,SING,C12,H7,no,N,32,,191391,36166,KBF
33,,SING,C15,H12,no,N,33,,191391,36166,KBF
34,,SING,C15,H13,no,N,34,,191391,36166,KBF
35,,SING,C14,H10,no,N,35,,191391,36166,KBF
36,,SING,C14,H11,no,N,36,,191391,36166,KBF
37,,SING,C13,H9,no,N,37,,191391,36166,KBF
38,,SING,C16,H15,no,N,38,,191391,36166,KBF
39,,SING,C16,H14,no,N,39,,191391,36166,KBF
1,,DOUB,C13,C14,yes,N,1,,191481,36172,9F6
2,,SING,C13,C11,yes,N,2,,191481,36172,9F6
3,,SING,C14,N1,yes,N,3,,191481,36172,9F6
4,,DOUB,C11,C5,yes,N,4,,191481,36172,9F6
5,,DOUB,N1,C12,yes,N,5,,191481,36172,9F6
6,,SING,C5,C12,yes,N,6,,191481,36172,9F6
7,,SING,C5,C7,no,N,7,,191481,36172,9F6
8,,DOUB,C7,C6,no,E,8,,191481,36172,9F6
9,,DOUB,C9,C4,yes,N,9,,191481,36172,9F6
10,,SING,C9,C10,yes,N,10,,191481,36172,9F6
11,,SING,C4,C1,yes,N,11,,191481,36172,9F6
12,,SING,C6,C3,no,N,12,,191481,36172,9F6
13,,DOUB,C10,C8,yes,N,13,,191481,36172,9F6
14,,SING,C1,C3,no,N,14,,191481,36172,9F6
15,,DOUB,C1,C2,yes,N,15,,191481,36172,9F6
16,,DOUB,C3,O2,no,N,16,,191481,36172,9F6
17,,SING,C8,C2,yes,N,17,,191481,36172,9F6
18,,SING,C2,O1,no,N,18,,191481,36172,9F6
19,,SING,O1,H1,no,N,19,,191481,36172,9F6
20,,SING,C8,H2,no,N,20,,191481,36172,9F6
21,,SING,C10,H3,no,N,21,,191481,36172,9F6
22,,SING,C9,H4,no,N,22,,191481,36172,9F6
23,,SING,C4,H5,no,N,23,,191481,36172,9F6
24,,SING,C6,H6,no,N,24,,191481,36172,9F6
25,,SING,C7,H7,no,N,25,,191481,36172,9F6
26,,SING,C12,H8,no,N,26,,191481,36172,9F6
27,,SING,C14,H9,no,N,27,,191481,36172,9F6
28,,SING,C13,H10,no,N,28,,191481,36172,9F6
29,,SING,C11,H11,no,N,29,,191481,36172,9F6
1,,SING,N,HN1,no,N,1,,191555,36177,NH2
2,,SING,N,HN2,no,N,2,,191555,36177,NH2
1,,SING,FE,NA,no,N,1,,192033,367,HEC
2,,SING,FE,NB,no,N,2,,192033,367,HEC
3,,SING,FE,NC,no,N,3,,192033,367,HEC
4,,SING,FE,ND,no,N,4,,192033,367,HEC
5,,DOUB,CHA,C1A,no,N,5,,192033,367,HEC
6,,SING,CHA,C4D,no,N,6,,192033,367,HEC
7,,SING,CHA,HHA,no,N,7,,192033,367,HEC
8,,DOUB,CHB,C4A,no,N,8,,192033,367,HEC
9,,SING,CHB,C1B,no,N,9,,192033,367,HEC
10,,SING,CHB,HHB,no,N,10,,192033,367,HEC
11,,DOUB,CHC,C4B,no,N,11,,192033,367,HEC
12,,SING,CHC,C1C,no,N,12,,192033,367,HEC
13,,SING,CHC,HHC,no,N,13,,192033,367,HEC
14,,DOUB,CHD,C4C,no,N,14,,192033,367,HEC
15,,SING,CHD,C1D,no,N,15,,192033,367,HEC
16,,SING,CHD,HHD,no,N,16,,192033,367,HEC
17,,SING,NA,C1A,yes,N,17,,192033,367,HEC
18,,SING,NA,C4A,yes,N,18,,192033,367,HEC
19,,SING,C1A,C2A,yes,N,19,,192033,367,HEC
20,,DOUB,C2A,C3A,yes,N,20,,192033,367,HEC
21,,SING,C2A,CAA,no,N,21,,192033,367,HEC
22,,SING,C3A,C4A,yes,N,22,,192033,367,HEC
23,,SING,C3A,CMA,no,N,23,,192033,367,HEC
24,,SING,CMA,HMA1,no,N,24,,192033,367,HEC
25,,SING,CMA,HMA2,no,N,25,,192033,367,HEC
26,,SING,CMA,HMA3,no,N,26,,192033,367,HEC
27,,SING,CAA,CBA,no,N,27,,192033,367,HEC
28,,SING,CAA,HAA1,no,N,28,,192033,367,HEC
29,,SING,CAA,HAA2,no,N,29,,192033,367,HEC
30,,SING,CBA,CGA,no,N,30,,192033,367,HEC
31,,SING,CBA,HBA1,no,N,31,,192033,367,HEC
32,,SING,CBA,HBA2,no,N,32,,192033,367,HEC
33,,DOUB,CGA,O1A,no,N,33,,192033,367,HEC
34,,SING,CGA,O2A,no,N,34,,192033,367,HEC
35,,SING,O2A,H2A,no,N,35,,192033,367,HEC
36,,SING,NB,C1B,yes,N,36,,192033,367,HEC
37,,SING,NB,C4B,yes,N,37,,192033,367,HEC
38,,DOUB,C1B,C2B,yes,N,38,,192033,367,HEC
39,,SING,C2B,C3B,yes,N,39,,192033,367,HEC
40,,SING,C2B,CMB,no,N,40,,192033,367,HEC
41,,SING,C3B,C4B,yes,N,41,,192033,367,HEC
42,,DOUB,C3B,CAB,no,E,42,,192033,367,HEC
43,,SING,CMB,HMB1,no,N,43,,192033,367,HEC
44,,SING,CMB,HMB2,no,N,44,,192033,367,HEC
45,,SING,CMB,HMB3,no,N,45,,192033,367,HEC
46,,SING,CAB,CBB,no,N,46,,192033,367,HEC
47,,SING,CAB,HAB,no,N,47,,192033,367,HEC
48,,SING,CBB,HBB1,no,N,48,,192033,367,HEC
49,,SING,CBB,HBB2,no,N,49,,192033,367,HEC
50,,SING,CBB,HBB3,no,N,50,,192033,367,HEC
51,,SING,NC,C1C,yes,N,51,,192033,367,HEC
52,,SING,NC,C4C,yes,N,52,,192033,367,HEC
53,,DOUB,C1C,C2C,yes,N,53,,192033,367,HEC
54,,SING,C2C,C3C,yes,N,54,,192033,367,HEC
55,,SING,C2C,CMC,no,N,55,,192033,367,HEC
56,,SING,C3C,C4C,yes,N,56,,192033,367,HEC
57,,DOUB,C3C,CAC,no,E,57,,192033,367,HEC
58,,SING,CMC,HMC1,no,N,58,,192033,367,HEC
59,,SING,CMC,HMC2,no,N,59,,192033,367,HEC
60,,SING,CMC,HMC3,no,N,60,,192033,367,HEC
61,,SING,CAC,CBC,no,N,61,,192033,367,HEC
62,,SING,CAC,HAC,no,N,62,,192033,367,HEC
63,,SING,CBC,HBC1,no,N,63,,192033,367,HEC
64,,SING,CBC,HBC2,no,N,64,,192033,367,HEC
65,,SING,CBC,HBC3,no,N,65,,192033,367,HEC
66,,SING,ND,C1D,yes,N,66,,192033,367,HEC
67,,SING,ND,C4D,yes,N,67,,192033,367,HEC
68,,DOUB,C1D,C2D,yes,N,68,,192033,367,HEC
69,,SING,C2D,C3D,yes,N,69,,192033,367,HEC
70,,SING,C2D,CMD,no,N,70,,192033,367,HEC
71,,DOUB,C3D,C4D,yes,N,71,,192033,367,HEC
72,,SING,C3D,CAD,no,N,72,,192033,367,HEC
73,,SING,CMD,HMD1,no,N,73,,192033,367,HEC
74,,SING,CMD,HMD2,no,N,74,,192033,367,HEC
75,,SING,CMD,HMD3,no,N,75,,192033,367,HEC
76,,SING,CAD,CBD,no,N,76,,192033,367,HEC
77,,SING,CAD,HAD1,no,N,77,,192033,367,HEC
78,,SING,CAD,HAD2,no,N,78,,192033,367,HEC
79,,SING,CBD,CGD,no,N,79,,192033,367,HEC
80,,SING,CBD,HBD1,no,N,80,,192033,367,HEC
81,,SING,CBD,HBD2,no,N,81,,192033,367,HEC
82,,DOUB,CGD,O1D,no,N,82,,192033,367,HEC
83,,SING,CGD,O2D,no,N,83,,192033,367,HEC
84,,SING,O2D,H2D,no,N,84,,192033,367,HEC
1,,SING,FE,NA,no,N,1,,192048,369,HEC
2,,SING,FE,NB,no,N,2,,192048,369,HEC
3,,SING,FE,NC,no,N,3,,192048,369,HEC
4,,SING,FE,ND,no,N,4,,192048,369,HEC
5,,DOUB,CHA,C1A,no,N,5,,192048,369,HEC
6,,SING,CHA,C4D,no,N,6,,192048,369,HEC
7,,SING,CHA,HHA,no,N,7,,192048,369,HEC
8,,DOUB,CHB,C4A,no,N,8,,192048,369,HEC
9,,SING,CHB,C1B,no,N,9,,192048,369,HEC
10,,SING,CHB,HHB,no,N,10,,192048,369,HEC
11,,DOUB,CHC,C4B,no,N,11,,192048,369,HEC
12,,SING,CHC,C1C,no,N,12,,192048,369,HEC
13,,SING,CHC,HHC,no,N,13,,192048,369,HEC
14,,DOUB,CHD,C4C,no,N,14,,192048,369,HEC
15,,SING,CHD,C1D,no,N,15,,192048,369,HEC
16,,SING,CHD,HHD,no,N,16,,192048,369,HEC
17,,SING,NA,C1A,yes,N,17,,192048,369,HEC
18,,SING,NA,C4A,yes,N,18,,192048,369,HEC
19,,SING,C1A,C2A,yes,N,19,,192048,369,HEC
20,,DOUB,C2A,C3A,yes,N,20,,192048,369,HEC
21,,SING,C2A,CAA,no,N,21,,192048,369,HEC
22,,SING,C3A,C4A,yes,N,22,,192048,369,HEC
23,,SING,C3A,CMA,no,N,23,,192048,369,HEC
24,,SING,CMA,HMA1,no,N,24,,192048,369,HEC
25,,SING,CMA,HMA2,no,N,25,,192048,369,HEC
26,,SING,CMA,HMA3,no,N,26,,192048,369,HEC
27,,SING,CAA,CBA,no,N,27,,192048,369,HEC
28,,SING,CAA,HAA1,no,N,28,,192048,369,HEC
29,,SING,CAA,HAA2,no,N,29,,192048,369,HEC
30,,SING,CBA,CGA,no,N,30,,192048,369,HEC
31,,SING,CBA,HBA1,no,N,31,,192048,369,HEC
32,,SING,CBA,HBA2,no,N,32,,192048,369,HEC
33,,DOUB,CGA,O1A,no,N,33,,192048,369,HEC
34,,SING,CGA,O2A,no,N,34,,192048,369,HEC
35,,SING,O2A,H2A,no,N,35,,192048,369,HEC
36,,SING,NB,C1B,yes,N,36,,192048,369,HEC
37,,SING,NB,C4B,yes,N,37,,192048,369,HEC
38,,DOUB,C1B,C2B,yes,N,38,,192048,369,HEC
39,,SING,C2B,C3B,yes,N,39,,192048,369,HEC
40,,SING,C2B,CMB,no,N,40,,192048,369,HEC
41,,SING,C3B,C4B,yes,N,41,,192048,369,HEC
42,,DOUB,C3B,CAB,no,E,42,,192048,369,HEC
43,,SING,CMB,HMB1,no,N,43,,192048,369,HEC
44,,SING,CMB,HMB2,no,N,44,,192048,369,HEC
45,,SING,CMB,HMB3,no,N,45,,192048,369,HEC
46,,SING,CAB,CBB,no,N,46,,192048,369,HEC
47,,SING,CAB,HAB,no,N,47,,192048,369,HEC
48,,SING,CBB,HBB1,no,N,48,,192048,369,HEC
49,,SING,CBB,HBB2,no,N,49,,192048,369,HEC
50,,SING,CBB,HBB3,no,N,50,,192048,369,HEC
51,,SING,NC,C1C,yes,N,51,,192048,369,HEC
52,,SING,NC,C4C,yes,N,52,,192048,369,HEC
53,,DOUB,C1C,C2C,yes,N,53,,192048,369,HEC
54,,SING,C2C,C3C,yes,N,54,,192048,369,HEC
55,,SING,C2C,CMC,no,N,55,,192048,369,HEC
56,,SING,C3C,C4C,yes,N,56,,192048,369,HEC
57,,DOUB,C3C,CAC,no,E,57,,192048,369,HEC
58,,SING,CMC,HMC1,no,N,58,,192048,369,HEC
59,,SING,CMC,HMC2,no,N,59,,192048,369,HEC
60,,SING,CMC,HMC3,no,N,60,,192048,369,HEC
61,,SING,CAC,CBC,no,N,61,,192048,369,HEC
62,,SING,CAC,HAC,no,N,62,,192048,369,HEC
63,,SING,CBC,HBC1,no,N,63,,192048,369,HEC
64,,SING,CBC,HBC2,no,N,64,,192048,369,HEC
65,,SING,CBC,HBC3,no,N,65,,192048,369,HEC
66,,SING,ND,C1D,yes,N,66,,192048,369,HEC
67,,SING,ND,C4D,yes,N,67,,192048,369,HEC
68,,DOUB,C1D,C2D,yes,N,68,,192048,369,HEC
69,,SING,C2D,C3D,yes,N,69,,192048,369,HEC
70,,SING,C2D,CMD,no,N,70,,192048,369,HEC
71,,DOUB,C3D,C4D,yes,N,71,,192048,369,HEC
72,,SING,C3D,CAD,no,N,72,,192048,369,HEC
73,,SING,CMD,HMD1,no,N,73,,192048,369,HEC
74,,SING,CMD,HMD2,no,N,74,,192048,369,HEC
75,,SING,CMD,HMD3,no,N,75,,192048,369,HEC
76,,SING,CAD,CBD,no,N,76,,192048,369,HEC
77,,SING,CAD,HAD1,no,N,77,,192048,369,HEC
78,,SING,CAD,HAD2,no,N,78,,192048,369,HEC
79,,SING,CBD,CGD,no,N,79,,192048,369,HEC
80,,SING,CBD,HBD1,no,N,80,,192048,369,HEC
81,,SING,CBD,HBD2,no,N,81,,192048,369,HEC
82,,DOUB,CGD,O1D,no,N,82,,192048,369,HEC
83,,SING,CGD,O2D,no,N,83,,192048,369,HEC
84,,SING,O2D,H2D,no,N,84,,192048,369,HEC
1,,DOUB,C,O,no,N,1,,192207,39,ACE
2,,SING,C,CH3,no,N,2,,192207,39,ACE
3,,SING,C,H,no,N,3,,192207,39,ACE
4,,SING,CH3,H1,no,N,4,,192207,39,ACE
5,,SING,CH3,H2,no,N,5,,192207,39,ACE
6,,SING,CH3,H3,no,N,6,,192207,39,ACE
1,,SING,C1A,C2A,no,N,1,,192221,390,SAC
2,,DOUB,C1A,OAC,no,N,2,,192221,390,SAC
3,,SING,C1A,N,no,N,3,,192221,390,SAC
4,,SING,C2A,H2A1,no,N,4,,192221,390,SAC
5,,SING,C2A,H2A2,no,N,5,,192221,390,SAC
6,,SING,C2A,H2A3,no,N,6,,192221,390,SAC
7,,SING,N,CA,no,N,7,,192221,390,SAC
8,,SING,N,H,no,N,8,,192221,390,SAC
9,,SING,CA,C,no,N,9,,192221,390,SAC
10,,SING,CA,CB,no,N,10,,192221,390,SAC
11,,SING,CA,HA,no,N,11,,192221,390,SAC
12,,DOUB,C,O,no,N,12,,192221,390,SAC
13,,SING,C,OXT,no,N,13,,192221,390,SAC
14,,SING,OXT,HXT,no,N,14,,192221,390,SAC
15,,SING,CB,OG,no,N,15,,192221,390,SAC
16,,SING,CB,HB2,no,N,16,,192221,390,SAC
17,,SING,CB,HB3,no,N,17,,192221,390,SAC
18,,SING,OG,HG,no,N,18,,192221,390,SAC
1,,DOUB,P,O1P,no,N,1,,192520,4027,TMP
2,,SING,P,O2P,no,N,2,,192520,4027,TMP
3,,SING,P,O3P,no,N,3,,192520,4027,TMP
4,,SING,P,O5',no,N,4,,192520,4027,TMP
5,,SING,O2P,HOP2,no,N,5,,192520,4027,TMP
6,,SING,O3P,HOP3,no,N,6,,192520,4027,TMP
7,,SING,O5',C5',no,N,7,,192520,4027,TMP
8,,SING,C5',C4',no,N,8,,192520,4027,TMP
9,,SING,C5',H5'1,no,N,9,,192520,4027,TMP
10,,SING,C5',H5'2,no,N,10,,192520,4027,TMP
11,,SING,C4',O4',no,N,11,,192520,4027,TMP
12,,SING,C4',C3',no,N,12,,192520,4027,TMP
13,,SING,C4',H4',no,N,13,,192520,4027,TMP
14,,SING,O4',C1',no,N,14,,192520,4027,TMP
15,,SING,C3',O3',no,N,15,,192520,4027,TMP
16,,SING,C3',C2',no,N,16,,192520,4027,TMP
17,,SING,C3',H3',no,N,17,,192520,4027,TMP
18,,SING,O3',HO3',no,N,18,,192520,4027,TMP
19,,SING,C2',C1',no,N,19,,192520,4027,TMP
20,,SING,C2',H2'1,no,N,20,,192520,4027,TMP
21,,SING,C2',H2'2,no,N,21,,192520,4027,TMP
22,,SING,C1',N1,no,N,22,,192520,4027,TMP
23,,SING,C1',H1',no,N,23,,192520,4027,TMP
24,,SING,N1,C2,no,N,24,,192520,4027,TMP
25,,SING,N1,C6,no,N,25,,192520,4027,TMP
26,,DOUB,C2,O2,no,N,26,,192520,4027,TMP
27,,SING,C2,N3,no,N,27,,192520,4027,TMP
28,,SING,N3,C4,no,N,28,,192520,4027,TMP
29,,SING,N3,HN3,no,N,29,,192520,4027,TMP
30,,DOUB,C4,O4,no,N,30,,192520,4027,TMP
31,,SING,C4,C5,no,N,31,,192520,4027,TMP
32,,SING,C5,C5M,no,N,32,,192520,4027,TMP
33,,DOUB,C5,C6,no,N,33,,192520,4027,TMP
34,,SING,C5M,H51,no,N,34,,192520,4027,TMP
35,,SING,C5M,H52,no,N,35,,192520,4027,TMP
36,,SING,C5M,H53,no,N,36,,192520,4027,TMP
37,,SING,C6,H6,no,N,37,,192520,4027,TMP
1,,DOUB,PA,O1A,no,N,1,,192521,4027,NDP
2,,SING,PA,O2A,no,N,2,,192521,4027,NDP
3,,SING,PA,O5B,no,N,3,,192521,4027,NDP
4,,SING,PA,O3,no,N,4,,192521,4027,NDP
5,,SING,O2A,HOA2,no,N,5,,192521,4027,NDP
6,,SING,O5B,C5B,no,N,6,,192521,4027,NDP
7,,SING,C5B,C4B,no,N,7,,192521,4027,NDP
8,,SING,C5B,H51A,no,N,8,,192521,4027,NDP
9,,SING,C5B,H52A,no,N,9,,192521,4027,NDP
10,,SING,C4B,O4B,no,N,10,,192521,4027,NDP
11,,SING,C4B,C3B,no,N,11,,192521,4027,NDP
12,,SING,C4B,H4B,no,N,12,,192521,4027,NDP
13,,SING,O4B,C1B,no,N,13,,192521,4027,NDP
14,,SING,C3B,O3B,no,N,14,,192521,4027,NDP
15,,SING,C3B,C2B,no,N,15,,192521,4027,NDP
16,,SING,C3B,H3B,no,N,16,,192521,4027,NDP
17,,SING,O3B,HO3A,no,N,17,,192521,4027,NDP
18,,SING,C2B,O2B,no,N,18,,192521,4027,NDP
19,,SING,C2B,C1B,no,N,19,,192521,4027,NDP
20,,SING,C2B,H2B,no,N,20,,192521,4027,NDP
21,,SING,O2B,P2B,no,N,21,,192521,4027,NDP
22,,SING,C1B,N9A,no,N,22,,192521,4027,NDP
23,,SING,C1B,H1B,no,N,23,,192521,4027,NDP
24,,SING,N9A,C8A,yes,N,24,,192521,4027,NDP
25,,SING,N9A,C4A,yes,N,25,,192521,4027,NDP
26,,DOUB,C8A,N7A,yes,N,26,,192521,4027,NDP
27,,SING,C8A,H8A,no,N,27,,192521,4027,NDP
28,,SING,N7A,C5A,yes,N,28,,192521,4027,NDP
29,,SING,C5A,C6A,yes,N,29,,192521,4027,NDP
30,,DOUB,C5A,C4A,yes,N,30,,192521,4027,NDP
31,,SING,C6A,N6A,no,N,31,,192521,4027,NDP
32,,DOUB,C6A,N1A,yes,N,32,,192521,4027,NDP
33,,SING,N6A,H61A,no,N,33,,192521,4027,NDP
34,,SING,N6A,H62A,no,N,34,,192521,4027,NDP
35,,SING,N1A,C2A,yes,N,35,,192521,4027,NDP
36,,DOUB,C2A,N3A,yes,N,36,,192521,4027,NDP
37,,SING,C2A,H2A,no,N,37,,192521,4027,NDP
38,,SING,N3A,C4A,yes,N,38,,192521,4027,NDP
39,,SING,O3,PN,no,N,39,,192521,4027,NDP
40,,DOUB,PN,O1N,no,N,40,,192521,4027,NDP
41,,SING,PN,O2N,no,N,41,,192521,4027,NDP
42,,SING,PN,O5D,no,N,42,,192521,4027,NDP
43,,SING,O2N,H21N,no,N,43,,192521,4027,NDP
44,,SING,O5D,C5D,no,N,44,,192521,4027,NDP
45,,SING,C5D,C4D,no,N,45,,192521,4027,NDP
46,,SING,C5D,H51N,no,N,46,,192521,4027,NDP
47,,SING,C5D,H52N,no,N,47,,192521,4027,NDP
48,,SING,C4D,O4D,no,N,48,,192521,4027,NDP
49,,SING,C4D,C3D,no,N,49,,192521,4027,NDP
50,,SING,C4D,H4D,no,N,50,,192521,4027,NDP
51,,SING,O4D,C1D,no,N,51,,192521,4027,NDP
52,,SING,C3D,O3D,no,N,52,,192521,4027,NDP
53,,SING,C3D,C2D,no,N,53,,192521,4027,NDP
54,,SING,C3D,H3D,no,N,54,,192521,4027,NDP
55,,SING,O3D,HO3N,no,N,55,,192521,4027,NDP
56,,SING,C2D,O2D,no,N,56,,192521,4027,NDP
57,,SING,C2D,C1D,no,N,57,,192521,4027,NDP
58,,SING,C2D,H2D,no,N,58,,192521,4027,NDP
59,,SING,O2D,HO2N,no,N,59,,192521,4027,NDP
60,,SING,C1D,N1N,no,N,60,,192521,4027,NDP
61,,SING,C1D,H1D,no,N,61,,192521,4027,NDP
62,,SING,N1N,C2N,no,N,62,,192521,4027,NDP
63,,SING,N1N,C6N,no,N,63,,192521,4027,NDP
64,,DOUB,C2N,C3N,no,N,64,,192521,4027,NDP
65,,SING,C2N,H2N,no,N,65,,192521,4027,NDP
66,,SING,C3N,C7N,no,N,66,,192521,4027,NDP
67,,SING,C3N,C4N,no,N,67,,192521,4027,NDP
68,,DOUB,C7N,O7N,no,N,68,,192521,4027,NDP
69,,SING,C7N,N7N,no,N,69,,192521,4027,NDP
70,,SING,N7N,H71N,no,N,70,,192521,4027,NDP
71,,SING,N7N,H72N,no,N,71,,192521,4027,NDP
72,,SING,C4N,C5N,no,N,72,,192521,4027,NDP
73,,SING,C4N,H41N,no,N,73,,192521,4027,NDP
74,,SING,C4N,H42N,no,N,74,,192521,4027,NDP
75,,DOUB,C5N,C6N,no,N,75,,192521,4027,NDP
76,,SING,C5N,H5N,no,N,76,,192521,4027,NDP
77,,SING,C6N,H6N,no,N,77,,192521,4027,NDP
78,,DOUB,P2B,O1X,no,N,78,,192521,4027,NDP
79,,SING,P2B,O2X,no,N,79,,192521,4027,NDP
80,,SING,P2B,O3X,no,N,80,,192521,4027,NDP
81,,SING,O2X,HOP2,no,N,81,,192521,4027,NDP
82,,SING,O3X,HOP3,no,N,82,,192521,4027,NDP
1,,DOUB,C1,O1,no,N,1,,192572,4030,MYR
2,,SING,C1,O2,no,N,2,,192572,4030,MYR
3,,SING,C1,C2,no,N,3,,192572,4030,MYR
4,,SING,O2,HO2,no,N,4,,192572,4030,MYR
5,,SING,C2,C3,no,N,5,,192572,4030,MYR
6,,SING,C2,H21,no,N,6,,192572,4030,MYR
7,,SING,C2,H22,no,N,7,,192572,4030,MYR
8,,SING,C3,C4,no,N,8,,192572,4030,MYR
9,,SING,C3,H31,no,N,9,,192572,4030,MYR
10,,SING,C3,H32,no,N,10,,192572,4030,MYR
11,,SING,C4,C5,no,N,11,,192572,4030,MYR
12,,SING,C4,H41,no,N,12,,192572,4030,MYR
13,,SING,C4,H42,no,N,13,,192572,4030,MYR
14,,SING,C5,C6,no,N,14,,192572,4030,MYR
15,,SING,C5,H51,no,N,15,,192572,4030,MYR
16,,SING,C5,H52,no,N,16,,192572,4030,MYR
17,,SING,C6,C7,no,N,17,,192572,4030,MYR
18,,SING,C6,H61,no,N,18,,192572,4030,MYR
19,,SING,C6,H62,no,N,19,,192572,4030,MYR
20,,SING,C7,C8,no,N,20,,192572,4030,MYR
21,,SING,C7,H71,no,N,21,,192572,4030,MYR
22,,SING,C7,H72,no,N,22,,192572,4030,MYR
23,,SING,C8,C9,no,N,23,,192572,4030,MYR
24,,SING,C8,H81,no,N,24,,192572,4030,MYR
25,,SING,C8,H82,no,N,25,,192572,4030,MYR
26,,SING,C9,C10,no,N,26,,192572,4030,MYR
27,,SING,C9,H91,no,N,27,,192572,4030,MYR
28,,SING,C9,H92,no,N,28,,192572,4030,MYR
29,,SING,C10,C11,no,N,29,,192572,4030,MYR
30,,SING,C10,H101,no,N,30,,192572,4030,MYR
31,,SING,C10,H102,no,N,31,,192572,4030,MYR
32,,SING,C11,C12,no,N,32,,192572,4030,MYR
33,,SING,C11,H111,no,N,33,,192572,4030,MYR
34,,SING,C11,H112,no,N,34,,192572,4030,MYR
35,,SING,C12,C13,no,N,35,,192572,4030,MYR
36,,SING,C12,H121,no,N,36,,192572,4030,MYR
37,,SING,C12,H122,no,N,37,,192572,4030,MYR
38,,SING,C13,C14,no,N,38,,192572,4030,MYR
39,,SING,C13,H131,no,N,39,,192572,4030,MYR
40,,SING,C13,H132,no,N,40,,192572,4030,MYR
41,,SING,C14,H141,no,N,41,,192572,4030,MYR
42,,SING,C14,H142,no,N,42,,192572,4030,MYR
43,,SING,C14,H143,no,N,43,,192572,4030,MYR
1,,SING,CHA,C1A,yes,N,1,,192689,4038,HEM
2,,DOUB,CHA,C4D,yes,N,2,,192689,4038,HEM
3,,SING,CHA,HHA,no,N,3,,192689,4038,HEM
4,,SING,CHB,C4A,yes,N,4,,192689,4038,HEM
5,,DOUB,CHB,C1B,yes,N,5,,192689,4038,HEM
6,,SING,CHB,HHB,no,N,6,,192689,4038,HEM
7,,SING,CHC,C4B,yes,N,7,,192689,4038,HEM
8,,DOUB,CHC,C1C,yes,N,8,,192689,4038,HEM
9,,SING,CHC,HHC,no,N,9,,192689,4038,HEM
10,,DOUB,CHD,C4C,yes,N,10,,192689,4038,HEM
11,,SING,CHD,C1D,yes,N,11,,192689,4038,HEM
12,,SING,CHD,HHD,no,N,12,,192689,4038,HEM
13,,DOUB,C1A,C2A,yes,N,13,,192689,4038,HEM
14,,SING,C1A,NA,yes,N,14,,192689,4038,HEM
15,,SING,C2A,C3A,yes,N,15,,192689,4038,HEM
16,,SING,C2A,CAA,no,N,16,,192689,4038,HEM
17,,DOUB,C3A,C4A,yes,N,17,,192689,4038,HEM
18,,SING,C3A,CMA,no,N,18,,192689,4038,HEM
19,,SING,C4A,NA,yes,N,19,,192689,4038,HEM
20,,SING,CMA,HMA,no,N,20,,192689,4038,HEM
21,,SING,CMA,HMAA,no,N,21,,192689,4038,HEM
22,,SING,CMA,HMAB,no,N,22,,192689,4038,HEM
23,,SING,CAA,CBA,no,N,23,,192689,4038,HEM
24,,SING,CAA,HAA,no,N,24,,192689,4038,HEM
25,,SING,CAA,HAAA,no,N,25,,192689,4038,HEM
26,,SING,CBA,CGA,no,N,26,,192689,4038,HEM
27,,SING,CBA,HBA,no,N,27,,192689,4038,HEM
28,,SING,CBA,HBAA,no,N,28,,192689,4038,HEM
29,,DOUB,CGA,O1A,no,N,29,,192689,4038,HEM
30,,SING,CGA,O2A,no,N,30,,192689,4038,HEM
31,,SING,C1B,C2B,no,N,31,,192689,4038,HEM
32,,SING,C1B,NB,yes,N,32,,192689,4038,HEM
33,,DOUB,C2B,C3B,yes,N,33,,192689,4038,HEM
34,,SING,C2B,CMB,yes,N,34,,192689,4038,HEM
35,,SING,C3B,C4B,no,N,35,,192689,4038,HEM
36,,SING,C3B,CAB,yes,N,36,,192689,4038,HEM
37,,DOUB,C4B,NB,no,N,37,,192689,4038,HEM
38,,SING,CMB,HMB,yes,N,38,,192689,4038,HEM
39,,SING,CMB,HMBA,no,N,39,,192689,4038,HEM
40,,SING,CMB,HMBB,no,N,40,,192689,4038,HEM
41,,DOUB,CAB,CBB,no,N,41,,192689,4038,HEM
42,,SING,CAB,HAB,no,N,42,,192689,4038,HEM
43,,SING,CBB,HBB,no,N,43,,192689,4038,HEM
44,,SING,CBB,HBBA,no,N,44,,192689,4038,HEM
45,,SING,C1C,C2C,no,N,45,,192689,4038,HEM
46,,SING,C1C,NC,yes,N,46,,192689,4038,HEM
47,,DOUB,C2C,C3C,yes,N,47,,192689,4038,HEM
48,,SING,C2C,CMC,yes,N,48,,192689,4038,HEM
49,,SING,C3C,C4C,no,N,49,,192689,4038,HEM
50,,SING,C3C,CAC,yes,N,50,,192689,4038,HEM
51,,SING,C4C,NC,no,N,51,,192689,4038,HEM
52,,SING,CMC,HMC,yes,N,52,,192689,4038,HEM
53,,SING,CMC,HMCA,no,N,53,,192689,4038,HEM
54,,SING,CMC,HMCB,no,N,54,,192689,4038,HEM
55,,DOUB,CAC,CBC,no,N,55,,192689,4038,HEM
56,,SING,CAC,HAC,no,N,56,,192689,4038,HEM
57,,SING,CBC,HBC,no,N,57,,192689,4038,HEM
58,,SING,CBC,HBCA,no,N,58,,192689,4038,HEM
59,,SING,C1D,C2D,no,N,59,,192689,4038,HEM
60,,DOUB,C1D,ND,yes,N,60,,192689,4038,HEM
61,,DOUB,C2D,C3D,yes,N,61,,192689,4038,HEM
62,,SING,C2D,CMD,yes,N,62,,192689,4038,HEM
63,,SING,C3D,C4D,no,N,63,,192689,4038,HEM
64,,SING,C3D,CAD,yes,N,64,,192689,4038,HEM
65,,SING,C4D,ND,no,N,65,,192689,4038,HEM
66,,SING,CMD,HMD,yes,N,66,,192689,4038,HEM
67,,SING,CMD,HMDA,no,N,67,,192689,4038,HEM
68,,SING,CMD,HMDB,no,N,68,,192689,4038,HEM
69,,SING,CAD,CBD,no,N,69,,192689,4038,HEM
70,,SING,CAD,HAD,no,N,70,,192689,4038,HEM
71,,SING,CAD,HADA,no,N,71,,192689,4038,HEM
72,,SING,CBD,CGD,no,N,72,,192689,4038,HEM
73,,SING,CBD,HBD,no,N,73,,192689,4038,HEM
74,,SING,CBD,HBDA,no,N,74,,192689,4038,HEM
75,,DOUB,CGD,O1D,no,N,75,,192689,4038,HEM
76,,SING,CGD,O2D,no,N,76,,192689,4038,HEM
77,,SING,O2A,H2A,no,N,77,,192689,4038,HEM
78,,SING,O2D,H2D,no,N,78,,192689,4038,HEM
79,,SING,FE,NA,no,N,79,,192689,4038,HEM
80,,SING,FE,NB,no,N,80,,192689,4038,HEM
81,,SING,FE,NC,no,N,81,,192689,4038,HEM
82,,SING,FE,ND,no,N,82,,192689,4038,HEM
1,,TRIP,C,O,no,N,1,,192690,4038,CMO
1,,SING,FE1,S2,no,N,1,,192748,4042,SF4
2,,SING,FE1,S3,no,N,2,,192748,4042,SF4
3,,SING,FE1,S4,no,N,3,,192748,4042,SF4
4,,SING,FE2,S1,no,N,4,,192748,4042,SF4
5,,SING,FE2,S3,no,N,5,,192748,4042,SF4
6,,SING,FE2,S4,no,N,6,,192748,4042,SF4
7,,SING,FE3,S1,no,N,7,,192748,4042,SF4
8,,SING,FE3,S2,no,N,8,,192748,4042,SF4
9,,SING,FE3,S4,no,N,9,,192748,4042,SF4
10,,SING,FE4,S1,no,N,10,,192748,4042,SF4
11,,SING,FE4,S2,no,N,11,,192748,4042,SF4
12,,SING,FE4,S3,no,N,12,,192748,4042,SF4
1,,SING,C1,C2,no,N,1,,192850,4049,FCB
2,,SING,C1,O1,no,N,2,,192850,4049,FCB
3,,SING,C1,O5,no,N,3,,192850,4049,FCB
4,,SING,C1,H1,no,N,4,,192850,4049,FCB
5,,SING,C2,C3,no,N,5,,192850,4049,FCB
6,,SING,C2,O2,no,N,6,,192850,4049,FCB
7,,SING,C2,H2,no,N,7,,192850,4049,FCB
8,,SING,C3,C4,no,N,8,,192850,4049,FCB
9,,SING,C3,O3,no,N,9,,192850,4049,FCB
10,,SING,C3,H3,no,N,10,,192850,4049,FCB
11,,SING,C4,C5,no,N,11,,192850,4049,FCB
12,,SING,C4,O4,no,N,12,,192850,4049,FCB
13,,SING,C4,H4,no,N,13,,192850,4049,FCB
14,,SING,C5,C6,no,N,14,,192850,4049,FCB
15,,SING,C5,O5,no,N,15,,192850,4049,FCB
16,,SING,C5,H5,no,N,16,,192850,4049,FCB
17,,SING,C6,H61,no,N,17,,192850,4049,FCB
18,,SING,C6,H62,no,N,18,,192850,4049,FCB
19,,SING,C6,H63,no,N,19,,192850,4049,FCB
20,,SING,O1,HO1,no,N,20,,192850,4049,FCB
21,,SING,O2,HO2,no,N,21,,192850,4049,FCB
22,,SING,O3,HO3,no,N,22,,192850,4049,FCB
23,,SING,O4,HO4,no,N,23,,192850,4049,FCB
1,,DOUB,P2,O4P,no,N,1,,192932,4053,THP
2,,SING,P2,O5P,no,N,2,,192932,4053,THP
3,,SING,P2,O6P,no,N,3,,192932,4053,THP
4,,SING,P2,O5',no,N,4,,192932,4053,THP
5,,SING,O5P,HOP5,no,N,5,,192932,4053,THP
6,,SING,O6P,HOP6,no,N,6,,192932,4053,THP
7,,DOUB,P1,O1P,no,N,7,,192932,4053,THP
8,,SING,P1,O2P,no,N,8,,192932,4053,THP
9,,SING,P1,O3P,no,N,9,,192932,4053,THP
10,,SING,P1,O3',no,N,10,,192932,4053,THP
11,,SING,O2P,HOP2,no,N,11,,192932,4053,THP
12,,SING,O3P,HOP3,no,N,12,,192932,4053,THP
13,,SING,O5',C5',no,N,13,,192932,4053,THP
14,,SING,C5',C4',no,N,14,,192932,4053,THP
15,,SING,C5',H5'1,no,N,15,,192932,4053,THP
16,,SING,C5',H5'2,no,N,16,,192932,4053,THP
17,,SING,C4',O4',no,N,17,,192932,4053,THP
18,,SING,C4',C3',no,N,18,,192932,4053,THP
19,,SING,C4',H4',no,N,19,,192932,4053,THP
20,,SING,O4',C1',no,N,20,,192932,4053,THP
21,,SING,C3',O3',no,N,21,,192932,4053,THP
22,,SING,C3',C2',no,N,22,,192932,4053,THP
23,,SING,C3',H3',no,N,23,,192932,4053,THP
24,,SING,C2',C1',no,N,24,,192932,4053,THP
25,,SING,C2',H2'1,no,N,25,,192932,4053,THP
26,,SING,C2',H2'2,no,N,26,,192932,4053,THP
27,,SING,C1',N1,no,N,27,,192932,4053,THP
28,,SING,C1',H1',no,N,28,,192932,4053,THP
29,,SING,N1,C2,no,N,29,,192932,4053,THP
30,,SING,N1,C6,no,N,30,,192932,4053,THP
31,,DOUB,C2,O2,no,N,31,,192932,4053,THP
32,,SING,C2,N3,no,N,32,,192932,4053,THP
33,,SING,N3,C4,no,N,33,,192932,4053,THP
34,,SING,N3,H3,no,N,34,,192932,4053,THP
35,,DOUB,C4,O4,no,N,35,,192932,4053,THP
36,,SING,C4,C5,no,N,36,,192932,4053,THP
37,,SING,C5,C5M,no,N,37,,192932,4053,THP
38,,DOUB,C5,C6,no,N,38,,192932,4053,THP
39,,SING,C5M,H51,no,N,39,,192932,4053,THP
40,,SING,C5M,H52,no,N,40,,192932,4053,THP
41,,SING,C5M,H53,no,N,41,,192932,4053,THP
42,,SING,C6,H6,no,N,42,,192932,4053,THP
1,,DOUB,S1,O1,no,N,1,,192982,4056,WW7
2,,DOUB,S1,O2,no,N,2,,192982,4056,WW7
3,,SING,S1,N1,no,N,3,,192982,4056,WW7
4,,SING,S1,C1,no,N,4,,192982,4056,WW7
5,,SING,N1,C11,no,N,5,,192982,4056,WW7
6,,SING,N1,HN1,no,N,6,,192982,4056,WW7
7,,DOUB,C4,C3,yes,N,7,,192982,4056,WW7
8,,SING,C4,C10,yes,N,8,,192982,4056,WW7
9,,SING,C4,H4,no,N,9,,192982,4056,WW7
10,,SING,C3,C2,yes,N,10,,192982,4056,WW7
11,,SING,C3,H3,no,N,11,,192982,4056,WW7
12,,DOUB,C2,C1,yes,N,12,,192982,4056,WW7
13,,SING,C2,H2,no,N,13,,192982,4056,WW7
14,,SING,C1,C9,yes,N,14,,192982,4056,WW7
15,,DOUB,C9,C10,yes,N,15,,192982,4056,WW7
16,,SING,C9,C8,yes,N,16,,192982,4056,WW7
17,,SING,C10,C5,yes,N,17,,192982,4056,WW7
18,,SING,CL1,C5,no,N,18,,192982,4056,WW7
19,,DOUB,C5,C6,yes,N,19,,192982,4056,WW7
20,,SING,C6,C7,yes,N,20,,192982,4056,WW7
21,,SING,C6,H6,no,N,21,,192982,4056,WW7
22,,DOUB,C7,C8,yes,N,22,,192982,4056,WW7
23,,SING,C7,H7,no,N,23,,192982,4056,WW7
24,,SING,C8,H8,no,N,24,,192982,4056,WW7
25,,SING,C11,C12,no,N,25,,192982,4056,WW7
26,,SING,C11,H111,no,N,26,,192982,4056,WW7
27,,SING,C11,H112,no,N,27,,192982,4056,WW7
28,,SING,C12,C13,no,N,28,,192982,4056,WW7
29,,SING,C12,H121,no,N,29,,192982,4056,WW7
30,,SING,C12,H122,no,N,30,,192982,4056,WW7
31,,SING,C14,C13,no,N,31,,192982,4056,WW7
32,,SING,C14,C15,no,N,32,,192982,4056,WW7
33,,SING,C14,H141,no,N,33,,192982,4056,WW7
34,,SING,C14,H142,no,N,34,,192982,4056,WW7
35,,SING,C13,H131,no,N,35,,192982,4056,WW7
36,,SING,C13,H132,no,N,36,,192982,4056,WW7
37,,SING,C15,C16,no,N,37,,192982,4056,WW7
38,,SING,C15,H151,no,N,38,,192982,4056,WW7
39,,SING,C15,H152,no,N,39,,192982,4056,WW7
40,,SING,C16,N2,no,N,40,,192982,4056,WW7
41,,SING,C16,H161,no,N,41,,192982,4056,WW7
42,,SING,C16,H162,no,N,42,,192982,4056,WW7
43,,SING,N2,HN21,no,N,43,,192982,4056,WW7
44,,SING,N2,HN22,no,N,44,,192982,4056,WW7
1,,SING,CHA,C1A,yes,N,1,,193052,4061,PP9
2,,DOUB,CHA,C4D,yes,Z,2,,193052,4061,PP9
3,,SING,CHA,HHA,no,N,3,,193052,4061,PP9
4,,SING,CHB,C4A,yes,N,4,,193052,4061,PP9
5,,DOUB,CHB,C1B,yes,Z,5,,193052,4061,PP9
6,,SING,CHB,HHB,no,N,6,,193052,4061,PP9
7,,SING,CHC,C4B,yes,N,7,,193052,4061,PP9
8,,DOUB,CHC,C1C,yes,Z,8,,193052,4061,PP9
9,,SING,CHC,HHC,no,N,9,,193052,4061,PP9
10,,DOUB,CHD,C4C,yes,Z,10,,193052,4061,PP9
11,,SING,CHD,C1D,yes,N,11,,193052,4061,PP9
12,,SING,CHD,HHD,no,N,12,,193052,4061,PP9
13,,SING,NA,C1A,yes,N,13,,193052,4061,PP9
14,,SING,NA,C4A,yes,N,14,,193052,4061,PP9
15,,SING,NA,HNA,no,N,15,,193052,4061,PP9
16,,DOUB,C1A,C2A,yes,N,16,,193052,4061,PP9
17,,SING,C2A,C3A,yes,N,17,,193052,4061,PP9
18,,SING,C2A,CAA,no,N,18,,193052,4061,PP9
19,,DOUB,C3A,C4A,yes,N,19,,193052,4061,PP9
20,,SING,C3A,CMA,no,N,20,,193052,4061,PP9
21,,SING,CMA,HMA1,no,N,21,,193052,4061,PP9
22,,SING,CMA,HMA2,no,N,22,,193052,4061,PP9
23,,SING,CMA,HMA3,no,N,23,,193052,4061,PP9
24,,SING,CAA,CBA,no,N,24,,193052,4061,PP9
25,,SING,CAA,HAA1,no,N,25,,193052,4061,PP9
26,,SING,CAA,HAA2,no,N,26,,193052,4061,PP9
27,,SING,CBA,CGA,no,N,27,,193052,4061,PP9
28,,SING,CBA,HBA1,no,N,28,,193052,4061,PP9
29,,SING,CBA,HBA2,no,N,29,,193052,4061,PP9
30,,DOUB,CGA,O1A,no,N,30,,193052,4061,PP9
31,,SING,CGA,O2A,no,N,31,,193052,4061,PP9
32,,SING,O2A,H2A,no,N,32,,193052,4061,PP9
33,,SING,NB,C1B,yes,N,33,,193052,4061,PP9
34,,DOUB,NB,C4B,yes,N,34,,193052,4061,PP9
35,,SING,C1B,C2B,no,N,35,,193052,4061,PP9
36,,DOUB,C2B,C3B,no,N,36,,193052,4061,PP9
37,,SING,C2B,CMB,no,N,37,,193052,4061,PP9
38,,SING,C3B,C4B,no,N,38,,193052,4061,PP9
39,,SING,C3B,CAB,no,N,39,,193052,4061,PP9
40,,SING,CMB,HMB1,no,N,40,,193052,4061,PP9
41,,SING,CMB,HMB2,no,N,41,,193052,4061,PP9
42,,SING,CMB,HMB3,no,N,42,,193052,4061,PP9
43,,DOUB,CAB,CBB,no,N,43,,193052,4061,PP9
44,,SING,CAB,HAB,no,N,44,,193052,4061,PP9
45,,SING,CBB,HBB1,no,N,45,,193052,4061,PP9
46,,SING,CBB,HBB2,no,N,46,,193052,4061,PP9
47,,SING,NC,C1C,yes,N,47,,193052,4061,PP9
48,,SING,NC,C4C,yes,N,48,,193052,4061,PP9
49,,SING,NC,HNC,no,N,49,,193052,4061,PP9
50,,SING,C1C,C2C,yes,N,50,,193052,4061,PP9
51,,DOUB,C2C,C3C,yes,N,51,,193052,4061,PP9
52,,SING,C2C,CMC,no,N,52,,193052,4061,PP9
53,,SING,C3C,C4C,yes,N,53,,193052,4061,PP9
54,,SING,C3C,CAC,no,N,54,,193052,4061,PP9
55,,SING,CMC,HMC1,no,N,55,,193052,4061,PP9
56,,SING,CMC,HMC2,no,N,56,,193052,4061,PP9
57,,SING,CMC,HMC3,no,N,57,,193052,4061,PP9
58,,DOUB,CAC,CBC,no,N,58,,193052,4061,PP9
59,,SING,CAC,HAC,no,N,59,,193052,4061,PP9
60,,SING,CBC,HBC1,no,N,60,,193052,4061,PP9
61,,SING,CBC,HBC2,no,N,61,,193052,4061,PP9
62,,DOUB,ND,C1D,yes,N,62,,193052,4061,PP9
63,,SING,ND,C4D,yes,N,63,,193052,4061,PP9
64,,SING,C1D,C2D,no,N,64,,193052,4061,PP9
65,,DOUB,C2D,C3D,no,N,65,,193052,4061,PP9
66,,SING,C2D,CMD,no,N,66,,193052,4061,PP9
67,,SING,C3D,C4D,no,N,67,,193052,4061,PP9
68,,SING,C3D,CAD,no,N,68,,193052,4061,PP9
69,,SING,CMD,HMD1,no,N,69,,193052,4061,PP9
70,,SING,CMD,HMD2,no,N,70,,193052,4061,PP9
71,,SING,CMD,HMD3,no,N,71,,193052,4061,PP9
72,,SING,CAD,CBD,no,N,72,,193052,4061,PP9
73,,SING,CAD,HAD1,no,N,73,,193052,4061,PP9
74,,SING,CAD,HAD2,no,N,74,,193052,4061,PP9
75,,SING,CBD,CGD,no,N,75,,193052,4061,PP9
76,,SING,CBD,HBD1,no,N,76,,193052,4061,PP9
77,,SING,CBD,HBD2,no,N,77,,193052,4061,PP9
78,,DOUB,CGD,O1D,no,N,78,,193052,4061,PP9
79,,SING,CGD,O2D,no,N,79,,193052,4061,PP9
80,,SING,O2D,H2D,no,N,80,,193052,4061,PP9
1,,TRIP,C,O,no,N,1,,193053,4061,CMO
1,,SING,CHA,C1A,yes,N,1,,193071,4062,PP9
2,,DOUB,CHA,C4D,yes,Z,2,,193071,4062,PP9
3,,SING,CHA,HHA,no,N,3,,193071,4062,PP9
4,,SING,CHB,C4A,yes,N,4,,193071,4062,PP9
5,,DOUB,CHB,C1B,yes,Z,5,,193071,4062,PP9
6,,SING,CHB,HHB,no,N,6,,193071,4062,PP9
7,,SING,CHC,C4B,yes,N,7,,193071,4062,PP9
8,,DOUB,CHC,C1C,yes,Z,8,,193071,4062,PP9
9,,SING,CHC,HHC,no,N,9,,193071,4062,PP9
10,,DOUB,CHD,C4C,yes,Z,10,,193071,4062,PP9
11,,SING,CHD,C1D,yes,N,11,,193071,4062,PP9
12,,SING,CHD,HHD,no,N,12,,193071,4062,PP9
13,,SING,NA,C1A,yes,N,13,,193071,4062,PP9
14,,SING,NA,C4A,yes,N,14,,193071,4062,PP9
15,,SING,NA,HNA,no,N,15,,193071,4062,PP9
16,,DOUB,C1A,C2A,yes,N,16,,193071,4062,PP9
17,,SING,C2A,C3A,yes,N,17,,193071,4062,PP9
18,,SING,C2A,CAA,no,N,18,,193071,4062,PP9
19,,DOUB,C3A,C4A,yes,N,19,,193071,4062,PP9
20,,SING,C3A,CMA,no,N,20,,193071,4062,PP9
21,,SING,CMA,HMA1,no,N,21,,193071,4062,PP9
22,,SING,CMA,HMA2,no,N,22,,193071,4062,PP9
23,,SING,CMA,HMA3,no,N,23,,193071,4062,PP9
24,,SING,CAA,CBA,no,N,24,,193071,4062,PP9
25,,SING,CAA,HAA1,no,N,25,,193071,4062,PP9
26,,SING,CAA,HAA2,no,N,26,,193071,4062,PP9
27,,SING,CBA,CGA,no,N,27,,193071,4062,PP9
28,,SING,CBA,HBA1,no,N,28,,193071,4062,PP9
29,,SING,CBA,HBA2,no,N,29,,193071,4062,PP9
30,,DOUB,CGA,O1A,no,N,30,,193071,4062,PP9
31,,SING,CGA,O2A,no,N,31,,193071,4062,PP9
32,,SING,O2A,H2A,no,N,32,,193071,4062,PP9
33,,SING,NB,C1B,yes,N,33,,193071,4062,PP9
34,,DOUB,NB,C4B,yes,N,34,,193071,4062,PP9
35,,SING,C1B,C2B,no,N,35,,193071,4062,PP9
36,,DOUB,C2B,C3B,no,N,36,,193071,4062,PP9
37,,SING,C2B,CMB,no,N,37,,193071,4062,PP9
38,,SING,C3B,C4B,no,N,38,,193071,4062,PP9
39,,SING,C3B,CAB,no,N,39,,193071,4062,PP9
40,,SING,CMB,HMB1,no,N,40,,193071,4062,PP9
41,,SING,CMB,HMB2,no,N,41,,193071,4062,PP9
42,,SING,CMB,HMB3,no,N,42,,193071,4062,PP9
43,,DOUB,CAB,CBB,no,N,43,,193071,4062,PP9
44,,SING,CAB,HAB,no,N,44,,193071,4062,PP9
45,,SING,CBB,HBB1,no,N,45,,193071,4062,PP9
46,,SING,CBB,HBB2,no,N,46,,193071,4062,PP9
47,,SING,NC,C1C,yes,N,47,,193071,4062,PP9
48,,SING,NC,C4C,yes,N,48,,193071,4062,PP9
49,,SING,NC,HNC,no,N,49,,193071,4062,PP9
50,,SING,C1C,C2C,yes,N,50,,193071,4062,PP9
51,,DOUB,C2C,C3C,yes,N,51,,193071,4062,PP9
52,,SING,C2C,CMC,no,N,52,,193071,4062,PP9
53,,SING,C3C,C4C,yes,N,53,,193071,4062,PP9
54,,SING,C3C,CAC,no,N,54,,193071,4062,PP9
55,,SING,CMC,HMC1,no,N,55,,193071,4062,PP9
56,,SING,CMC,HMC2,no,N,56,,193071,4062,PP9
57,,SING,CMC,HMC3,no,N,57,,193071,4062,PP9
58,,DOUB,CAC,CBC,no,N,58,,193071,4062,PP9
59,,SING,CAC,HAC,no,N,59,,193071,4062,PP9
60,,SING,CBC,HBC1,no,N,60,,193071,4062,PP9
61,,SING,CBC,HBC2,no,N,61,,193071,4062,PP9
62,,DOUB,ND,C1D,yes,N,62,,193071,4062,PP9
63,,SING,ND,C4D,yes,N,63,,193071,4062,PP9
64,,SING,C1D,C2D,no,N,64,,193071,4062,PP9
65,,DOUB,C2D,C3D,no,N,65,,193071,4062,PP9
66,,SING,C2D,CMD,no,N,66,,193071,4062,PP9
67,,SING,C3D,C4D,no,N,67,,193071,4062,PP9
68,,SING,C3D,CAD,no,N,68,,193071,4062,PP9
69,,SING,CMD,HMD1,no,N,69,,193071,4062,PP9
70,,SING,CMD,HMD2,no,N,70,,193071,4062,PP9
71,,SING,CMD,HMD3,no,N,71,,193071,4062,PP9
72,,SING,CAD,CBD,no,N,72,,193071,4062,PP9
73,,SING,CAD,HAD1,no,N,73,,193071,4062,PP9
74,,SING,CAD,HAD2,no,N,74,,193071,4062,PP9
75,,SING,CBD,CGD,no,N,75,,193071,4062,PP9
76,,SING,CBD,HBD1,no,N,76,,193071,4062,PP9
77,,SING,CBD,HBD2,no,N,77,,193071,4062,PP9
78,,DOUB,CGD,O1D,no,N,78,,193071,4062,PP9
79,,SING,CGD,O2D,no,N,79,,193071,4062,PP9
80,,SING,O2D,H2D,no,N,80,,193071,4062,PP9
1,,TRIP,C,O,no,N,1,,193072,4062,CMO
1,,SING,N,CA,no,N,1,,193147,4067,PCA
2,,SING,N,CD,no,N,2,,193147,4067,PCA
3,,SING,N,H,no,N,3,,193147,4067,PCA
4,,SING,CA,CB,no,N,4,,193147,4067,PCA
5,,SING,CA,C,no,N,5,,193147,4067,PCA
6,,SING,CA,HA,no,N,6,,193147,4067,PCA
7,,SING,CB,CG,no,N,7,,193147,4067,PCA
8,,SING,CB,HB2,no,N,8,,193147,4067,PCA
9,,SING,CB,HB3,no,N,9,,193147,4067,PCA
10,,SING,CG,CD,no,N,10,,193147,4067,PCA
11,,SING,CG,HG2,no,N,11,,193147,4067,PCA
12,,SING,CG,HG3,no,N,12,,193147,4067,PCA
13,,DOUB,CD,OE,no,N,13,,193147,4067,PCA
14,,DOUB,C,O,no,N,14,,193147,4067,PCA
15,,SING,C,OXT,no,N,15,,193147,4067,PCA
16,,SING,OXT,HXT,no,N,16,,193147,4067,PCA
1,,SING,P,O1P,no,N,1,,193204,407,PGA
2,,DOUB,P,O2P,no,N,2,,193204,407,PGA
3,,SING,P,O3P,no,N,3,,193204,407,PGA
4,,SING,P,O4P,no,N,4,,193204,407,PGA
5,,SING,O1P,C2,no,N,5,,193204,407,PGA
6,,SING,O3P,HOP3,no,N,6,,193204,407,PGA
7,,SING,O4P,HOP4,no,N,7,,193204,407,PGA
8,,SING,C2,C1,no,N,8,,193204,407,PGA
9,,SING,C2,H21,no,N,9,,193204,407,PGA
10,,SING,C2,H22,no,N,10,,193204,407,PGA
11,,DOUB,C1,O1,no,N,11,,193204,407,PGA
12,,SING,C1,O2,no,N,12,,193204,407,PGA
13,,SING,O2,HO2,no,N,13,,193204,407,PGA
1,,SING,N,HN1,no,N,1,,193205,407,NH2
2,,SING,N,HN2,no,N,2,,193205,407,NH2
1,,SING,N,CA,no,N,1,,193235,4071,PCA
2,,SING,N,CD,no,N,2,,193235,4071,PCA
3,,SING,N,H,no,N,3,,193235,4071,PCA
4,,SING,CA,CB,no,N,4,,193235,4071,PCA
5,,SING,CA,C,no,N,5,,193235,4071,PCA
6,,SING,CA,HA,no,N,6,,193235,4071,PCA
7,,SING,CB,CG,no,N,7,,193235,4071,PCA
8,,SING,CB,HB2,no,N,8,,193235,4071,PCA
9,,SING,CB,HB3,no,N,9,,193235,4071,PCA
10,,SING,CG,CD,no,N,10,,193235,4071,PCA
11,,SING,CG,HG2,no,N,11,,193235,4071,PCA
12,,SING,CG,HG3,no,N,12,,193235,4071,PCA
13,,DOUB,CD,OE,no,N,13,,193235,4071,PCA
14,,DOUB,C,O,no,N,14,,193235,4071,PCA
15,,SING,C,OXT,no,N,15,,193235,4071,PCA
16,,SING,OXT,HXT,no,N,16,,193235,4071,PCA
1,,SING,N,CA,no,N,1,,193368,408,HIA
2,,SING,N,H,no,N,2,,193368,408,HIA
3,,SING,N,H2,no,N,3,,193368,408,HIA
4,,SING,CA,CB,no,N,4,,193368,408,HIA
5,,SING,CA,C,no,N,5,,193368,408,HIA
6,,SING,CA,HA,no,N,6,,193368,408,HIA
7,,SING,CB,CG,no,N,7,,193368,408,HIA
8,,SING,CB,HB2,no,N,8,,193368,408,HIA
9,,SING,CB,HB3,no,N,9,,193368,408,HIA
10,,SING,CG,ND1,yes,N,10,,193368,408,HIA
11,,DOUB,CG,CD2,yes,N,11,,193368,408,HIA
12,,SING,ND1,CE1,yes,N,12,,193368,408,HIA
13,,SING,ND1,HD1,no,N,13,,193368,408,HIA
14,,SING,CD2,NE2,yes,N,14,,193368,408,HIA
15,,SING,CD2,HD2,no,N,15,,193368,408,HIA
16,,DOUB,CE1,NE2,yes,N,16,,193368,408,HIA
17,,SING,CE1,HE1,no,N,17,,193368,408,HIA
18,,DOUB,C,O,no,N,18,,193368,408,HIA
19,,SING,C,NXT,no,N,19,,193368,408,HIA
20,,SING,NXT,HXT1,no,N,20,,193368,408,HIA
21,,SING,NXT,HXT2,no,N,21,,193368,408,HIA
1,,SING,N,HN1,no,N,1,,193511,4088,NH2
2,,SING,N,HN2,no,N,2,,193511,4088,NH2
1,,DOUB,C,O,no,N,1,,193675,4099,ACE
2,,SING,C,CH3,no,N,2,,193675,4099,ACE
3,,SING,C,H,no,N,3,,193675,4099,ACE
4,,SING,CH3,H1,no,N,4,,193675,4099,ACE
5,,SING,CH3,H2,no,N,5,,193675,4099,ACE
6,,SING,CH3,H3,no,N,6,,193675,4099,ACE
1,,SING,N,HN1,no,N,1,,193676,4099,NH2
2,,SING,N,HN2,no,N,2,,193676,4099,NH2
1,,SING,C1A,C2A,no,N,1,,194185,4129,SAC
2,,DOUB,C1A,OAC,no,N,2,,194185,4129,SAC
3,,SING,C1A,N,no,N,3,,194185,4129,SAC
4,,SING,C2A,H2A1,no,N,4,,194185,4129,SAC
5,,SING,C2A,H2A2,no,N,5,,194185,4129,SAC
6,,SING,C2A,H2A3,no,N,6,,194185,4129,SAC
7,,SING,N,CA,no,N,7,,194185,4129,SAC
8,,SING,N,H,no,N,8,,194185,4129,SAC
9,,SING,CA,C,no,N,9,,194185,4129,SAC
10,,SING,CA,CB,no,N,10,,194185,4129,SAC
11,,SING,CA,HA,no,N,11,,194185,4129,SAC
12,,DOUB,C,O,no,N,12,,194185,4129,SAC
13,,SING,C,OXT,no,N,13,,194185,4129,SAC
14,,SING,OXT,HXT,no,N,14,,194185,4129,SAC
15,,SING,CB,OG,no,N,15,,194185,4129,SAC
16,,SING,CB,HB2,no,N,16,,194185,4129,SAC
17,,SING,CB,HB3,no,N,17,,194185,4129,SAC
18,,SING,OG,HG,no,N,18,,194185,4129,SAC
1,,SING,FE,NA,no,N,1,,194218,4130,HEC
2,,SING,FE,NB,no,N,2,,194218,4130,HEC
3,,SING,FE,NC,no,N,3,,194218,4130,HEC
4,,SING,FE,ND,no,N,4,,194218,4130,HEC
5,,DOUB,CHA,C1A,no,N,5,,194218,4130,HEC
6,,SING,CHA,C4D,no,N,6,,194218,4130,HEC
7,,SING,CHA,HHA,no,N,7,,194218,4130,HEC
8,,DOUB,CHB,C4A,no,N,8,,194218,4130,HEC
9,,SING,CHB,C1B,no,N,9,,194218,4130,HEC
10,,SING,CHB,HHB,no,N,10,,194218,4130,HEC
11,,DOUB,CHC,C4B,no,N,11,,194218,4130,HEC
12,,SING,CHC,C1C,no,N,12,,194218,4130,HEC
13,,SING,CHC,HHC,no,N,13,,194218,4130,HEC
14,,DOUB,CHD,C4C,no,N,14,,194218,4130,HEC
15,,SING,CHD,C1D,no,N,15,,194218,4130,HEC
16,,SING,CHD,HHD,no,N,16,,194218,4130,HEC
17,,SING,NA,C1A,yes,N,17,,194218,4130,HEC
18,,SING,NA,C4A,yes,N,18,,194218,4130,HEC
19,,SING,C1A,C2A,yes,N,19,,194218,4130,HEC
20,,DOUB,C2A,C3A,yes,N,20,,194218,4130,HEC
21,,SING,C2A,CAA,no,N,21,,194218,4130,HEC
22,,SING,C3A,C4A,yes,N,22,,194218,4130,HEC
23,,SING,C3A,CMA,no,N,23,,194218,4130,HEC
24,,SING,CMA,HMA1,no,N,24,,194218,4130,HEC
25,,SING,CMA,HMA2,no,N,25,,194218,4130,HEC
26,,SING,CMA,HMA3,no,N,26,,194218,4130,HEC
27,,SING,CAA,CBA,no,N,27,,194218,4130,HEC
28,,SING,CAA,HAA1,no,N,28,,194218,4130,HEC
29,,SING,CAA,HAA2,no,N,29,,194218,4130,HEC
30,,SING,CBA,CGA,no,N,30,,194218,4130,HEC
31,,SING,CBA,HBA1,no,N,31,,194218,4130,HEC
32,,SING,CBA,HBA2,no,N,32,,194218,4130,HEC
33,,DOUB,CGA,O1A,no,N,33,,194218,4130,HEC
34,,SING,CGA,O2A,no,N,34,,194218,4130,HEC
35,,SING,O2A,H2A,no,N,35,,194218,4130,HEC
36,,SING,NB,C1B,yes,N,36,,194218,4130,HEC
37,,SING,NB,C4B,yes,N,37,,194218,4130,HEC
38,,DOUB,C1B,C2B,yes,N,38,,194218,4130,HEC
39,,SING,C2B,C3B,yes,N,39,,194218,4130,HEC
40,,SING,C2B,CMB,no,N,40,,194218,4130,HEC
41,,SING,C3B,C4B,yes,N,41,,194218,4130,HEC
42,,DOUB,C3B,CAB,no,E,42,,194218,4130,HEC
43,,SING,CMB,HMB1,no,N,43,,194218,4130,HEC
44,,SING,CMB,HMB2,no,N,44,,194218,4130,HEC
45,,SING,CMB,HMB3,no,N,45,,194218,4130,HEC
46,,SING,CAB,CBB,no,N,46,,194218,4130,HEC
47,,SING,CAB,HAB,no,N,47,,194218,4130,HEC
48,,SING,CBB,HBB1,no,N,48,,194218,4130,HEC
49,,SING,CBB,HBB2,no,N,49,,194218,4130,HEC
50,,SING,CBB,HBB3,no,N,50,,194218,4130,HEC
51,,SING,NC,C1C,yes,N,51,,194218,4130,HEC
52,,SING,NC,C4C,yes,N,52,,194218,4130,HEC
53,,DOUB,C1C,C2C,yes,N,53,,194218,4130,HEC
54,,SING,C2C,C3C,yes,N,54,,194218,4130,HEC
55,,SING,C2C,CMC,no,N,55,,194218,4130,HEC
56,,SING,C3C,C4C,yes,N,56,,194218,4130,HEC
57,,DOUB,C3C,CAC,no,E,57,,194218,4130,HEC
58,,SING,CMC,HMC1,no,N,58,,194218,4130,HEC
59,,SING,CMC,HMC2,no,N,59,,194218,4130,HEC
60,,SING,CMC,HMC3,no,N,60,,194218,4130,HEC
61,,SING,CAC,CBC,no,N,61,,194218,4130,HEC
62,,SING,CAC,HAC,no,N,62,,194218,4130,HEC
63,,SING,CBC,HBC1,no,N,63,,194218,4130,HEC
64,,SING,CBC,HBC2,no,N,64,,194218,4130,HEC
65,,SING,CBC,HBC3,no,N,65,,194218,4130,HEC
66,,SING,ND,C1D,yes,N,66,,194218,4130,HEC
67,,SING,ND,C4D,yes,N,67,,194218,4130,HEC
68,,DOUB,C1D,C2D,yes,N,68,,194218,4130,HEC
69,,SING,C2D,C3D,yes,N,69,,194218,4130,HEC
70,,SING,C2D,CMD,no,N,70,,194218,4130,HEC
71,,DOUB,C3D,C4D,yes,N,71,,194218,4130,HEC
72,,SING,C3D,CAD,no,N,72,,194218,4130,HEC
73,,SING,CMD,HMD1,no,N,73,,194218,4130,HEC
74,,SING,CMD,HMD2,no,N,74,,194218,4130,HEC
75,,SING,CMD,HMD3,no,N,75,,194218,4130,HEC
76,,SING,CAD,CBD,no,N,76,,194218,4130,HEC
77,,SING,CAD,HAD1,no,N,77,,194218,4130,HEC
78,,SING,CAD,HAD2,no,N,78,,194218,4130,HEC
79,,SING,CBD,CGD,no,N,79,,194218,4130,HEC
80,,SING,CBD,HBD1,no,N,80,,194218,4130,HEC
81,,SING,CBD,HBD2,no,N,81,,194218,4130,HEC
82,,DOUB,CGD,O1D,no,N,82,,194218,4130,HEC
83,,SING,CGD,O2D,no,N,83,,194218,4130,HEC
84,,SING,O2D,H2D,no,N,84,,194218,4130,HEC
1,,SING,FE,NA,no,N,1,,194234,4131,HEC
2,,SING,FE,NB,no,N,2,,194234,4131,HEC
3,,SING,FE,NC,no,N,3,,194234,4131,HEC
4,,SING,FE,ND,no,N,4,,194234,4131,HEC
5,,DOUB,CHA,C1A,no,N,5,,194234,4131,HEC
6,,SING,CHA,C4D,no,N,6,,194234,4131,HEC
7,,SING,CHA,HHA,no,N,7,,194234,4131,HEC
8,,DOUB,CHB,C4A,no,N,8,,194234,4131,HEC
9,,SING,CHB,C1B,no,N,9,,194234,4131,HEC
10,,SING,CHB,HHB,no,N,10,,194234,4131,HEC
11,,DOUB,CHC,C4B,no,N,11,,194234,4131,HEC
12,,SING,CHC,C1C,no,N,12,,194234,4131,HEC
13,,SING,CHC,HHC,no,N,13,,194234,4131,HEC
14,,DOUB,CHD,C4C,no,N,14,,194234,4131,HEC
15,,SING,CHD,C1D,no,N,15,,194234,4131,HEC
16,,SING,CHD,HHD,no,N,16,,194234,4131,HEC
17,,SING,NA,C1A,yes,N,17,,194234,4131,HEC
18,,SING,NA,C4A,yes,N,18,,194234,4131,HEC
19,,SING,C1A,C2A,yes,N,19,,194234,4131,HEC
20,,DOUB,C2A,C3A,yes,N,20,,194234,4131,HEC
21,,SING,C2A,CAA,no,N,21,,194234,4131,HEC
22,,SING,C3A,C4A,yes,N,22,,194234,4131,HEC
23,,SING,C3A,CMA,no,N,23,,194234,4131,HEC
24,,SING,CMA,HMA1,no,N,24,,194234,4131,HEC
25,,SING,CMA,HMA2,no,N,25,,194234,4131,HEC
26,,SING,CMA,HMA3,no,N,26,,194234,4131,HEC
27,,SING,CAA,CBA,no,N,27,,194234,4131,HEC
28,,SING,CAA,HAA1,no,N,28,,194234,4131,HEC
29,,SING,CAA,HAA2,no,N,29,,194234,4131,HEC
30,,SING,CBA,CGA,no,N,30,,194234,4131,HEC
31,,SING,CBA,HBA1,no,N,31,,194234,4131,HEC
32,,SING,CBA,HBA2,no,N,32,,194234,4131,HEC
33,,DOUB,CGA,O1A,no,N,33,,194234,4131,HEC
34,,SING,CGA,O2A,no,N,34,,194234,4131,HEC
35,,SING,O2A,H2A,no,N,35,,194234,4131,HEC
36,,SING,NB,C1B,yes,N,36,,194234,4131,HEC
37,,SING,NB,C4B,yes,N,37,,194234,4131,HEC
38,,DOUB,C1B,C2B,yes,N,38,,194234,4131,HEC
39,,SING,C2B,C3B,yes,N,39,,194234,4131,HEC
40,,SING,C2B,CMB,no,N,40,,194234,4131,HEC
41,,SING,C3B,C4B,yes,N,41,,194234,4131,HEC
42,,DOUB,C3B,CAB,no,E,42,,194234,4131,HEC
43,,SING,CMB,HMB1,no,N,43,,194234,4131,HEC
44,,SING,CMB,HMB2,no,N,44,,194234,4131,HEC
45,,SING,CMB,HMB3,no,N,45,,194234,4131,HEC
46,,SING,CAB,CBB,no,N,46,,194234,4131,HEC
47,,SING,CAB,HAB,no,N,47,,194234,4131,HEC
48,,SING,CBB,HBB1,no,N,48,,194234,4131,HEC
49,,SING,CBB,HBB2,no,N,49,,194234,4131,HEC
50,,SING,CBB,HBB3,no,N,50,,194234,4131,HEC
51,,SING,NC,C1C,yes,N,51,,194234,4131,HEC
52,,SING,NC,C4C,yes,N,52,,194234,4131,HEC
53,,DOUB,C1C,C2C,yes,N,53,,194234,4131,HEC
54,,SING,C2C,C3C,yes,N,54,,194234,4131,HEC
55,,SING,C2C,CMC,no,N,55,,194234,4131,HEC
56,,SING,C3C,C4C,yes,N,56,,194234,4131,HEC
57,,DOUB,C3C,CAC,no,E,57,,194234,4131,HEC
58,,SING,CMC,HMC1,no,N,58,,194234,4131,HEC
59,,SING,CMC,HMC2,no,N,59,,194234,4131,HEC
60,,SING,CMC,HMC3,no,N,60,,194234,4131,HEC
61,,SING,CAC,CBC,no,N,61,,194234,4131,HEC
62,,SING,CAC,HAC,no,N,62,,194234,4131,HEC
63,,SING,CBC,HBC1,no,N,63,,194234,4131,HEC
64,,SING,CBC,HBC2,no,N,64,,194234,4131,HEC
65,,SING,CBC,HBC3,no,N,65,,194234,4131,HEC
66,,SING,ND,C1D,yes,N,66,,194234,4131,HEC
67,,SING,ND,C4D,yes,N,67,,194234,4131,HEC
68,,DOUB,C1D,C2D,yes,N,68,,194234,4131,HEC
69,,SING,C2D,C3D,yes,N,69,,194234,4131,HEC
70,,SING,C2D,CMD,no,N,70,,194234,4131,HEC
71,,DOUB,C3D,C4D,yes,N,71,,194234,4131,HEC
72,,SING,C3D,CAD,no,N,72,,194234,4131,HEC
73,,SING,CMD,HMD1,no,N,73,,194234,4131,HEC
74,,SING,CMD,HMD2,no,N,74,,194234,4131,HEC
75,,SING,CMD,HMD3,no,N,75,,194234,4131,HEC
76,,SING,CAD,CBD,no,N,76,,194234,4131,HEC
77,,SING,CAD,HAD1,no,N,77,,194234,4131,HEC
78,,SING,CAD,HAD2,no,N,78,,194234,4131,HEC
79,,SING,CBD,CGD,no,N,79,,194234,4131,HEC
80,,SING,CBD,HBD1,no,N,80,,194234,4131,HEC
81,,SING,CBD,HBD2,no,N,81,,194234,4131,HEC
82,,DOUB,CGD,O1D,no,N,82,,194234,4131,HEC
83,,SING,CGD,O2D,no,N,83,,194234,4131,HEC
84,,SING,O2D,H2D,no,N,84,,194234,4131,HEC
1,,SING,N,CA,no,N,1,,194349,4138,PCA
2,,SING,N,CD,no,N,2,,194349,4138,PCA
3,,SING,N,H,no,N,3,,194349,4138,PCA
4,,SING,CA,CB,no,N,4,,194349,4138,PCA
5,,SING,CA,C,no,N,5,,194349,4138,PCA
6,,SING,CA,HA,no,N,6,,194349,4138,PCA
7,,SING,CB,CG,no,N,7,,194349,4138,PCA
8,,SING,CB,HB2,no,N,8,,194349,4138,PCA
9,,SING,CB,HB3,no,N,9,,194349,4138,PCA
10,,SING,CG,CD,no,N,10,,194349,4138,PCA
11,,SING,CG,HG2,no,N,11,,194349,4138,PCA
12,,SING,CG,HG3,no,N,12,,194349,4138,PCA
13,,DOUB,CD,OE,no,N,13,,194349,4138,PCA
14,,DOUB,C,O,no,N,14,,194349,4138,PCA
15,,SING,C,OXT,no,N,15,,194349,4138,PCA
16,,SING,OXT,HXT,no,N,16,,194349,4138,PCA
1,,SING,C1,O1,no,N,1,,194423,4142,PLM
2,,DOUB,C1,O2,no,N,2,,194423,4142,PLM
3,,SING,C1,C2,no,N,3,,194423,4142,PLM
4,,SING,O1,H,no,N,4,,194423,4142,PLM
5,,SING,C2,C3,no,N,5,,194423,4142,PLM
6,,SING,C2,H21,no,N,6,,194423,4142,PLM
7,,SING,C2,H22,no,N,7,,194423,4142,PLM
8,,SING,C3,C4,no,N,8,,194423,4142,PLM
9,,SING,C3,H31,no,N,9,,194423,4142,PLM
10,,SING,C3,H32,no,N,10,,194423,4142,PLM
11,,SING,C4,C5,no,N,11,,194423,4142,PLM
12,,SING,C4,H41,no,N,12,,194423,4142,PLM
13,,SING,C4,H42,no,N,13,,194423,4142,PLM
14,,SING,C5,C6,no,N,14,,194423,4142,PLM
15,,SING,C5,H51,no,N,15,,194423,4142,PLM
16,,SING,C5,H52,no,N,16,,194423,4142,PLM
17,,SING,C6,C7,no,N,17,,194423,4142,PLM
18,,SING,C6,H61,no,N,18,,194423,4142,PLM
19,,SING,C6,H62,no,N,19,,194423,4142,PLM
20,,SING,C7,C8,no,N,20,,194423,4142,PLM
21,,SING,C7,H71,no,N,21,,194423,4142,PLM
22,,SING,C7,H72,no,N,22,,194423,4142,PLM
23,,SING,C8,C9,no,N,23,,194423,4142,PLM
24,,SING,C8,H81,no,N,24,,194423,4142,PLM
25,,SING,C8,H82,no,N,25,,194423,4142,PLM
26,,SING,C9,CA,no,N,26,,194423,4142,PLM
27,,SING,C9,H91,no,N,27,,194423,4142,PLM
28,,SING,C9,H92,no,N,28,,194423,4142,PLM
29,,SING,CA,CB,no,N,29,,194423,4142,PLM
30,,SING,CA,HA1,no,N,30,,194423,4142,PLM
31,,SING,CA,HA2,no,N,31,,194423,4142,PLM
32,,SING,CB,CC,no,N,32,,194423,4142,PLM
33,,SING,CB,HB1,no,N,33,,194423,4142,PLM
34,,SING,CB,HB2,no,N,34,,194423,4142,PLM
35,,SING,CC,CD,no,N,35,,194423,4142,PLM
36,,SING,CC,HC1,no,N,36,,194423,4142,PLM
37,,SING,CC,HC2,no,N,37,,194423,4142,PLM
38,,SING,CD,CE,no,N,38,,194423,4142,PLM
39,,SING,CD,HD1,no,N,39,,194423,4142,PLM
40,,SING,CD,HD2,no,N,40,,194423,4142,PLM
41,,SING,CE,CF,no,N,41,,194423,4142,PLM
42,,SING,CE,HE1,no,N,42,,194423,4142,PLM
43,,SING,CE,HE2,no,N,43,,194423,4142,PLM
44,,SING,CF,CG,no,N,44,,194423,4142,PLM
45,,SING,CF,HF1,no,N,45,,194423,4142,PLM
46,,SING,CF,HF2,no,N,46,,194423,4142,PLM
47,,SING,CG,HG1,no,N,47,,194423,4142,PLM
48,,SING,CG,HG2,no,N,48,,194423,4142,PLM
49,,SING,CG,HG3,no,N,49,,194423,4142,PLM
1,,SING,N,CN,no,N,1,,194486,4146,FME
2,,SING,N,CA,no,N,2,,194486,4146,FME
3,,SING,N,H,no,N,3,,194486,4146,FME
4,,DOUB,CN,O1,no,N,4,,194486,4146,FME
5,,SING,CN,HCN,no,N,5,,194486,4146,FME
6,,SING,CA,CB,no,N,6,,194486,4146,FME
7,,SING,CA,C,no,N,7,,194486,4146,FME
8,,SING,CA,HA,no,N,8,,194486,4146,FME
9,,SING,CB,CG,no,N,9,,194486,4146,FME
10,,SING,CB,HB2,no,N,10,,194486,4146,FME
11,,SING,CB,HB3,no,N,11,,194486,4146,FME
12,,SING,CG,SD,no,N,12,,194486,4146,FME
13,,SING,CG,HG2,no,N,13,,194486,4146,FME
14,,SING,CG,HG3,no,N,14,,194486,4146,FME
15,,SING,SD,CE,no,N,15,,194486,4146,FME
16,,SING,CE,HE1,no,N,16,,194486,4146,FME
17,,SING,CE,HE2,no,N,17,,194486,4146,FME
18,,SING,CE,HE3,no,N,18,,194486,4146,FME
19,,DOUB,C,O,no,N,19,,194486,4146,FME
20,,SING,C,OXT,no,N,20,,194486,4146,FME
21,,SING,OXT,HXT,no,N,21,,194486,4146,FME
1,,SING,N,CN,no,N,1,,194581,4151,FME
2,,SING,N,CA,no,N,2,,194581,4151,FME
3,,SING,N,H,no,N,3,,194581,4151,FME
4,,DOUB,CN,O1,no,N,4,,194581,4151,FME
5,,SING,CN,HCN,no,N,5,,194581,4151,FME
6,,SING,CA,CB,no,N,6,,194581,4151,FME
7,,SING,CA,C,no,N,7,,194581,4151,FME
8,,SING,CA,HA,no,N,8,,194581,4151,FME
9,,SING,CB,CG,no,N,9,,194581,4151,FME
10,,SING,CB,HB2,no,N,10,,194581,4151,FME
11,,SING,CB,HB3,no,N,11,,194581,4151,FME
12,,SING,CG,SD,no,N,12,,194581,4151,FME
13,,SING,CG,HG2,no,N,13,,194581,4151,FME
14,,SING,CG,HG3,no,N,14,,194581,4151,FME
15,,SING,SD,CE,no,N,15,,194581,4151,FME
16,,SING,CE,HE1,no,N,16,,194581,4151,FME
17,,SING,CE,HE2,no,N,17,,194581,4151,FME
18,,SING,CE,HE3,no,N,18,,194581,4151,FME
19,,DOUB,C,O,no,N,19,,194581,4151,FME
20,,SING,C,OXT,no,N,20,,194581,4151,FME
21,,SING,OXT,HXT,no,N,21,,194581,4151,FME
1,,SING,N,CA,no,N,1,,194613,4153,NVA
2,,SING,N,H,no,N,2,,194613,4153,NVA
3,,SING,N,H2,no,N,3,,194613,4153,NVA
4,,SING,CA,CB,no,N,4,,194613,4153,NVA
5,,SING,CA,C,no,N,5,,194613,4153,NVA
6,,SING,CA,HA,no,N,6,,194613,4153,NVA
7,,SING,CB,CG,no,N,7,,194613,4153,NVA
8,,SING,CB,HB2,no,N,8,,194613,4153,NVA
9,,SING,CB,HB3,no,N,9,,194613,4153,NVA
10,,SING,CG,CD,no,N,10,,194613,4153,NVA
11,,SING,CG,HG2,no,N,11,,194613,4153,NVA
12,,SING,CG,HG3,no,N,12,,194613,4153,NVA
13,,SING,CD,HD1,no,N,13,,194613,4153,NVA
14,,SING,CD,HD2,no,N,14,,194613,4153,NVA
15,,SING,CD,HD3,no,N,15,,194613,4153,NVA
16,,DOUB,C,O,no,N,16,,194613,4153,NVA
17,,SING,C,OXT,no,N,17,,194613,4153,NVA
18,,SING,OXT,HXT,no,N,18,,194613,4153,NVA
1,,SING,FE1,S1,no,N,1,,194634,4154,FES
2,,SING,FE1,S2,no,N,2,,194634,4154,FES
3,,SING,FE2,S1,no,N,3,,194634,4154,FES
4,,SING,FE2,S2,no,N,4,,194634,4154,FES
1,,SING,N,CA,no,N,1,,194651,4155,PCA
2,,SING,N,CD,no,N,2,,194651,4155,PCA
3,,SING,N,H,no,N,3,,194651,4155,PCA
4,,SING,CA,CB,no,N,4,,194651,4155,PCA
5,,SING,CA,C,no,N,5,,194651,4155,PCA
6,,SING,CA,HA,no,N,6,,194651,4155,PCA
7,,SING,CB,CG,no,N,7,,194651,4155,PCA
8,,SING,CB,HB2,no,N,8,,194651,4155,PCA
9,,SING,CB,HB3,no,N,9,,194651,4155,PCA
10,,SING,CG,CD,no,N,10,,194651,4155,PCA
11,,SING,CG,HG2,no,N,11,,194651,4155,PCA
12,,SING,CG,HG3,no,N,12,,194651,4155,PCA
13,,DOUB,CD,OE,no,N,13,,194651,4155,PCA
14,,DOUB,C,O,no,N,14,,194651,4155,PCA
15,,SING,C,OXT,no,N,15,,194651,4155,PCA
16,,SING,OXT,HXT,no,N,16,,194651,4155,PCA
1,,DOUB,C1,O1,no,N,1,,194819,4164,SIN
2,,SING,C1,O2,no,N,2,,194819,4164,SIN
3,,SING,C1,C2,no,N,3,,194819,4164,SIN
4,,SING,O2,HO2,no,N,4,,194819,4164,SIN
5,,SING,C2,C3,no,N,5,,194819,4164,SIN
6,,SING,C2,H21,no,N,6,,194819,4164,SIN
7,,SING,C2,H22,no,N,7,,194819,4164,SIN
8,,SING,C3,C4,no,N,8,,194819,4164,SIN
9,,SING,C3,H31,no,N,9,,194819,4164,SIN
10,,SING,C3,H32,no,N,10,,194819,4164,SIN
11,,DOUB,C4,O3,no,N,11,,194819,4164,SIN
12,,SING,C4,O4,no,N,12,,194819,4164,SIN
13,,SING,O4,HO4,no,N,13,,194819,4164,SIN
1,,SING,N,CA,no,N,1,,194820,4164,ORN
2,,SING,N,H,no,N,2,,194820,4164,ORN
3,,SING,N,H2,no,N,3,,194820,4164,ORN
4,,SING,CA,CB,no,N,4,,194820,4164,ORN
5,,SING,CA,C,no,N,5,,194820,4164,ORN
6,,SING,CA,HA,no,N,6,,194820,4164,ORN
7,,SING,CB,CG,no,N,7,,194820,4164,ORN
8,,SING,CB,HB2,no,N,8,,194820,4164,ORN
9,,SING,CB,HB3,no,N,9,,194820,4164,ORN
10,,SING,CG,CD,no,N,10,,194820,4164,ORN
11,,SING,CG,HG2,no,N,11,,194820,4164,ORN
12,,SING,CG,HG3,no,N,12,,194820,4164,ORN
13,,SING,CD,NE,no,N,13,,194820,4164,ORN
14,,SING,CD,HD2,no,N,14,,194820,4164,ORN
15,,SING,CD,HD3,no,N,15,,194820,4164,ORN
16,,SING,NE,HE1,no,N,16,,194820,4164,ORN
17,,SING,NE,HE2,no,N,17,,194820,4164,ORN
18,,DOUB,C,O,no,N,18,,194820,4164,ORN
19,,SING,C,OXT,no,N,19,,194820,4164,ORN
20,,SING,OXT,HXT,no,N,20,,194820,4164,ORN
1,,SING,N,CA,no,N,1,,194821,4164,BHD
2,,SING,N,H,no,N,2,,194821,4164,BHD
3,,SING,N,H2,no,N,3,,194821,4164,BHD
4,,SING,CA,CB,no,N,4,,194821,4164,BHD
5,,SING,CA,C,no,N,5,,194821,4164,BHD
6,,SING,CA,HA,no,N,6,,194821,4164,BHD
7,,SING,CB,OB,no,N,7,,194821,4164,BHD
8,,SING,CB,CG,no,N,8,,194821,4164,BHD
9,,SING,CB,HB,no,N,9,,194821,4164,BHD
10,,SING,OB,HOB,no,N,10,,194821,4164,BHD
11,,DOUB,CG,OD1,no,N,11,,194821,4164,BHD
12,,SING,CG,OD2,no,N,12,,194821,4164,BHD
13,,SING,OD2,HD2,no,N,13,,194821,4164,BHD
14,,DOUB,C,O,no,N,14,,194821,4164,BHD
15,,SING,C,OXT,no,N,15,,194821,4164,BHD
16,,SING,OXT,HXT,no,N,16,,194821,4164,BHD
1,,SING,N,CA,no,N,1,,194822,4164,DAB
2,,SING,N,H,no,N,2,,194822,4164,DAB
3,,SING,N,H2,no,N,3,,194822,4164,DAB
4,,SING,CA,C,no,N,4,,194822,4164,DAB
5,,SING,CA,CB,no,N,5,,194822,4164,DAB
6,,SING,CA,HA,no,N,6,,194822,4164,DAB
7,,DOUB,C,O,no,N,7,,194822,4164,DAB
8,,SING,C,OXT,no,N,8,,194822,4164,DAB
9,,SING,CB,CG,no,N,9,,194822,4164,DAB
10,,SING,CB,HB2,no,N,10,,194822,4164,DAB
11,,SING,CB,HB3,no,N,11,,194822,4164,DAB
12,,SING,CG,ND,no,N,12,,194822,4164,DAB
13,,SING,CG,HG2,no,N,13,,194822,4164,DAB
14,,SING,CG,HG3,no,N,14,,194822,4164,DAB
15,,SING,ND,HD1,no,N,15,,194822,4164,DAB
16,,SING,ND,HD2,no,N,16,,194822,4164,DAB
17,,SING,OXT,HXT,no,N,17,,194822,4164,DAB
1,,DOUB,O,C,no,N,1,,194823,4164,ONH
2,,SING,C,OXT,no,N,2,,194823,4164,ONH
3,,SING,C,CA,no,N,3,,194823,4164,ONH
4,,SING,N,CA,no,N,4,,194823,4164,ONH
5,,SING,N,HN,no,N,5,,194823,4164,ONH
6,,SING,N,HNA,no,N,6,,194823,4164,ONH
7,,SING,CB,CA,no,N,7,,194823,4164,ONH
8,,SING,CA,HA,no,N,8,,194823,4164,ONH
9,,SING,CB,CG,no,N,9,,194823,4164,ONH
10,,SING,CB,HB,no,N,10,,194823,4164,ONH
11,,SING,CB,HBA,no,N,11,,194823,4164,ONH
12,,SING,CD,CG,no,N,12,,194823,4164,ONH
13,,SING,CD,NE,no,N,13,,194823,4164,ONH
14,,SING,CD,HD,no,N,14,,194823,4164,ONH
15,,SING,CD,HDA,no,N,15,,194823,4164,ONH
16,,SING,OZ,NE,no,N,16,,194823,4164,ONH
17,,SING,CG,HG,no,N,17,,194823,4164,ONH
18,,SING,CG,HGA,no,N,18,,194823,4164,ONH
19,,SING,OXT,HOXT,no,N,19,,194823,4164,ONH
20,,SING,OZ,HOZ,no,N,20,,194823,4164,ONH
21,,SING,NE,HNE,no,N,21,,194823,4164,ONH
1,,SING,C1,C2,no,N,1,,194824,4164,CHR
2,,SING,C1,C9,no,N,2,,194824,4164,CHR
3,,DOUB,C1,C12,no,N,3,,194824,4164,CHR
4,,TRIP,C2,C3,no,N,4,,194824,4164,CHR
5,,SING,C3,C4,no,N,5,,194824,4164,CHR
6,,SING,C4,O2,no,N,6,,194824,4164,CHR
7,,SING,C4,C5,no,N,7,,194824,4164,CHR
8,,SING,C4,C33,no,N,8,,194824,4164,CHR
9,,SING,O2,C5,no,N,9,,194824,4164,CHR
10,,SING,C5,C6,no,N,10,,194824,4164,CHR
11,,SING,C5,H5,no,N,11,,194824,4164,CHR
12,,TRIP,C6,C7,no,N,12,,194824,4164,CHR
13,,SING,C7,C8,no,N,13,,194824,4164,CHR
14,,DOUB,C8,C9,no,E,14,,194824,4164,CHR
15,,SING,C8,H8,no,N,15,,194824,4164,CHR
16,,SING,C9,C10,no,N,16,,194824,4164,CHR
17,,SING,C10,O1,no,N,17,,194824,4164,CHR
18,,SING,C10,C11,no,N,18,,194824,4164,CHR
19,,SING,C10,H10,no,N,19,,194824,4164,CHR
20,,SING,O1,C13,no,N,20,,194824,4164,CHR
21,,SING,C11,O6,no,N,21,,194824,4164,CHR
22,,SING,C11,C12,no,N,22,,194824,4164,CHR
23,,SING,C11,H11,no,N,23,,194824,4164,CHR
24,,SING,O6,C20,no,N,24,,194824,4164,CHR
25,,SING,C12,H12,no,N,25,,194824,4164,CHR
26,,SING,C13,O3,no,N,26,,194824,4164,CHR
27,,SING,C13,C14,no,N,27,,194824,4164,CHR
28,,SING,C13,H13,no,N,28,,194824,4164,CHR
29,,SING,O3,C17,no,N,29,,194824,4164,CHR
30,,SING,C14,N1,no,N,30,,194824,4164,CHR
31,,SING,C14,C15,no,N,31,,194824,4164,CHR
32,,SING,C14,H14,no,N,32,,194824,4164,CHR
33,,SING,N1,C19,no,N,33,,194824,4164,CHR
34,,SING,N1,HN1,no,N,34,,194824,4164,CHR
35,,SING,C19,H191,no,N,35,,194824,4164,CHR
36,,SING,C19,H192,no,N,36,,194824,4164,CHR
37,,SING,C19,H193,no,N,37,,194824,4164,CHR
38,,SING,C15,O4,no,N,38,,194824,4164,CHR
39,,SING,C15,C16,no,N,39,,194824,4164,CHR
40,,SING,C15,H15,no,N,40,,194824,4164,CHR
41,,SING,O4,HO4,no,N,41,,194824,4164,CHR
42,,SING,C16,O5,no,N,42,,194824,4164,CHR
43,,SING,C16,C17,no,N,43,,194824,4164,CHR
44,,SING,C16,H16,no,N,44,,194824,4164,CHR
45,,SING,O5,HO5,no,N,45,,194824,4164,CHR
46,,SING,C17,C18,no,N,46,,194824,4164,CHR
47,,SING,C17,H17,no,N,47,,194824,4164,CHR
48,,SING,C18,H181,no,N,48,,194824,4164,CHR
49,,SING,C18,H182,no,N,49,,194824,4164,CHR
50,,SING,C18,H183,no,N,50,,194824,4164,CHR
51,,DOUB,C20,O7,no,N,51,,194824,4164,CHR
52,,SING,C20,C21,no,N,52,,194824,4164,CHR
53,,DOUB,C21,C22,yes,N,53,,194824,4164,CHR
54,,SING,C21,C26,yes,N,54,,194824,4164,CHR
55,,SING,C22,O9,no,N,55,,194824,4164,CHR
56,,SING,C22,C23,yes,N,56,,194824,4164,CHR
57,,SING,O9,HO9,no,N,57,,194824,4164,CHR
58,,DOUB,C23,C24,yes,N,58,,194824,4164,CHR
59,,SING,C23,H23,no,N,59,,194824,4164,CHR
60,,SING,C24,C25,yes,N,60,,194824,4164,CHR
61,,SING,C24,H24,no,N,61,,194824,4164,CHR
62,,DOUB,C25,C26,yes,N,62,,194824,4164,CHR
63,,SING,C25,C30,yes,N,63,,194824,4164,CHR
64,,SING,C26,C27,yes,N,64,,194824,4164,CHR
65,,DOUB,C27,C28,yes,N,65,,194824,4164,CHR
66,,SING,C27,H27,no,N,66,,194824,4164,CHR
67,,SING,C28,O8,no,N,67,,194824,4164,CHR
68,,SING,C28,C29,yes,N,68,,194824,4164,CHR
69,,SING,O8,C31,no,N,69,,194824,4164,CHR
70,,SING,C31,H311,no,N,70,,194824,4164,CHR
71,,SING,C31,H312,no,N,71,,194824,4164,CHR
72,,SING,C31,H313,no,N,72,,194824,4164,CHR
73,,DOUB,C29,C30,yes,N,73,,194824,4164,CHR
74,,SING,C29,H29,no,N,74,,194824,4164,CHR
75,,SING,C30,C32,no,N,75,,194824,4164,CHR
76,,SING,C32,H321,no,N,76,,194824,4164,CHR
77,,SING,C32,H322,no,N,77,,194824,4164,CHR
78,,SING,C32,H323,no,N,78,,194824,4164,CHR
79,,SING,C33,O10,no,N,79,,194824,4164,CHR
80,,SING,C33,C35,no,N,80,,194824,4164,CHR
81,,SING,C33,H33,no,N,81,,194824,4164,CHR
82,,SING,O10,C34,no,N,82,,194824,4164,CHR
83,,DOUB,C34,O11,no,N,83,,194824,4164,CHR
84,,SING,C34,O12,no,N,84,,194824,4164,CHR
85,,SING,O12,C35,no,N,85,,194824,4164,CHR
86,,SING,C35,H351,no,N,86,,194824,4164,CHR
87,,SING,C35,H352,no,N,87,,194824,4164,CHR
1,,DOUB,C1,O1,no,N,1,,194916,4169,SIN
2,,SING,C1,O2,no,N,2,,194916,4169,SIN
3,,SING,C1,C2,no,N,3,,194916,4169,SIN
4,,SING,O2,HO2,no,N,4,,194916,4169,SIN
5,,SING,C2,C3,no,N,5,,194916,4169,SIN
6,,SING,C2,H21,no,N,6,,194916,4169,SIN
7,,SING,C2,H22,no,N,7,,194916,4169,SIN
8,,SING,C3,C4,no,N,8,,194916,4169,SIN
9,,SING,C3,H31,no,N,9,,194916,4169,SIN
10,,SING,C3,H32,no,N,10,,194916,4169,SIN
11,,DOUB,C4,O3,no,N,11,,194916,4169,SIN
12,,SING,C4,O4,no,N,12,,194916,4169,SIN
13,,SING,O4,HO4,no,N,13,,194916,4169,SIN
1,,SING,N,CA,no,N,1,,194917,4169,ORN
2,,SING,N,H,no,N,2,,194917,4169,ORN
3,,SING,N,H2,no,N,3,,194917,4169,ORN
4,,SING,CA,CB,no,N,4,,194917,4169,ORN
5,,SING,CA,C,no,N,5,,194917,4169,ORN
6,,SING,CA,HA,no,N,6,,194917,4169,ORN
7,,SING,CB,CG,no,N,7,,194917,4169,ORN
8,,SING,CB,HB2,no,N,8,,194917,4169,ORN
9,,SING,CB,HB3,no,N,9,,194917,4169,ORN
10,,SING,CG,CD,no,N,10,,194917,4169,ORN
11,,SING,CG,HG2,no,N,11,,194917,4169,ORN
12,,SING,CG,HG3,no,N,12,,194917,4169,ORN
13,,SING,CD,NE,no,N,13,,194917,4169,ORN
14,,SING,CD,HD2,no,N,14,,194917,4169,ORN
15,,SING,CD,HD3,no,N,15,,194917,4169,ORN
16,,SING,NE,HE1,no,N,16,,194917,4169,ORN
17,,SING,NE,HE2,no,N,17,,194917,4169,ORN
18,,DOUB,C,O,no,N,18,,194917,4169,ORN
19,,SING,C,OXT,no,N,19,,194917,4169,ORN
20,,SING,OXT,HXT,no,N,20,,194917,4169,ORN
1,,SING,N,CA,no,N,1,,194918,4169,BHD
2,,SING,N,H,no,N,2,,194918,4169,BHD
3,,SING,N,H2,no,N,3,,194918,4169,BHD
4,,SING,CA,CB,no,N,4,,194918,4169,BHD
5,,SING,CA,C,no,N,5,,194918,4169,BHD
6,,SING,CA,HA,no,N,6,,194918,4169,BHD
7,,SING,CB,OB,no,N,7,,194918,4169,BHD
8,,SING,CB,CG,no,N,8,,194918,4169,BHD
9,,SING,CB,HB,no,N,9,,194918,4169,BHD
10,,SING,OB,HOB,no,N,10,,194918,4169,BHD
11,,DOUB,CG,OD1,no,N,11,,194918,4169,BHD
12,,SING,CG,OD2,no,N,12,,194918,4169,BHD
13,,SING,OD2,HD2,no,N,13,,194918,4169,BHD
14,,DOUB,C,O,no,N,14,,194918,4169,BHD
15,,SING,C,OXT,no,N,15,,194918,4169,BHD
16,,SING,OXT,HXT,no,N,16,,194918,4169,BHD
1,,SING,N,CA,no,N,1,,194919,4169,DAB
2,,SING,N,H,no,N,2,,194919,4169,DAB
3,,SING,N,H2,no,N,3,,194919,4169,DAB
4,,SING,CA,C,no,N,4,,194919,4169,DAB
5,,SING,CA,CB,no,N,5,,194919,4169,DAB
6,,SING,CA,HA,no,N,6,,194919,4169,DAB
7,,DOUB,C,O,no,N,7,,194919,4169,DAB
8,,SING,C,OXT,no,N,8,,194919,4169,DAB
9,,SING,CB,CG,no,N,9,,194919,4169,DAB
10,,SING,CB,HB2,no,N,10,,194919,4169,DAB
11,,SING,CB,HB3,no,N,11,,194919,4169,DAB
12,,SING,CG,ND,no,N,12,,194919,4169,DAB
13,,SING,CG,HG2,no,N,13,,194919,4169,DAB
14,,SING,CG,HG3,no,N,14,,194919,4169,DAB
15,,SING,ND,HD1,no,N,15,,194919,4169,DAB
16,,SING,ND,HD2,no,N,16,,194919,4169,DAB
17,,SING,OXT,HXT,no,N,17,,194919,4169,DAB
1,,DOUB,O,C,no,N,1,,194920,4169,ONH
2,,SING,C,OXT,no,N,2,,194920,4169,ONH
3,,SING,C,CA,no,N,3,,194920,4169,ONH
4,,SING,N,CA,no,N,4,,194920,4169,ONH
5,,SING,N,HN,no,N,5,,194920,4169,ONH
6,,SING,N,HNA,no,N,6,,194920,4169,ONH
7,,SING,CB,CA,no,N,7,,194920,4169,ONH
8,,SING,CA,HA,no,N,8,,194920,4169,ONH
9,,SING,CB,CG,no,N,9,,194920,4169,ONH
10,,SING,CB,HB,no,N,10,,194920,4169,ONH
11,,SING,CB,HBA,no,N,11,,194920,4169,ONH
12,,SING,CD,CG,no,N,12,,194920,4169,ONH
13,,SING,CD,NE,no,N,13,,194920,4169,ONH
14,,SING,CD,HD,no,N,14,,194920,4169,ONH
15,,SING,CD,HDA,no,N,15,,194920,4169,ONH
16,,SING,OZ,NE,no,N,16,,194920,4169,ONH
17,,SING,CG,HG,no,N,17,,194920,4169,ONH
18,,SING,CG,HGA,no,N,18,,194920,4169,ONH
19,,SING,OXT,HOXT,no,N,19,,194920,4169,ONH
20,,SING,OZ,HOZ,no,N,20,,194920,4169,ONH
21,,SING,NE,HNE,no,N,21,,194920,4169,ONH
1,,SING,C1,C2,no,N,1,,194921,4169,CHR
2,,SING,C1,C9,no,N,2,,194921,4169,CHR
3,,DOUB,C1,C12,no,N,3,,194921,4169,CHR
4,,TRIP,C2,C3,no,N,4,,194921,4169,CHR
5,,SING,C3,C4,no,N,5,,194921,4169,CHR
6,,SING,C4,O2,no,N,6,,194921,4169,CHR
7,,SING,C4,C5,no,N,7,,194921,4169,CHR
8,,SING,C4,C33,no,N,8,,194921,4169,CHR
9,,SING,O2,C5,no,N,9,,194921,4169,CHR
10,,SING,C5,C6,no,N,10,,194921,4169,CHR
11,,SING,C5,H5,no,N,11,,194921,4169,CHR
12,,TRIP,C6,C7,no,N,12,,194921,4169,CHR
13,,SING,C7,C8,no,N,13,,194921,4169,CHR
14,,DOUB,C8,C9,no,E,14,,194921,4169,CHR
15,,SING,C8,H8,no,N,15,,194921,4169,CHR
16,,SING,C9,C10,no,N,16,,194921,4169,CHR
17,,SING,C10,O1,no,N,17,,194921,4169,CHR
18,,SING,C10,C11,no,N,18,,194921,4169,CHR
19,,SING,C10,H10,no,N,19,,194921,4169,CHR
20,,SING,O1,C13,no,N,20,,194921,4169,CHR
21,,SING,C11,O6,no,N,21,,194921,4169,CHR
22,,SING,C11,C12,no,N,22,,194921,4169,CHR
23,,SING,C11,H11,no,N,23,,194921,4169,CHR
24,,SING,O6,C20,no,N,24,,194921,4169,CHR
25,,SING,C12,H12,no,N,25,,194921,4169,CHR
26,,SING,C13,O3,no,N,26,,194921,4169,CHR
27,,SING,C13,C14,no,N,27,,194921,4169,CHR
28,,SING,C13,H13,no,N,28,,194921,4169,CHR
29,,SING,O3,C17,no,N,29,,194921,4169,CHR
30,,SING,C14,N1,no,N,30,,194921,4169,CHR
31,,SING,C14,C15,no,N,31,,194921,4169,CHR
32,,SING,C14,H14,no,N,32,,194921,4169,CHR
33,,SING,N1,C19,no,N,33,,194921,4169,CHR
34,,SING,N1,HN1,no,N,34,,194921,4169,CHR
35,,SING,C19,H191,no,N,35,,194921,4169,CHR
36,,SING,C19,H192,no,N,36,,194921,4169,CHR
37,,SING,C19,H193,no,N,37,,194921,4169,CHR
38,,SING,C15,O4,no,N,38,,194921,4169,CHR
39,,SING,C15,C16,no,N,39,,194921,4169,CHR
40,,SING,C15,H15,no,N,40,,194921,4169,CHR
41,,SING,O4,HO4,no,N,41,,194921,4169,CHR
42,,SING,C16,O5,no,N,42,,194921,4169,CHR
43,,SING,C16,C17,no,N,43,,194921,4169,CHR
44,,SING,C16,H16,no,N,44,,194921,4169,CHR
45,,SING,O5,HO5,no,N,45,,194921,4169,CHR
46,,SING,C17,C18,no,N,46,,194921,4169,CHR
47,,SING,C17,H17,no,N,47,,194921,4169,CHR
48,,SING,C18,H181,no,N,48,,194921,4169,CHR
49,,SING,C18,H182,no,N,49,,194921,4169,CHR
50,,SING,C18,H183,no,N,50,,194921,4169,CHR
51,,DOUB,C20,O7,no,N,51,,194921,4169,CHR
52,,SING,C20,C21,no,N,52,,194921,4169,CHR
53,,DOUB,C21,C22,yes,N,53,,194921,4169,CHR
54,,SING,C21,C26,yes,N,54,,194921,4169,CHR
55,,SING,C22,O9,no,N,55,,194921,4169,CHR
56,,SING,C22,C23,yes,N,56,,194921,4169,CHR
57,,SING,O9,HO9,no,N,57,,194921,4169,CHR
58,,DOUB,C23,C24,yes,N,58,,194921,4169,CHR
59,,SING,C23,H23,no,N,59,,194921,4169,CHR
60,,SING,C24,C25,yes,N,60,,194921,4169,CHR
61,,SING,C24,H24,no,N,61,,194921,4169,CHR
62,,DOUB,C25,C26,yes,N,62,,194921,4169,CHR
63,,SING,C25,C30,yes,N,63,,194921,4169,CHR
64,,SING,C26,C27,yes,N,64,,194921,4169,CHR
65,,DOUB,C27,C28,yes,N,65,,194921,4169,CHR
66,,SING,C27,H27,no,N,66,,194921,4169,CHR
67,,SING,C28,O8,no,N,67,,194921,4169,CHR
68,,SING,C28,C29,yes,N,68,,194921,4169,CHR
69,,SING,O8,C31,no,N,69,,194921,4169,CHR
70,,SING,C31,H311,no,N,70,,194921,4169,CHR
71,,SING,C31,H312,no,N,71,,194921,4169,CHR
72,,SING,C31,H313,no,N,72,,194921,4169,CHR
73,,DOUB,C29,C30,yes,N,73,,194921,4169,CHR
74,,SING,C29,H29,no,N,74,,194921,4169,CHR
75,,SING,C30,C32,no,N,75,,194921,4169,CHR
76,,SING,C32,H321,no,N,76,,194921,4169,CHR
77,,SING,C32,H322,no,N,77,,194921,4169,CHR
78,,SING,C32,H323,no,N,78,,194921,4169,CHR
79,,SING,C33,O10,no,N,79,,194921,4169,CHR
80,,SING,C33,C35,no,N,80,,194921,4169,CHR
81,,SING,C33,H33,no,N,81,,194921,4169,CHR
82,,SING,O10,C34,no,N,82,,194921,4169,CHR
83,,DOUB,C34,O11,no,N,83,,194921,4169,CHR
84,,SING,C34,O12,no,N,84,,194921,4169,CHR
85,,SING,O12,C35,no,N,85,,194921,4169,CHR
86,,SING,C35,H351,no,N,86,,194921,4169,CHR
87,,SING,C35,H352,no,N,87,,194921,4169,CHR
1,,DOUB,P,OP1,no,N,1,,194951,4170,IGU
2,,SING,P,OP2,no,N,2,,194951,4170,IGU
3,,SING,P,OP3,no,N,3,,194951,4170,IGU
4,,SING,P,O5',no,N,4,,194951,4170,IGU
5,,SING,OP2,HOP2,no,N,5,,194951,4170,IGU
6,,SING,OP3,HOP3,no,N,6,,194951,4170,IGU
7,,SING,O5',C5',no,N,7,,194951,4170,IGU
8,,SING,C5',C4',no,N,8,,194951,4170,IGU
9,,SING,C5',H5',no,N,9,,194951,4170,IGU
10,,SING,C5',H5'',no,N,10,,194951,4170,IGU
11,,SING,C4',O4',no,N,11,,194951,4170,IGU
12,,SING,C4',C3',no,N,12,,194951,4170,IGU
13,,SING,C4',H4',no,N,13,,194951,4170,IGU
14,,SING,O4',C1',no,N,14,,194951,4170,IGU
15,,SING,C3',O3',no,N,15,,194951,4170,IGU
16,,SING,C3',C2',no,N,16,,194951,4170,IGU
17,,SING,C3',H3',no,N,17,,194951,4170,IGU
18,,SING,O3',HO3',no,N,18,,194951,4170,IGU
19,,SING,C2',C1',no,N,19,,194951,4170,IGU
20,,SING,C2',H2',no,N,20,,194951,4170,IGU
21,,SING,C2',H2'',no,N,21,,194951,4170,IGU
22,,SING,C1',N9,no,N,22,,194951,4170,IGU
23,,SING,C1',H1',no,N,23,,194951,4170,IGU
24,,SING,N9,C8,yes,N,24,,194951,4170,IGU
25,,SING,N9,C4,yes,N,25,,194951,4170,IGU
26,,DOUB,C8,N7,yes,N,26,,194951,4170,IGU
27,,SING,C8,H8,no,N,27,,194951,4170,IGU
28,,SING,N7,C5,yes,N,28,,194951,4170,IGU
29,,SING,C6,N6,no,N,29,,194951,4170,IGU
30,,SING,C6,C5,no,N,30,,194951,4170,IGU
31,,DOUB,C6,N1,no,N,31,,194951,4170,IGU
32,,SING,N6,HN61,no,N,32,,194951,4170,IGU
33,,SING,N6,HN62,no,N,33,,194951,4170,IGU
34,,DOUB,C5,C4,yes,N,34,,194951,4170,IGU
35,,SING,N1,C2,no,N,35,,194951,4170,IGU
36,,DOUB,C2,O2,no,N,36,,194951,4170,IGU
37,,SING,C2,N3,no,N,37,,194951,4170,IGU
38,,SING,N3,C4,no,N,38,,194951,4170,IGU
39,,SING,N3,HN3,no,N,39,,194951,4170,IGU
1,,SING,C1,C2,no,N,1,,195008,4173,HAI
2,,SING,C1,C6,no,N,2,,195008,4173,HAI
3,,SING,C1,N,no,N,3,,195008,4173,HAI
4,,SING,C1,H1,no,N,4,,195008,4173,HAI
5,,SING,C2,C3,no,N,5,,195008,4173,HAI
6,,SING,C2,H21,no,N,6,,195008,4173,HAI
7,,SING,C2,H22,no,N,7,,195008,4173,HAI
8,,SING,C3,C4,no,N,8,,195008,4173,HAI
9,,SING,C3,H31,no,N,9,,195008,4173,HAI
10,,SING,C3,H32,no,N,10,,195008,4173,HAI
11,,SING,C4,C5,no,N,11,,195008,4173,HAI
12,,SING,C4,H41,no,N,12,,195008,4173,HAI
13,,SING,C4,H42,no,N,13,,195008,4173,HAI
14,,SING,C5,C6,no,N,14,,195008,4173,HAI
15,,SING,C5,H51,no,N,15,,195008,4173,HAI
16,,SING,C5,H52,no,N,16,,195008,4173,HAI
17,,SING,C6,H61,no,N,17,,195008,4173,HAI
18,,SING,C6,H62,no,N,18,,195008,4173,HAI
19,,SING,N,HN1,no,N,19,,195008,4173,HAI
20,,SING,N,HN2,no,N,20,,195008,4173,HAI
21,,SING,N,HN3,no,N,21,,195008,4173,HAI
1,,SING,FE1,S1,no,N,1,,195152,4181,FES
2,,SING,FE1,S2,no,N,2,,195152,4181,FES
3,,SING,FE2,S1,no,N,3,,195152,4181,FES
4,,SING,FE2,S2,no,N,4,,195152,4181,FES
1,,SING,N,CA,no,N,1,,195240,4185,PCA
2,,SING,N,CD,no,N,2,,195240,4185,PCA
3,,SING,N,H,no,N,3,,195240,4185,PCA
4,,SING,CA,CB,no,N,4,,195240,4185,PCA
5,,SING,CA,C,no,N,5,,195240,4185,PCA
6,,SING,CA,HA,no,N,6,,195240,4185,PCA
7,,SING,CB,CG,no,N,7,,195240,4185,PCA
8,,SING,CB,HB2,no,N,8,,195240,4185,PCA
9,,SING,CB,HB3,no,N,9,,195240,4185,PCA
10,,SING,CG,CD,no,N,10,,195240,4185,PCA
11,,SING,CG,HG2,no,N,11,,195240,4185,PCA
12,,SING,CG,HG3,no,N,12,,195240,4185,PCA
13,,DOUB,CD,OE,no,N,13,,195240,4185,PCA
14,,DOUB,C,O,no,N,14,,195240,4185,PCA
15,,SING,C,OXT,no,N,15,,195240,4185,PCA
16,,SING,OXT,HXT,no,N,16,,195240,4185,PCA
1,,SING,FE,NA,no,N,1,,195312,4189,HEC
2,,SING,FE,NB,no,N,2,,195312,4189,HEC
3,,SING,FE,NC,no,N,3,,195312,4189,HEC
4,,SING,FE,ND,no,N,4,,195312,4189,HEC
5,,DOUB,CHA,C1A,no,N,5,,195312,4189,HEC
6,,SING,CHA,C4D,no,N,6,,195312,4189,HEC
7,,SING,CHA,HHA,no,N,7,,195312,4189,HEC
8,,DOUB,CHB,C4A,no,N,8,,195312,4189,HEC
9,,SING,CHB,C1B,no,N,9,,195312,4189,HEC
10,,SING,CHB,HHB,no,N,10,,195312,4189,HEC
11,,DOUB,CHC,C4B,no,N,11,,195312,4189,HEC
12,,SING,CHC,C1C,no,N,12,,195312,4189,HEC
13,,SING,CHC,HHC,no,N,13,,195312,4189,HEC
14,,DOUB,CHD,C4C,no,N,14,,195312,4189,HEC
15,,SING,CHD,C1D,no,N,15,,195312,4189,HEC
16,,SING,CHD,HHD,no,N,16,,195312,4189,HEC
17,,SING,NA,C1A,yes,N,17,,195312,4189,HEC
18,,SING,NA,C4A,yes,N,18,,195312,4189,HEC
19,,SING,C1A,C2A,yes,N,19,,195312,4189,HEC
20,,DOUB,C2A,C3A,yes,N,20,,195312,4189,HEC
21,,SING,C2A,CAA,no,N,21,,195312,4189,HEC
22,,SING,C3A,C4A,yes,N,22,,195312,4189,HEC
23,,SING,C3A,CMA,no,N,23,,195312,4189,HEC
24,,SING,CMA,HMA1,no,N,24,,195312,4189,HEC
25,,SING,CMA,HMA2,no,N,25,,195312,4189,HEC
26,,SING,CMA,HMA3,no,N,26,,195312,4189,HEC
27,,SING,CAA,CBA,no,N,27,,195312,4189,HEC
28,,SING,CAA,HAA1,no,N,28,,195312,4189,HEC
29,,SING,CAA,HAA2,no,N,29,,195312,4189,HEC
30,,SING,CBA,CGA,no,N,30,,195312,4189,HEC
31,,SING,CBA,HBA1,no,N,31,,195312,4189,HEC
32,,SING,CBA,HBA2,no,N,32,,195312,4189,HEC
33,,DOUB,CGA,O1A,no,N,33,,195312,4189,HEC
34,,SING,CGA,O2A,no,N,34,,195312,4189,HEC
35,,SING,O2A,H2A,no,N,35,,195312,4189,HEC
36,,SING,NB,C1B,yes,N,36,,195312,4189,HEC
37,,SING,NB,C4B,yes,N,37,,195312,4189,HEC
38,,DOUB,C1B,C2B,yes,N,38,,195312,4189,HEC
39,,SING,C2B,C3B,yes,N,39,,195312,4189,HEC
40,,SING,C2B,CMB,no,N,40,,195312,4189,HEC
41,,SING,C3B,C4B,yes,N,41,,195312,4189,HEC
42,,DOUB,C3B,CAB,no,E,42,,195312,4189,HEC
43,,SING,CMB,HMB1,no,N,43,,195312,4189,HEC
44,,SING,CMB,HMB2,no,N,44,,195312,4189,HEC
45,,SING,CMB,HMB3,no,N,45,,195312,4189,HEC
46,,SING,CAB,CBB,no,N,46,,195312,4189,HEC
47,,SING,CAB,HAB,no,N,47,,195312,4189,HEC
48,,SING,CBB,HBB1,no,N,48,,195312,4189,HEC
49,,SING,CBB,HBB2,no,N,49,,195312,4189,HEC
50,,SING,CBB,HBB3,no,N,50,,195312,4189,HEC
51,,SING,NC,C1C,yes,N,51,,195312,4189,HEC
52,,SING,NC,C4C,yes,N,52,,195312,4189,HEC
53,,DOUB,C1C,C2C,yes,N,53,,195312,4189,HEC
54,,SING,C2C,C3C,yes,N,54,,195312,4189,HEC
55,,SING,C2C,CMC,no,N,55,,195312,4189,HEC
56,,SING,C3C,C4C,yes,N,56,,195312,4189,HEC
57,,DOUB,C3C,CAC,no,E,57,,195312,4189,HEC
58,,SING,CMC,HMC1,no,N,58,,195312,4189,HEC
59,,SING,CMC,HMC2,no,N,59,,195312,4189,HEC
60,,SING,CMC,HMC3,no,N,60,,195312,4189,HEC
61,,SING,CAC,CBC,no,N,61,,195312,4189,HEC
62,,SING,CAC,HAC,no,N,62,,195312,4189,HEC
63,,SING,CBC,HBC1,no,N,63,,195312,4189,HEC
64,,SING,CBC,HBC2,no,N,64,,195312,4189,HEC
65,,SING,CBC,HBC3,no,N,65,,195312,4189,HEC
66,,SING,ND,C1D,yes,N,66,,195312,4189,HEC
67,,SING,ND,C4D,yes,N,67,,195312,4189,HEC
68,,DOUB,C1D,C2D,yes,N,68,,195312,4189,HEC
69,,SING,C2D,C3D,yes,N,69,,195312,4189,HEC
70,,SING,C2D,CMD,no,N,70,,195312,4189,HEC
71,,DOUB,C3D,C4D,yes,N,71,,195312,4189,HEC
72,,SING,C3D,CAD,no,N,72,,195312,4189,HEC
73,,SING,CMD,HMD1,no,N,73,,195312,4189,HEC
74,,SING,CMD,HMD2,no,N,74,,195312,4189,HEC
75,,SING,CMD,HMD3,no,N,75,,195312,4189,HEC
76,,SING,CAD,CBD,no,N,76,,195312,4189,HEC
77,,SING,CAD,HAD1,no,N,77,,195312,4189,HEC
78,,SING,CAD,HAD2,no,N,78,,195312,4189,HEC
79,,SING,CBD,CGD,no,N,79,,195312,4189,HEC
80,,SING,CBD,HBD1,no,N,80,,195312,4189,HEC
81,,SING,CBD,HBD2,no,N,81,,195312,4189,HEC
82,,DOUB,CGD,O1D,no,N,82,,195312,4189,HEC
83,,SING,CGD,O2D,no,N,83,,195312,4189,HEC
84,,SING,O2D,H2D,no,N,84,,195312,4189,HEC
1,,SING,N,CA,no,N,1,,195345,4190,PCA
2,,SING,N,CD,no,N,2,,195345,4190,PCA
3,,SING,N,H,no,N,3,,195345,4190,PCA
4,,SING,CA,CB,no,N,4,,195345,4190,PCA
5,,SING,CA,C,no,N,5,,195345,4190,PCA
6,,SING,CA,HA,no,N,6,,195345,4190,PCA
7,,SING,CB,CG,no,N,7,,195345,4190,PCA
8,,SING,CB,HB2,no,N,8,,195345,4190,PCA
9,,SING,CB,HB3,no,N,9,,195345,4190,PCA
10,,SING,CG,CD,no,N,10,,195345,4190,PCA
11,,SING,CG,HG2,no,N,11,,195345,4190,PCA
12,,SING,CG,HG3,no,N,12,,195345,4190,PCA
13,,DOUB,CD,OE,no,N,13,,195345,4190,PCA
14,,DOUB,C,O,no,N,14,,195345,4190,PCA
15,,SING,C,OXT,no,N,15,,195345,4190,PCA
16,,SING,OXT,HXT,no,N,16,,195345,4190,PCA
1,,SING,N,CA,no,N,1,,195359,4191,PCA
2,,SING,N,CD,no,N,2,,195359,4191,PCA
3,,SING,N,H,no,N,3,,195359,4191,PCA
4,,SING,CA,CB,no,N,4,,195359,4191,PCA
5,,SING,CA,C,no,N,5,,195359,4191,PCA
6,,SING,CA,HA,no,N,6,,195359,4191,PCA
7,,SING,CB,CG,no,N,7,,195359,4191,PCA
8,,SING,CB,HB2,no,N,8,,195359,4191,PCA
9,,SING,CB,HB3,no,N,9,,195359,4191,PCA
10,,SING,CG,CD,no,N,10,,195359,4191,PCA
11,,SING,CG,HG2,no,N,11,,195359,4191,PCA
12,,SING,CG,HG3,no,N,12,,195359,4191,PCA
13,,DOUB,CD,OE,no,N,13,,195359,4191,PCA
14,,DOUB,C,O,no,N,14,,195359,4191,PCA
15,,SING,C,OXT,no,N,15,,195359,4191,PCA
16,,SING,OXT,HXT,no,N,16,,195359,4191,PCA
1,,DOUB,C2,O1,no,N,1,,195373,4192,3NF
2,,SING,C3,C2,no,N,2,,195373,4192,3NF
3,,SING,N4,C2,no,N,3,,195373,4192,3NF
4,,SING,C3,H3,no,N,4,,195373,4192,3NF
5,,SING,C3,H3A,no,N,5,,195373,4192,3NF
6,,SING,C3,H3B,no,N,6,,195373,4192,3NF
7,,SING,N4,C5,no,N,7,,195373,4192,3NF
8,,SING,N4,H2,no,N,8,,195373,4192,3NF
9,,SING,C9,C5,no,N,9,,195373,4192,3NF
10,,SING,C5,C6,no,N,10,,195373,4192,3NF
11,,SING,C5,H5,no,N,11,,195373,4192,3NF
12,,DOUB,O7,C6,no,N,12,,195373,4192,3NF
13,,SING,C6,OXT,no,N,13,,195373,4192,3NF
14,,SING,OXT,HXT,no,N,14,,195373,4192,3NF
15,,SING,C9,C10,no,N,15,,195373,4192,3NF
16,,SING,C9,H9,no,N,16,,195373,4192,3NF
17,,SING,C9,H9A,no,N,17,,195373,4192,3NF
18,,DOUB,C10,C15,yes,N,18,,195373,4192,3NF
19,,SING,C10,C11,yes,N,19,,195373,4192,3NF
20,,DOUB,C11,C12,yes,N,20,,195373,4192,3NF
21,,SING,C11,H11,no,N,21,,195373,4192,3NF
22,,SING,C12,C13,yes,N,22,,195373,4192,3NF
23,,SING,C12,H12,no,N,23,,195373,4192,3NF
24,,DOUB,C14,C13,yes,N,24,,195373,4192,3NF
25,,SING,C13,O16,no,N,25,,195373,4192,3NF
26,,SING,C15,C14,yes,N,26,,195373,4192,3NF
27,,SING,C14,H14,no,N,27,,195373,4192,3NF
28,,SING,C15,H15,no,N,28,,195373,4192,3NF
29,,SING,O16,HO16,no,N,29,,195373,4192,3NF
1,,SING,C1,N1,no,N,1,,195374,4192,GM1
2,,DOUB,C1,O1,no,N,2,,195374,4192,GM1
3,,SING,C1,C2,no,N,3,,195374,4192,GM1
4,,SING,N1,HN11,no,N,4,,195374,4192,GM1
5,,SING,N1,HN12,no,N,5,,195374,4192,GM1
6,,SING,C2,N2,no,N,6,,195374,4192,GM1
7,,SING,C2,H21,no,N,7,,195374,4192,GM1
8,,SING,C2,H22,no,N,8,,195374,4192,GM1
9,,SING,N2,HN21,no,N,9,,195374,4192,GM1
10,,SING,N2,HN22,no,N,10,,195374,4192,GM1
1,,DOUB,PA,O1A,no,N,1,,195390,4193,AP5
2,,SING,PA,O2A,no,N,2,,195390,4193,AP5
3,,SING,PA,O3A,no,N,3,,195390,4193,AP5
4,,SING,PA,O5F,no,N,4,,195390,4193,AP5
5,,SING,O2A,HOA2,no,N,5,,195390,4193,AP5
6,,SING,O3A,PB,no,N,6,,195390,4193,AP5
7,,DOUB,PB,O1B,no,N,7,,195390,4193,AP5
8,,SING,PB,O2B,no,N,8,,195390,4193,AP5
9,,SING,PB,O3B,no,N,9,,195390,4193,AP5
10,,SING,O2B,HOB2,no,N,10,,195390,4193,AP5
11,,SING,O3B,PG,no,N,11,,195390,4193,AP5
12,,DOUB,PG,O1G,no,N,12,,195390,4193,AP5
13,,SING,PG,O2G,no,N,13,,195390,4193,AP5
14,,SING,PG,O3G,no,N,14,,195390,4193,AP5
15,,SING,O2G,HOG2,no,N,15,,195390,4193,AP5
16,,SING,O3G,PD,no,N,16,,195390,4193,AP5
17,,DOUB,PD,O1D,no,N,17,,195390,4193,AP5
18,,SING,PD,O2D,no,N,18,,195390,4193,AP5
19,,SING,PD,O3D,no,N,19,,195390,4193,AP5
20,,SING,O2D,HOD2,no,N,20,,195390,4193,AP5
21,,SING,O3D,PE,no,N,21,,195390,4193,AP5
22,,DOUB,PE,O1E,no,N,22,,195390,4193,AP5
23,,SING,PE,O2E,no,N,23,,195390,4193,AP5
24,,SING,PE,O5J,no,N,24,,195390,4193,AP5
25,,SING,O2E,HOE2,no,N,25,,195390,4193,AP5
26,,SING,O5F,C5F,no,N,26,,195390,4193,AP5
27,,SING,C5F,C4F,no,N,27,,195390,4193,AP5
28,,SING,C5F,H51A,no,N,28,,195390,4193,AP5
29,,SING,C5F,H52A,no,N,29,,195390,4193,AP5
30,,SING,C4F,O4F,no,N,30,,195390,4193,AP5
31,,SING,C4F,C3F,no,N,31,,195390,4193,AP5
32,,SING,C4F,H4F,no,N,32,,195390,4193,AP5
33,,SING,O4F,C1F,no,N,33,,195390,4193,AP5
34,,SING,C3F,O3F,no,N,34,,195390,4193,AP5
35,,SING,C3F,C2F,no,N,35,,195390,4193,AP5
36,,SING,C3F,H3F,no,N,36,,195390,4193,AP5
37,,SING,O3F,HO3A,no,N,37,,195390,4193,AP5
38,,SING,C2F,O2F,no,N,38,,195390,4193,AP5
39,,SING,C2F,C1F,no,N,39,,195390,4193,AP5
40,,SING,C2F,H2F,no,N,40,,195390,4193,AP5
41,,SING,O2F,HO2A,no,N,41,,195390,4193,AP5
42,,SING,C1F,N9A,no,N,42,,195390,4193,AP5
43,,SING,C1F,H1F,no,N,43,,195390,4193,AP5
44,,SING,N9A,C8A,yes,N,44,,195390,4193,AP5
45,,SING,N9A,C4A,yes,N,45,,195390,4193,AP5
46,,DOUB,C8A,N7A,yes,N,46,,195390,4193,AP5
47,,SING,C8A,H8A,no,N,47,,195390,4193,AP5
48,,SING,N7A,C5A,yes,N,48,,195390,4193,AP5
49,,SING,C5A,C6A,yes,N,49,,195390,4193,AP5
50,,DOUB,C5A,C4A,yes,N,50,,195390,4193,AP5
51,,SING,C6A,N6A,no,N,51,,195390,4193,AP5
52,,DOUB,C6A,N1A,yes,N,52,,195390,4193,AP5
53,,SING,N6A,H61A,no,N,53,,195390,4193,AP5
54,,SING,N6A,H62A,no,N,54,,195390,4193,AP5
55,,SING,N1A,C2A,yes,N,55,,195390,4193,AP5
56,,DOUB,C2A,N3A,yes,N,56,,195390,4193,AP5
57,,SING,C2A,H2A,no,N,57,,195390,4193,AP5
58,,SING,N3A,C4A,yes,N,58,,195390,4193,AP5
59,,SING,O5J,C5J,no,N,59,,195390,4193,AP5
60,,SING,C5J,C4J,no,N,60,,195390,4193,AP5
61,,SING,C5J,H51B,no,N,61,,195390,4193,AP5
62,,SING,C5J,H52B,no,N,62,,195390,4193,AP5
63,,SING,C4J,O4J,no,N,63,,195390,4193,AP5
64,,SING,C4J,C3J,no,N,64,,195390,4193,AP5
65,,SING,C4J,H4J,no,N,65,,195390,4193,AP5
66,,SING,O4J,C1J,no,N,66,,195390,4193,AP5
67,,SING,C3J,O3J,no,N,67,,195390,4193,AP5
68,,SING,C3J,C2J,no,N,68,,195390,4193,AP5
69,,SING,C3J,H3J,no,N,69,,195390,4193,AP5
70,,SING,O3J,HO3B,no,N,70,,195390,4193,AP5
71,,SING,C2J,O2J,no,N,71,,195390,4193,AP5
72,,SING,C2J,C1J,no,N,72,,195390,4193,AP5
73,,SING,C2J,H2J,no,N,73,,195390,4193,AP5
74,,SING,O2J,HO2B,no,N,74,,195390,4193,AP5
75,,SING,C1J,N9B,no,N,75,,195390,4193,AP5
76,,SING,C1J,H1J,no,N,76,,195390,4193,AP5
77,,SING,N9B,C8B,yes,N,77,,195390,4193,AP5
78,,SING,N9B,C4B,yes,N,78,,195390,4193,AP5
79,,DOUB,C8B,N7B,yes,N,79,,195390,4193,AP5
80,,SING,C8B,H8B,no,N,80,,195390,4193,AP5
81,,SING,N7B,C5B,yes,N,81,,195390,4193,AP5
82,,SING,C5B,C6B,yes,N,82,,195390,4193,AP5
83,,DOUB,C5B,C4B,yes,N,83,,195390,4193,AP5
84,,SING,C6B,N6B,no,N,84,,195390,4193,AP5
85,,DOUB,C6B,N1B,yes,N,85,,195390,4193,AP5
86,,SING,N6B,H61B,no,N,86,,195390,4193,AP5
87,,SING,N6B,H62B,no,N,87,,195390,4193,AP5
88,,SING,N1B,C2B,yes,N,88,,195390,4193,AP5
89,,DOUB,C2B,N3B,yes,N,89,,195390,4193,AP5
90,,SING,C2B,H2B,no,N,90,,195390,4193,AP5
91,,SING,N3B,C4B,yes,N,91,,195390,4193,AP5
1,,SING,N,CA,no,N,1,,195418,4194,DPR
2,,SING,N,CD,no,N,2,,195418,4194,DPR
3,,SING,N,H,no,N,3,,195418,4194,DPR
4,,SING,CA,CB,no,N,4,,195418,4194,DPR
5,,SING,CA,C,no,N,5,,195418,4194,DPR
6,,SING,CA,HA,no,N,6,,195418,4194,DPR
7,,SING,CB,CG,no,N,7,,195418,4194,DPR
8,,SING,CB,HB2,no,N,8,,195418,4194,DPR
9,,SING,CB,HB3,no,N,9,,195418,4194,DPR
10,,SING,CG,CD,no,N,10,,195418,4194,DPR
11,,SING,CG,HG2,no,N,11,,195418,4194,DPR
12,,SING,CG,HG3,no,N,12,,195418,4194,DPR
13,,SING,CD,HD2,no,N,13,,195418,4194,DPR
14,,SING,CD,HD3,no,N,14,,195418,4194,DPR
15,,DOUB,C,O,no,N,15,,195418,4194,DPR
16,,SING,C,OXT,no,N,16,,195418,4194,DPR
17,,SING,OXT,HXT,no,N,17,,195418,4194,DPR
1,,SING,N,HN1,no,N,1,,195419,4194,NH2
2,,SING,N,HN2,no,N,2,,195419,4194,NH2
1,,DOUB,C,O,no,N,1,,195520,420,ACE
2,,SING,C,CH3,no,N,2,,195520,420,ACE
3,,SING,C,H,no,N,3,,195520,420,ACE
4,,SING,CH3,H1,no,N,4,,195520,420,ACE
5,,SING,CH3,H2,no,N,5,,195520,420,ACE
6,,SING,CH3,H3,no,N,6,,195520,420,ACE
1,,SING,N,HN1,no,N,1,,195521,420,NH2
2,,SING,N,HN2,no,N,2,,195521,420,NH2
1,,DOUB,C,O,no,N,1,,195537,4200,ACE
2,,SING,C,CH3,no,N,2,,195537,4200,ACE
3,,SING,C,H,no,N,3,,195537,4200,ACE
4,,SING,CH3,H1,no,N,4,,195537,4200,ACE
5,,SING,CH3,H2,no,N,5,,195537,4200,ACE
6,,SING,CH3,H3,no,N,6,,195537,4200,ACE
1,,SING,N,HN1,no,N,1,,195538,4200,NH2
2,,SING,N,HN2,no,N,2,,195538,4200,NH2
1,,SING,N,CA,no,N,1,,195557,4201,ABA
2,,SING,N,H,no,N,2,,195557,4201,ABA
3,,SING,N,HN2,no,N,3,,195557,4201,ABA
4,,SING,CA,C,no,N,4,,195557,4201,ABA
5,,SING,CA,CB,no,N,5,,195557,4201,ABA
6,,SING,CA,HA,no,N,6,,195557,4201,ABA
7,,DOUB,C,O,no,N,7,,195557,4201,ABA
8,,SING,C,OXT,no,N,8,,195557,4201,ABA
9,,SING,CB,CG,no,N,9,,195557,4201,ABA
10,,SING,CB,HB3,no,N,10,,195557,4201,ABA
11,,SING,CB,HB2,no,N,11,,195557,4201,ABA
12,,SING,CG,HG1,no,N,12,,195557,4201,ABA
13,,SING,CG,HG3,no,N,13,,195557,4201,ABA
14,,SING,CG,HG2,no,N,14,,195557,4201,ABA
15,,SING,OXT,HXT,no,N,15,,195557,4201,ABA
1,,SING,N,HN1,no,N,1,,195595,4203,NH2
2,,SING,N,HN2,no,N,2,,195595,4203,NH2
1,,DOUB,C2,O1,no,N,1,,195596,4203,3NF
2,,SING,C3,C2,no,N,2,,195596,4203,3NF
3,,SING,N4,C2,no,N,3,,195596,4203,3NF
4,,SING,C3,H3,no,N,4,,195596,4203,3NF
5,,SING,C3,H3A,no,N,5,,195596,4203,3NF
6,,SING,C3,H3B,no,N,6,,195596,4203,3NF
7,,SING,N4,C5,no,N,7,,195596,4203,3NF
8,,SING,N4,H2,no,N,8,,195596,4203,3NF
9,,SING,C9,C5,no,N,9,,195596,4203,3NF
10,,SING,C5,C6,no,N,10,,195596,4203,3NF
11,,SING,C5,H5,no,N,11,,195596,4203,3NF
12,,DOUB,O7,C6,no,N,12,,195596,4203,3NF
13,,SING,C6,OXT,no,N,13,,195596,4203,3NF
14,,SING,OXT,HXT,no,N,14,,195596,4203,3NF
15,,SING,C9,C10,no,N,15,,195596,4203,3NF
16,,SING,C9,H9,no,N,16,,195596,4203,3NF
17,,SING,C9,H9A,no,N,17,,195596,4203,3NF
18,,DOUB,C10,C15,yes,N,18,,195596,4203,3NF
19,,SING,C10,C11,yes,N,19,,195596,4203,3NF
20,,DOUB,C11,C12,yes,N,20,,195596,4203,3NF
21,,SING,C11,H11,no,N,21,,195596,4203,3NF
22,,SING,C12,C13,yes,N,22,,195596,4203,3NF
23,,SING,C12,H12,no,N,23,,195596,4203,3NF
24,,DOUB,C14,C13,yes,N,24,,195596,4203,3NF
25,,SING,C13,O16,no,N,25,,195596,4203,3NF
26,,SING,C15,C14,yes,N,26,,195596,4203,3NF
27,,SING,C14,H14,no,N,27,,195596,4203,3NF
28,,SING,C15,H15,no,N,28,,195596,4203,3NF
29,,SING,O16,HO16,no,N,29,,195596,4203,3NF
1,,SING,N,CA,no,N,1,,195597,4203,SET
2,,SING,N,H,no,N,2,,195597,4203,SET
3,,SING,N,H2,no,N,3,,195597,4203,SET
4,,SING,CA,CB,no,N,4,,195597,4203,SET
5,,SING,CA,C,no,N,5,,195597,4203,SET
6,,SING,CA,HA,no,N,6,,195597,4203,SET
7,,SING,CB,OG,no,N,7,,195597,4203,SET
8,,SING,CB,HB2,no,N,8,,195597,4203,SET
9,,SING,CB,HB3,no,N,9,,195597,4203,SET
10,,SING,OG,HG,no,N,10,,195597,4203,SET
11,,SING,NT,C,no,N,11,,195597,4203,SET
12,,SING,NT,HNT1,no,N,12,,195597,4203,SET
13,,SING,NT,HNT2,no,N,13,,195597,4203,SET
14,,DOUB,C,O,no,N,14,,195597,4203,SET
1,,SING,CHA,C1A,yes,N,1,,195702,4208,HEM
2,,DOUB,CHA,C4D,yes,N,2,,195702,4208,HEM
3,,SING,CHA,HHA,no,N,3,,195702,4208,HEM
4,,SING,CHB,C4A,yes,N,4,,195702,4208,HEM
5,,DOUB,CHB,C1B,yes,N,5,,195702,4208,HEM
6,,SING,CHB,HHB,no,N,6,,195702,4208,HEM
7,,SING,CHC,C4B,yes,N,7,,195702,4208,HEM
8,,DOUB,CHC,C1C,yes,N,8,,195702,4208,HEM
9,,SING,CHC,HHC,no,N,9,,195702,4208,HEM
10,,DOUB,CHD,C4C,yes,N,10,,195702,4208,HEM
11,,SING,CHD,C1D,yes,N,11,,195702,4208,HEM
12,,SING,CHD,HHD,no,N,12,,195702,4208,HEM
13,,DOUB,C1A,C2A,yes,N,13,,195702,4208,HEM
14,,SING,C1A,NA,yes,N,14,,195702,4208,HEM
15,,SING,C2A,C3A,yes,N,15,,195702,4208,HEM
16,,SING,C2A,CAA,no,N,16,,195702,4208,HEM
17,,DOUB,C3A,C4A,yes,N,17,,195702,4208,HEM
18,,SING,C3A,CMA,no,N,18,,195702,4208,HEM
19,,SING,C4A,NA,yes,N,19,,195702,4208,HEM
20,,SING,CMA,HMA,no,N,20,,195702,4208,HEM
21,,SING,CMA,HMAA,no,N,21,,195702,4208,HEM
22,,SING,CMA,HMAB,no,N,22,,195702,4208,HEM
23,,SING,CAA,CBA,no,N,23,,195702,4208,HEM
24,,SING,CAA,HAA,no,N,24,,195702,4208,HEM
25,,SING,CAA,HAAA,no,N,25,,195702,4208,HEM
26,,SING,CBA,CGA,no,N,26,,195702,4208,HEM
27,,SING,CBA,HBA,no,N,27,,195702,4208,HEM
28,,SING,CBA,HBAA,no,N,28,,195702,4208,HEM
29,,DOUB,CGA,O1A,no,N,29,,195702,4208,HEM
30,,SING,CGA,O2A,no,N,30,,195702,4208,HEM
31,,SING,C1B,C2B,no,N,31,,195702,4208,HEM
32,,SING,C1B,NB,yes,N,32,,195702,4208,HEM
33,,DOUB,C2B,C3B,yes,N,33,,195702,4208,HEM
34,,SING,C2B,CMB,yes,N,34,,195702,4208,HEM
35,,SING,C3B,C4B,no,N,35,,195702,4208,HEM
36,,SING,C3B,CAB,yes,N,36,,195702,4208,HEM
37,,DOUB,C4B,NB,no,N,37,,195702,4208,HEM
38,,SING,CMB,HMB,yes,N,38,,195702,4208,HEM
39,,SING,CMB,HMBA,no,N,39,,195702,4208,HEM
40,,SING,CMB,HMBB,no,N,40,,195702,4208,HEM
41,,DOUB,CAB,CBB,no,N,41,,195702,4208,HEM
42,,SING,CAB,HAB,no,N,42,,195702,4208,HEM
43,,SING,CBB,HBB,no,N,43,,195702,4208,HEM
44,,SING,CBB,HBBA,no,N,44,,195702,4208,HEM
45,,SING,C1C,C2C,no,N,45,,195702,4208,HEM
46,,SING,C1C,NC,yes,N,46,,195702,4208,HEM
47,,DOUB,C2C,C3C,yes,N,47,,195702,4208,HEM
48,,SING,C2C,CMC,yes,N,48,,195702,4208,HEM
49,,SING,C3C,C4C,no,N,49,,195702,4208,HEM
50,,SING,C3C,CAC,yes,N,50,,195702,4208,HEM
51,,SING,C4C,NC,no,N,51,,195702,4208,HEM
52,,SING,CMC,HMC,yes,N,52,,195702,4208,HEM
53,,SING,CMC,HMCA,no,N,53,,195702,4208,HEM
54,,SING,CMC,HMCB,no,N,54,,195702,4208,HEM
55,,DOUB,CAC,CBC,no,N,55,,195702,4208,HEM
56,,SING,CAC,HAC,no,N,56,,195702,4208,HEM
57,,SING,CBC,HBC,no,N,57,,195702,4208,HEM
58,,SING,CBC,HBCA,no,N,58,,195702,4208,HEM
59,,SING,C1D,C2D,no,N,59,,195702,4208,HEM
60,,DOUB,C1D,ND,yes,N,60,,195702,4208,HEM
61,,DOUB,C2D,C3D,yes,N,61,,195702,4208,HEM
62,,SING,C2D,CMD,yes,N,62,,195702,4208,HEM
63,,SING,C3D,C4D,no,N,63,,195702,4208,HEM
64,,SING,C3D,CAD,yes,N,64,,195702,4208,HEM
65,,SING,C4D,ND,no,N,65,,195702,4208,HEM
66,,SING,CMD,HMD,yes,N,66,,195702,4208,HEM
67,,SING,CMD,HMDA,no,N,67,,195702,4208,HEM
68,,SING,CMD,HMDB,no,N,68,,195702,4208,HEM
69,,SING,CAD,CBD,no,N,69,,195702,4208,HEM
70,,SING,CAD,HAD,no,N,70,,195702,4208,HEM
71,,SING,CAD,HADA,no,N,71,,195702,4208,HEM
72,,SING,CBD,CGD,no,N,72,,195702,4208,HEM
73,,SING,CBD,HBD,no,N,73,,195702,4208,HEM
74,,SING,CBD,HBDA,no,N,74,,195702,4208,HEM
75,,DOUB,CGD,O1D,no,N,75,,195702,4208,HEM
76,,SING,CGD,O2D,no,N,76,,195702,4208,HEM
77,,SING,O2A,H2A,no,N,77,,195702,4208,HEM
78,,SING,O2D,H2D,no,N,78,,195702,4208,HEM
79,,SING,FE,NA,no,N,79,,195702,4208,HEM
80,,SING,FE,NB,no,N,80,,195702,4208,HEM
81,,SING,FE,NC,no,N,81,,195702,4208,HEM
82,,SING,FE,ND,no,N,82,,195702,4208,HEM
1,,SING,C1,C2,no,N,1,,195797,4212,AAC
2,,SING,C1,O1,no,N,2,,195797,4212,AAC
3,,DOUB,C1,O2,no,N,3,,195797,4212,AAC
4,,SING,C2,N1,no,N,4,,195797,4212,AAC
5,,SING,C2,HC21,no,N,5,,195797,4212,AAC
6,,SING,C2,HC22,no,N,6,,195797,4212,AAC
7,,SING,C3,C4,no,N,7,,195797,4212,AAC
8,,SING,C3,N1,no,N,8,,195797,4212,AAC
9,,DOUB,C3,O3,no,N,9,,195797,4212,AAC
10,,SING,C4,HC41,no,N,10,,195797,4212,AAC
11,,SING,C4,HC42,no,N,11,,195797,4212,AAC
12,,SING,C4,HC43,no,N,12,,195797,4212,AAC
13,,SING,N1,HN1,no,N,13,,195797,4212,AAC
14,,SING,O1,HO1,no,N,14,,195797,4212,AAC
1,,SING,N,CA,no,N,1,,195810,4213,DSN
2,,SING,N,H,no,N,2,,195810,4213,DSN
3,,SING,N,H2,no,N,3,,195810,4213,DSN
4,,SING,CA,C,no,N,4,,195810,4213,DSN
5,,SING,CA,CB,no,N,5,,195810,4213,DSN
6,,SING,CA,HA,no,N,6,,195810,4213,DSN
7,,DOUB,C,O,no,N,7,,195810,4213,DSN
8,,SING,C,OXT,no,N,8,,195810,4213,DSN
9,,SING,OXT,HXT,no,N,9,,195810,4213,DSN
10,,SING,CB,OG,no,N,10,,195810,4213,DSN
11,,SING,CB,HB2,no,N,11,,195810,4213,DSN
12,,SING,CB,HB3,no,N,12,,195810,4213,DSN
13,,SING,OG,HG,no,N,13,,195810,4213,DSN
1,,SING,N,CA,no,N,1,,195811,4213,DGN
2,,SING,N,H,no,N,2,,195811,4213,DGN
3,,SING,N,H2,no,N,3,,195811,4213,DGN
4,,SING,CA,C,no,N,4,,195811,4213,DGN
5,,SING,CA,CB,no,N,5,,195811,4213,DGN
6,,SING,CA,HA,no,N,6,,195811,4213,DGN
7,,DOUB,C,O,no,N,7,,195811,4213,DGN
8,,SING,C,OXT,no,N,8,,195811,4213,DGN
9,,SING,OXT,HXT,no,N,9,,195811,4213,DGN
10,,SING,CB,CG,no,N,10,,195811,4213,DGN
11,,SING,CB,HB2,no,N,11,,195811,4213,DGN
12,,SING,CB,HB3,no,N,12,,195811,4213,DGN
13,,SING,CG,CD,no,N,13,,195811,4213,DGN
14,,SING,CG,HG2,no,N,14,,195811,4213,DGN
15,,SING,CG,HG3,no,N,15,,195811,4213,DGN
16,,DOUB,CD,OE1,no,N,16,,195811,4213,DGN
17,,SING,CD,NE2,no,N,17,,195811,4213,DGN
18,,SING,NE2,HE21,no,N,18,,195811,4213,DGN
19,,SING,NE2,HE22,no,N,19,,195811,4213,DGN
1,,SING,N,CA,no,N,1,,195812,4213,DVA
2,,SING,N,H,no,N,2,,195812,4213,DVA
3,,SING,N,H2,no,N,3,,195812,4213,DVA
4,,SING,CA,CB,no,N,4,,195812,4213,DVA
5,,SING,CA,C,no,N,5,,195812,4213,DVA
6,,SING,CA,HA,no,N,6,,195812,4213,DVA
7,,SING,CB,CG1,no,N,7,,195812,4213,DVA
8,,SING,CB,CG2,no,N,8,,195812,4213,DVA
9,,SING,CB,HB,no,N,9,,195812,4213,DVA
10,,SING,CG1,HG11,no,N,10,,195812,4213,DVA
11,,SING,CG1,HG12,no,N,11,,195812,4213,DVA
12,,SING,CG1,HG13,no,N,12,,195812,4213,DVA
13,,SING,CG2,HG21,no,N,13,,195812,4213,DVA
14,,SING,CG2,HG22,no,N,14,,195812,4213,DVA
15,,SING,CG2,HG23,no,N,15,,195812,4213,DVA
16,,DOUB,C,O,no,N,16,,195812,4213,DVA
17,,SING,C,OXT,no,N,17,,195812,4213,DVA
18,,SING,OXT,HXT,no,N,18,,195812,4213,DVA
1,,SING,N,CA,no,N,1,,195813,4213,DAR
2,,SING,N,H,no,N,2,,195813,4213,DAR
3,,SING,N,H2,no,N,3,,195813,4213,DAR
4,,SING,CA,CB,no,N,4,,195813,4213,DAR
5,,SING,CA,C,no,N,5,,195813,4213,DAR
6,,SING,CA,HA,no,N,6,,195813,4213,DAR
7,,SING,CB,CG,no,N,7,,195813,4213,DAR
8,,SING,CB,HB2,no,N,8,,195813,4213,DAR
9,,SING,CB,HB3,no,N,9,,195813,4213,DAR
10,,SING,CG,CD,no,N,10,,195813,4213,DAR
11,,SING,CG,HG2,no,N,11,,195813,4213,DAR
12,,SING,CG,HG3,no,N,12,,195813,4213,DAR
13,,SING,CD,NE,no,N,13,,195813,4213,DAR
14,,SING,CD,HD2,no,N,14,,195813,4213,DAR
15,,SING,CD,HD3,no,N,15,,195813,4213,DAR
16,,SING,NE,CZ,no,N,16,,195813,4213,DAR
17,,SING,NE,HE,no,N,17,,195813,4213,DAR
18,,SING,CZ,NH1,no,N,18,,195813,4213,DAR
19,,DOUB,CZ,NH2,no,N,19,,195813,4213,DAR
20,,SING,NH1,HH11,no,N,20,,195813,4213,DAR
21,,SING,NH1,HH12,no,N,21,,195813,4213,DAR
22,,SING,NH2,HH21,no,N,22,,195813,4213,DAR
23,,SING,NH2,HH22,no,N,23,,195813,4213,DAR
24,,DOUB,C,O,no,N,24,,195813,4213,DAR
25,,SING,C,OXT,no,N,25,,195813,4213,DAR
26,,SING,OXT,HXT,no,N,26,,195813,4213,DAR
1,,SING,N,CA,no,N,1,,195814,4213,DAS
2,,SING,N,H,no,N,2,,195814,4213,DAS
3,,SING,N,H2,no,N,3,,195814,4213,DAS
4,,SING,CA,C,no,N,4,,195814,4213,DAS
5,,SING,CA,CB,no,N,5,,195814,4213,DAS
6,,SING,CA,HA,no,N,6,,195814,4213,DAS
7,,DOUB,C,O,no,N,7,,195814,4213,DAS
8,,SING,C,OXT,no,N,8,,195814,4213,DAS
9,,SING,CB,CG,no,N,9,,195814,4213,DAS
10,,SING,CB,HB2,no,N,10,,195814,4213,DAS
11,,SING,CB,HB3,no,N,11,,195814,4213,DAS
12,,DOUB,CG,OD1,no,N,12,,195814,4213,DAS
13,,SING,CG,OD2,no,N,13,,195814,4213,DAS
14,,SING,OD2,HD2,no,N,14,,195814,4213,DAS
15,,SING,OXT,HXT,no,N,15,,195814,4213,DAS
1,,SING,N,CA,no,N,1,,195815,4213,DPN
2,,SING,N,H,no,N,2,,195815,4213,DPN
3,,SING,N,H2,no,N,3,,195815,4213,DPN
4,,SING,CA,C,no,N,4,,195815,4213,DPN
5,,SING,CA,CB,no,N,5,,195815,4213,DPN
6,,SING,CA,HA,no,N,6,,195815,4213,DPN
7,,DOUB,C,O,no,N,7,,195815,4213,DPN
8,,SING,C,OXT,no,N,8,,195815,4213,DPN
9,,SING,OXT,HXT,no,N,9,,195815,4213,DPN
10,,SING,CB,CG,no,N,10,,195815,4213,DPN
11,,SING,CB,HB2,no,N,11,,195815,4213,DPN
12,,SING,CB,HB3,no,N,12,,195815,4213,DPN
13,,DOUB,CG,CD1,yes,N,13,,195815,4213,DPN
14,,SING,CG,CD2,yes,N,14,,195815,4213,DPN
15,,SING,CD1,CE1,yes,N,15,,195815,4213,DPN
16,,SING,CD1,HD1,no,N,16,,195815,4213,DPN
17,,DOUB,CD2,CE2,yes,N,17,,195815,4213,DPN
18,,SING,CD2,HD2,no,N,18,,195815,4213,DPN
19,,DOUB,CE1,CZ,yes,N,19,,195815,4213,DPN
20,,SING,CE1,HE1,no,N,20,,195815,4213,DPN
21,,SING,CE2,CZ,yes,N,21,,195815,4213,DPN
22,,SING,CE2,HE2,no,N,22,,195815,4213,DPN
23,,SING,CZ,HZ,no,N,23,,195815,4213,DPN
1,,SING,N,CA,no,N,1,,195816,4213,DLE
2,,SING,N,H,no,N,2,,195816,4213,DLE
3,,SING,N,H2,no,N,3,,195816,4213,DLE
4,,SING,CA,CB,no,N,4,,195816,4213,DLE
5,,SING,CA,C,no,N,5,,195816,4213,DLE
6,,SING,CA,HA,no,N,6,,195816,4213,DLE
7,,SING,CB,CG,no,N,7,,195816,4213,DLE
8,,SING,CB,HB2,no,N,8,,195816,4213,DLE
9,,SING,CB,HB3,no,N,9,,195816,4213,DLE
10,,SING,CG,CD1,no,N,10,,195816,4213,DLE
11,,SING,CG,CD2,no,N,11,,195816,4213,DLE
12,,SING,CG,HG,no,N,12,,195816,4213,DLE
13,,SING,CD1,HD11,no,N,13,,195816,4213,DLE
14,,SING,CD1,HD12,no,N,14,,195816,4213,DLE
15,,SING,CD1,HD13,no,N,15,,195816,4213,DLE
16,,SING,CD2,HD21,no,N,16,,195816,4213,DLE
17,,SING,CD2,HD22,no,N,17,,195816,4213,DLE
18,,SING,CD2,HD23,no,N,18,,195816,4213,DLE
19,,DOUB,C,O,no,N,19,,195816,4213,DLE
20,,SING,C,OXT,no,N,20,,195816,4213,DLE
21,,SING,OXT,HXT,no,N,21,,195816,4213,DLE
1,,SING,N,CA,no,N,1,,195817,4213,DAL
2,,SING,N,H,no,N,2,,195817,4213,DAL
3,,SING,N,H2,no,N,3,,195817,4213,DAL
4,,SING,CA,CB,no,N,4,,195817,4213,DAL
5,,SING,CA,C,no,N,5,,195817,4213,DAL
6,,SING,CA,HA,no,N,6,,195817,4213,DAL
7,,SING,CB,HB1,no,N,7,,195817,4213,DAL
8,,SING,CB,HB2,no,N,8,,195817,4213,DAL
9,,SING,CB,HB3,no,N,9,,195817,4213,DAL
10,,DOUB,C,O,no,N,10,,195817,4213,DAL
11,,SING,C,OXT,no,N,11,,195817,4213,DAL
12,,SING,OXT,HXT,no,N,12,,195817,4213,DAL
1,,SING,N,CA,no,N,1,,195818,4213,DPR
2,,SING,N,CD,no,N,2,,195818,4213,DPR
3,,SING,N,H,no,N,3,,195818,4213,DPR
4,,SING,CA,CB,no,N,4,,195818,4213,DPR
5,,SING,CA,C,no,N,5,,195818,4213,DPR
6,,SING,CA,HA,no,N,6,,195818,4213,DPR
7,,SING,CB,CG,no,N,7,,195818,4213,DPR
8,,SING,CB,HB2,no,N,8,,195818,4213,DPR
9,,SING,CB,HB3,no,N,9,,195818,4213,DPR
10,,SING,CG,CD,no,N,10,,195818,4213,DPR
11,,SING,CG,HG2,no,N,11,,195818,4213,DPR
12,,SING,CG,HG3,no,N,12,,195818,4213,DPR
13,,SING,CD,HD2,no,N,13,,195818,4213,DPR
14,,SING,CD,HD3,no,N,14,,195818,4213,DPR
15,,DOUB,C,O,no,N,15,,195818,4213,DPR
16,,SING,C,OXT,no,N,16,,195818,4213,DPR
17,,SING,OXT,HXT,no,N,17,,195818,4213,DPR
1,,SING,N,HN1,no,N,1,,195819,4213,NH2
2,,SING,N,HN2,no,N,2,,195819,4213,NH2
1,,DOUB,C1,O1,no,N,1,,195820,4213,LML
2,,SING,C1,OXT,no,N,2,,195820,4213,LML
3,,SING,C1,CA,no,N,3,,195820,4213,LML
4,,SING,OXT,HXT,no,N,4,,195820,4213,LML
5,,SING,CA,CB,no,N,5,,195820,4213,LML
6,,SING,CA,C,no,N,6,,195820,4213,LML
7,,SING,CA,HA,no,N,7,,195820,4213,LML
8,,SING,CB,CG,no,N,8,,195820,4213,LML
9,,SING,CB,HB1,no,N,9,,195820,4213,LML
10,,SING,CB,HB2,no,N,10,,195820,4213,LML
11,,SING,CG,CD1,no,N,11,,195820,4213,LML
12,,SING,CG,CD2,no,N,12,,195820,4213,LML
13,,SING,CG,HG,no,N,13,,195820,4213,LML
14,,SING,CD1,HD11,no,N,14,,195820,4213,LML
15,,SING,CD1,HD12,no,N,15,,195820,4213,LML
16,,SING,CD1,HD13,no,N,16,,195820,4213,LML
17,,SING,CD2,HD21,no,N,17,,195820,4213,LML
18,,SING,CD2,HD22,no,N,18,,195820,4213,LML
19,,SING,CD2,HD23,no,N,19,,195820,4213,LML
20,,DOUB,C,O,no,N,20,,195820,4213,LML
21,,SING,C,O2,no,N,21,,195820,4213,LML
22,,SING,O2,HO2,no,N,22,,195820,4213,LML
1,,SING,N,HN1,no,N,1,,195899,4218,NH2
2,,SING,N,HN2,no,N,2,,195899,4218,NH2
1,,SING,N,CA,no,N,1,,195932,422,CY3
2,,SING,N,H,no,N,2,,195932,422,CY3
3,,SING,N,H2,no,N,3,,195932,422,CY3
4,,SING,CA,C,no,N,4,,195932,422,CY3
5,,SING,CA,CB,no,N,5,,195932,422,CY3
6,,SING,CA,HA,no,N,6,,195932,422,CY3
7,,DOUB,C,O,no,N,7,,195932,422,CY3
8,,SING,C,N1,no,N,8,,195932,422,CY3
9,,SING,CB,SG,no,N,9,,195932,422,CY3
10,,SING,CB,HB2,no,N,10,,195932,422,CY3
11,,SING,CB,HB3,no,N,11,,195932,422,CY3
12,,SING,SG,HG,no,N,12,,195932,422,CY3
13,,SING,N1,HN11,no,N,13,,195932,422,CY3
14,,SING,N1,HN12,no,N,14,,195932,422,CY3
1,,SING,N1,CA1,no,N,1,,196034,4225,GSH
2,,SING,N1,HN11,no,N,2,,196034,4225,GSH
3,,SING,N1,HN12,no,N,3,,196034,4225,GSH
4,,SING,CA1,C1,no,N,4,,196034,4225,GSH
5,,SING,CA1,CB1,no,N,5,,196034,4225,GSH
6,,SING,CA1,HA1,no,N,6,,196034,4225,GSH
7,,DOUB,C1,O11,no,N,7,,196034,4225,GSH
8,,SING,C1,O12,no,N,8,,196034,4225,GSH
9,,SING,O12,H12,no,N,9,,196034,4225,GSH
10,,SING,CB1,CG1,no,N,10,,196034,4225,GSH
11,,SING,CB1,HB12,no,N,11,,196034,4225,GSH
12,,SING,CB1,HB13,no,N,12,,196034,4225,GSH
13,,SING,CG1,CD1,no,N,13,,196034,4225,GSH
14,,SING,CG1,HG12,no,N,14,,196034,4225,GSH
15,,SING,CG1,HG13,no,N,15,,196034,4225,GSH
16,,DOUB,CD1,OE1,no,N,16,,196034,4225,GSH
17,,SING,CD1,N2,no,N,17,,196034,4225,GSH
18,,SING,N2,CA2,no,N,18,,196034,4225,GSH
19,,SING,N2,HN2,no,N,19,,196034,4225,GSH
20,,SING,CA2,C2,no,N,20,,196034,4225,GSH
21,,SING,CA2,CB2,no,N,21,,196034,4225,GSH
22,,SING,CA2,HA2,no,N,22,,196034,4225,GSH
23,,DOUB,C2,O2,no,N,23,,196034,4225,GSH
24,,SING,C2,N3,no,N,24,,196034,4225,GSH
25,,SING,CB2,SG2,no,N,25,,196034,4225,GSH
26,,SING,CB2,HB22,no,N,26,,196034,4225,GSH
27,,SING,CB2,HB23,no,N,27,,196034,4225,GSH
28,,SING,SG2,HSG,no,N,28,,196034,4225,GSH
29,,SING,N3,CA3,no,N,29,,196034,4225,GSH
30,,SING,N3,HN3,no,N,30,,196034,4225,GSH
31,,SING,CA3,C3,no,N,31,,196034,4225,GSH
32,,SING,CA3,HA31,no,N,32,,196034,4225,GSH
33,,SING,CA3,HA32,no,N,33,,196034,4225,GSH
34,,DOUB,C3,O31,no,N,34,,196034,4225,GSH
35,,SING,C3,O32,no,N,35,,196034,4225,GSH
36,,SING,O32,H32,no,N,36,,196034,4225,GSH
1,,SING,FE1,S2,no,N,1,,196107,4229,SF4
2,,SING,FE1,S3,no,N,2,,196107,4229,SF4
3,,SING,FE1,S4,no,N,3,,196107,4229,SF4
4,,SING,FE2,S1,no,N,4,,196107,4229,SF4
5,,SING,FE2,S3,no,N,5,,196107,4229,SF4
6,,SING,FE2,S4,no,N,6,,196107,4229,SF4
7,,SING,FE3,S1,no,N,7,,196107,4229,SF4
8,,SING,FE3,S2,no,N,8,,196107,4229,SF4
9,,SING,FE3,S4,no,N,9,,196107,4229,SF4
10,,SING,FE4,S1,no,N,10,,196107,4229,SF4
11,,SING,FE4,S2,no,N,11,,196107,4229,SF4
12,,SING,FE4,S3,no,N,12,,196107,4229,SF4
1,,SING,N,CA,no,N,1,,196125,423,CY3
2,,SING,N,H,no,N,2,,196125,423,CY3
3,,SING,N,H2,no,N,3,,196125,423,CY3
4,,SING,CA,C,no,N,4,,196125,423,CY3
5,,SING,CA,CB,no,N,5,,196125,423,CY3
6,,SING,CA,HA,no,N,6,,196125,423,CY3
7,,DOUB,C,O,no,N,7,,196125,423,CY3
8,,SING,C,N1,no,N,8,,196125,423,CY3
9,,SING,CB,SG,no,N,9,,196125,423,CY3
10,,SING,CB,HB2,no,N,10,,196125,423,CY3
11,,SING,CB,HB3,no,N,11,,196125,423,CY3
12,,SING,SG,HG,no,N,12,,196125,423,CY3
13,,SING,N1,HN11,no,N,13,,196125,423,CY3
14,,SING,N1,HN12,no,N,14,,196125,423,CY3
1,,DOUB,C09,C10,yes,N,1,,196142,4230,ASH
2,,SING,C10,C11,yes,N,2,,196142,4230,ASH
3,,SING,C10,H10,no,N,3,,196142,4230,ASH
4,,DOUB,C11,C12,yes,N,4,,196142,4230,ASH
5,,SING,C11,H11,no,N,5,,196142,4230,ASH
6,,SING,N13,C12,yes,N,6,,196142,4230,ASH
7,,SING,C12,H12,no,N,7,,196142,4230,ASH
8,,SING,C09,C14,yes,N,8,,196142,4230,ASH
9,,DOUB,C14,N13,yes,N,9,,196142,4230,ASH
10,,SING,C14,H14,no,N,10,,196142,4230,ASH
11,,SING,C05,C16,yes,N,11,,196142,4230,ASH
12,,SING,C16,N17,no,N,12,,196142,4230,ASH
13,,DOUB,C16,N15,yes,N,13,,196142,4230,ASH
14,,DOUB,C18,C19,yes,N,14,,196142,4230,ASH
15,,SING,C19,C20,yes,N,15,,196142,4230,ASH
16,,SING,C19,H19,no,N,16,,196142,4230,ASH
17,,SING,C28,C21,yes,N,17,,196142,4230,ASH
18,,DOUB,C21,C20,yes,N,18,,196142,4230,ASH
19,,SING,C21,N22,no,N,19,,196142,4230,ASH
20,,SING,C23,C24,no,N,20,,196142,4230,ASH
21,,SING,O25,C24,no,N,21,,196142,4230,ASH
22,,SING,C24,H24,no,N,22,,196142,4230,ASH
23,,SING,C24,H24A,no,N,23,,196142,4230,ASH
24,,SING,CL,C02,no,N,24,,196142,4230,ASH
25,,DOUB,C03,C02,yes,N,25,,196142,4230,ASH
26,,SING,C02,N06,yes,N,26,,196142,4230,ASH
27,,SING,C03,N04,yes,N,27,,196142,4230,ASH
28,,SING,C03,H03,no,N,28,,196142,4230,ASH
29,,DOUB,N04,C05,yes,N,29,,196142,4230,ASH
30,,SING,C05,N06,yes,N,30,,196142,4230,ASH
31,,SING,N06,C07,yes,N,31,,196142,4230,ASH
32,,DOUB,C07,C08,yes,N,32,,196142,4230,ASH
33,,SING,C07,H07,no,N,33,,196142,4230,ASH
34,,SING,C08,N15,yes,N,34,,196142,4230,ASH
35,,SING,C08,C09,yes,N,35,,196142,4230,ASH
36,,SING,N17,C18,no,N,36,,196142,4230,ASH
37,,SING,N17,HN17,no,N,37,,196142,4230,ASH
38,,SING,C29,C18,yes,N,38,,196142,4230,ASH
39,,SING,C20,H20,no,N,39,,196142,4230,ASH
40,,SING,C27,N22,no,N,40,,196142,4230,ASH
41,,SING,N22,C23,no,N,41,,196142,4230,ASH
42,,SING,C23,H23,no,N,42,,196142,4230,ASH
43,,SING,C23,H23A,no,N,43,,196142,4230,ASH
44,,SING,C26,O25,no,N,44,,196142,4230,ASH
45,,SING,C27,C26,no,N,45,,196142,4230,ASH
46,,SING,C26,H26,no,N,46,,196142,4230,ASH
47,,SING,C26,H26A,no,N,47,,196142,4230,ASH
48,,SING,C27,H27,no,N,48,,196142,4230,ASH
49,,SING,C27,H27A,no,N,49,,196142,4230,ASH
50,,DOUB,C29,C28,yes,N,50,,196142,4230,ASH
51,,SING,C28,H28,no,N,51,,196142,4230,ASH
52,,SING,C29,H29,no,N,52,,196142,4230,ASH
1,,SING,C1,C2,no,N,1,,196143,4230,NTH
2,,SING,C1,C10,no,N,2,,196143,4230,NTH
3,,SING,C1,H11,no,N,3,,196143,4230,NTH
4,,SING,C1,H12,no,N,4,,196143,4230,NTH
5,,SING,C2,C3,no,N,5,,196143,4230,NTH
6,,SING,C2,H21,no,N,6,,196143,4230,NTH
7,,SING,C2,H22,no,N,7,,196143,4230,NTH
8,,DOUB,C3,O3,no,N,8,,196143,4230,NTH
9,,SING,C3,C4,no,N,9,,196143,4230,NTH
10,,DOUB,C4,C5,no,N,10,,196143,4230,NTH
11,,SING,C4,H7,no,N,11,,196143,4230,NTH
12,,SING,C5,C6,no,N,12,,196143,4230,NTH
13,,SING,C5,C10,no,N,13,,196143,4230,NTH
14,,SING,C6,C7,no,N,14,,196143,4230,NTH
15,,SING,C6,H61,no,N,15,,196143,4230,NTH
16,,SING,C6,H62,no,N,16,,196143,4230,NTH
17,,SING,C7,C8,no,N,17,,196143,4230,NTH
18,,SING,C7,H71,no,N,18,,196143,4230,NTH
19,,SING,C7,H72,no,N,19,,196143,4230,NTH
20,,SING,C8,C9,no,N,20,,196143,4230,NTH
21,,SING,C8,C14,no,N,21,,196143,4230,NTH
22,,SING,C8,H8,no,N,22,,196143,4230,NTH
23,,SING,C9,C10,no,N,23,,196143,4230,NTH
24,,SING,C9,C11,no,N,24,,196143,4230,NTH
25,,SING,C9,H9,no,N,25,,196143,4230,NTH
26,,SING,C10,H10,no,N,26,,196143,4230,NTH
27,,SING,C11,C12,no,N,27,,196143,4230,NTH
28,,SING,C11,H111,no,N,28,,196143,4230,NTH
29,,SING,C11,H112,no,N,29,,196143,4230,NTH
30,,SING,C12,C13,no,N,30,,196143,4230,NTH
31,,SING,C12,H121,no,N,31,,196143,4230,NTH
32,,SING,C12,H122,no,N,32,,196143,4230,NTH
33,,SING,C13,C14,no,N,33,,196143,4230,NTH
34,,SING,C13,C17,no,N,34,,196143,4230,NTH
35,,SING,C13,C18,no,N,35,,196143,4230,NTH
36,,SING,C14,C15,no,N,36,,196143,4230,NTH
37,,SING,C14,H14,no,N,37,,196143,4230,NTH
38,,SING,C15,C16,no,N,38,,196143,4230,NTH
39,,SING,C15,H151,no,N,39,,196143,4230,NTH
40,,SING,C15,H152,no,N,40,,196143,4230,NTH
41,,SING,C16,C17,no,N,41,,196143,4230,NTH
42,,SING,C16,H161,no,N,42,,196143,4230,NTH
43,,SING,C16,H162,no,N,43,,196143,4230,NTH
44,,SING,C17,O17,no,N,44,,196143,4230,NTH
45,,SING,C17,H17,no,N,45,,196143,4230,NTH
46,,SING,O17,C20,no,N,46,,196143,4230,NTH
47,,SING,C18,H181,no,N,47,,196143,4230,NTH
48,,SING,C18,H182,no,N,48,,196143,4230,NTH
49,,SING,C18,H183,no,N,49,,196143,4230,NTH
50,,DOUB,C20,O20,no,N,50,,196143,4230,NTH
51,,SING,C20,C22,no,N,51,,196143,4230,NTH
52,,SING,C21,C22,no,N,52,,196143,4230,NTH
53,,SING,C21,C23,no,N,53,,196143,4230,NTH
54,,SING,C21,H221,no,N,54,,196143,4230,NTH
55,,SING,C21,H222,no,N,55,,196143,4230,NTH
56,,SING,C22,H211,no,N,56,,196143,4230,NTH
57,,SING,C22,H212,no,N,57,,196143,4230,NTH
58,,DOUB,C23,O23,no,N,58,,196143,4230,NTH
59,,SING,C23,O24,no,N,59,,196143,4230,NTH
60,,SING,O24,H24,no,N,60,,196143,4230,NTH
1,,SING,FE1,S2,no,N,1,,196160,4231,SF4
2,,SING,FE1,S3,no,N,2,,196160,4231,SF4
3,,SING,FE1,S4,no,N,3,,196160,4231,SF4
4,,SING,FE2,S1,no,N,4,,196160,4231,SF4
5,,SING,FE2,S3,no,N,5,,196160,4231,SF4
6,,SING,FE2,S4,no,N,6,,196160,4231,SF4
7,,SING,FE3,S1,no,N,7,,196160,4231,SF4
8,,SING,FE3,S2,no,N,8,,196160,4231,SF4
9,,SING,FE3,S4,no,N,9,,196160,4231,SF4
10,,SING,FE4,S1,no,N,10,,196160,4231,SF4
11,,SING,FE4,S2,no,N,11,,196160,4231,SF4
12,,SING,FE4,S3,no,N,12,,196160,4231,SF4
1,,DOUB,PA,O1A,no,N,1,,196251,4236,NAP
2,,SING,PA,O2A,no,N,2,,196251,4236,NAP
3,,SING,PA,O5B,no,N,3,,196251,4236,NAP
4,,SING,PA,O3,no,N,4,,196251,4236,NAP
5,,SING,O2A,HOA2,no,N,5,,196251,4236,NAP
6,,SING,O5B,C5B,no,N,6,,196251,4236,NAP
7,,SING,C5B,C4B,no,N,7,,196251,4236,NAP
8,,SING,C5B,H51A,no,N,8,,196251,4236,NAP
9,,SING,C5B,H52A,no,N,9,,196251,4236,NAP
10,,SING,C4B,O4B,no,N,10,,196251,4236,NAP
11,,SING,C4B,C3B,no,N,11,,196251,4236,NAP
12,,SING,C4B,H4B,no,N,12,,196251,4236,NAP
13,,SING,O4B,C1B,no,N,13,,196251,4236,NAP
14,,SING,C3B,O3B,no,N,14,,196251,4236,NAP
15,,SING,C3B,C2B,no,N,15,,196251,4236,NAP
16,,SING,C3B,H3B,no,N,16,,196251,4236,NAP
17,,SING,O3B,HO3A,no,N,17,,196251,4236,NAP
18,,SING,C2B,O2B,no,N,18,,196251,4236,NAP
19,,SING,C2B,C1B,no,N,19,,196251,4236,NAP
20,,SING,C2B,H2B,no,N,20,,196251,4236,NAP
21,,SING,O2B,P2B,no,N,21,,196251,4236,NAP
22,,SING,C1B,N9A,no,N,22,,196251,4236,NAP
23,,SING,C1B,H1B,no,N,23,,196251,4236,NAP
24,,SING,N9A,C8A,yes,N,24,,196251,4236,NAP
25,,SING,N9A,C4A,yes,N,25,,196251,4236,NAP
26,,DOUB,C8A,N7A,yes,N,26,,196251,4236,NAP
27,,SING,C8A,H8A,no,N,27,,196251,4236,NAP
28,,SING,N7A,C5A,yes,N,28,,196251,4236,NAP
29,,SING,C5A,C6A,yes,N,29,,196251,4236,NAP
30,,DOUB,C5A,C4A,yes,N,30,,196251,4236,NAP
31,,SING,C6A,N6A,no,N,31,,196251,4236,NAP
32,,DOUB,C6A,N1A,yes,N,32,,196251,4236,NAP
33,,SING,N6A,H61A,no,N,33,,196251,4236,NAP
34,,SING,N6A,H62A,no,N,34,,196251,4236,NAP
35,,SING,N1A,C2A,yes,N,35,,196251,4236,NAP
36,,DOUB,C2A,N3A,yes,N,36,,196251,4236,NAP
37,,SING,C2A,H2A,no,N,37,,196251,4236,NAP
38,,SING,N3A,C4A,yes,N,38,,196251,4236,NAP
39,,SING,O3,PN,no,N,39,,196251,4236,NAP
40,,DOUB,PN,O1N,no,N,40,,196251,4236,NAP
41,,SING,PN,O2N,no,N,41,,196251,4236,NAP
42,,SING,PN,O5D,no,N,42,,196251,4236,NAP
43,,SING,O5D,C5D,no,N,43,,196251,4236,NAP
44,,SING,C5D,C4D,no,N,44,,196251,4236,NAP
45,,SING,C5D,H51N,no,N,45,,196251,4236,NAP
46,,SING,C5D,H52N,no,N,46,,196251,4236,NAP
47,,SING,C4D,O4D,no,N,47,,196251,4236,NAP
48,,SING,C4D,C3D,no,N,48,,196251,4236,NAP
49,,SING,C4D,H4D,no,N,49,,196251,4236,NAP
50,,SING,O4D,C1D,no,N,50,,196251,4236,NAP
51,,SING,C3D,O3D,no,N,51,,196251,4236,NAP
52,,SING,C3D,C2D,no,N,52,,196251,4236,NAP
53,,SING,C3D,H3D,no,N,53,,196251,4236,NAP
54,,SING,O3D,HO3N,no,N,54,,196251,4236,NAP
55,,SING,C2D,O2D,no,N,55,,196251,4236,NAP
56,,SING,C2D,C1D,no,N,56,,196251,4236,NAP
57,,SING,C2D,H2D,no,N,57,,196251,4236,NAP
58,,SING,O2D,HO2N,no,N,58,,196251,4236,NAP
59,,SING,C1D,N1N,no,N,59,,196251,4236,NAP
60,,SING,C1D,H1D,no,N,60,,196251,4236,NAP
61,,SING,N1N,C2N,yes,N,61,,196251,4236,NAP
62,,DOUB,N1N,C6N,yes,N,62,,196251,4236,NAP
63,,DOUB,C2N,C3N,yes,N,63,,196251,4236,NAP
64,,SING,C2N,H2N,no,N,64,,196251,4236,NAP
65,,SING,C3N,C7N,no,N,65,,196251,4236,NAP
66,,SING,C3N,C4N,yes,N,66,,196251,4236,NAP
67,,DOUB,C7N,O7N,no,N,67,,196251,4236,NAP
68,,SING,C7N,N7N,no,N,68,,196251,4236,NAP
69,,SING,N7N,H71N,no,N,69,,196251,4236,NAP
70,,SING,N7N,H72N,no,N,70,,196251,4236,NAP
71,,DOUB,C4N,C5N,yes,N,71,,196251,4236,NAP
72,,SING,C4N,H4N,no,N,72,,196251,4236,NAP
73,,SING,C5N,C6N,yes,N,73,,196251,4236,NAP
74,,SING,C5N,H5N,no,N,74,,196251,4236,NAP
75,,SING,C6N,H6N,no,N,75,,196251,4236,NAP
76,,DOUB,P2B,O1X,no,N,76,,196251,4236,NAP
77,,SING,P2B,O2X,no,N,77,,196251,4236,NAP
78,,SING,P2B,O3X,no,N,78,,196251,4236,NAP
79,,SING,O2X,HOP2,no,N,79,,196251,4236,NAP
80,,SING,O3X,HOP3,no,N,80,,196251,4236,NAP
1,,DOUB,P,OP1,no,N,1,,196405,4244,ATD
2,,SING,P,OP2,no,N,2,,196405,4244,ATD
3,,SING,P,OP3,no,N,3,,196405,4244,ATD
4,,SING,P,O3',no,N,4,,196405,4244,ATD
5,,SING,OP2,HOP2,no,N,5,,196405,4244,ATD
6,,SING,OP3,HOP3,no,N,6,,196405,4244,ATD
7,,SING,O5',C5',no,N,7,,196405,4244,ATD
8,,SING,O5',HO'5,no,N,8,,196405,4244,ATD
9,,SING,C5',C4',no,N,9,,196405,4244,ATD
10,,SING,C5',H5',no,N,10,,196405,4244,ATD
11,,SING,C5',H5'',no,N,11,,196405,4244,ATD
12,,SING,C4',O4',no,N,12,,196405,4244,ATD
13,,SING,C4',C3',no,N,13,,196405,4244,ATD
14,,SING,C4',H4',no,N,14,,196405,4244,ATD
15,,SING,O4',C1',no,N,15,,196405,4244,ATD
16,,SING,C3',O3',no,N,16,,196405,4244,ATD
17,,SING,C3',C2',no,N,17,,196405,4244,ATD
18,,SING,C3',H3',no,N,18,,196405,4244,ATD
19,,SING,C2',C1',no,N,19,,196405,4244,ATD
20,,SING,C2',H2',no,N,20,,196405,4244,ATD
21,,SING,C2',H2'',no,N,21,,196405,4244,ATD
22,,SING,C1',N1,no,N,22,,196405,4244,ATD
23,,SING,C1',H1',no,N,23,,196405,4244,ATD
24,,SING,N1,C2,no,N,24,,196405,4244,ATD
25,,SING,N1,C6,no,N,25,,196405,4244,ATD
26,,DOUB,C2,O2,no,N,26,,196405,4244,ATD
27,,SING,C2,N3,no,N,27,,196405,4244,ATD
28,,SING,N3,C4,no,N,28,,196405,4244,ATD
29,,SING,N3,H3,no,N,29,,196405,4244,ATD
30,,DOUB,C4,O4,no,N,30,,196405,4244,ATD
31,,SING,C4,C5,no,N,31,,196405,4244,ATD
32,,SING,C5,C5M,no,N,32,,196405,4244,ATD
33,,DOUB,C5,C6,no,N,33,,196405,4244,ATD
34,,SING,C5M,H71,no,N,34,,196405,4244,ATD
35,,SING,C5M,H72,no,N,35,,196405,4244,ATD
36,,SING,C5M,H73,no,N,36,,196405,4244,ATD
37,,SING,C6,H6,no,N,37,,196405,4244,ATD
1,,DOUB,O,C,no,N,1,,196740,4260,LPD
2,,SING,C,N2,no,N,2,,196740,4260,LPD
3,,SING,C,CA,no,N,3,,196740,4260,LPD
4,,SING,N2,HN21,no,N,4,,196740,4260,LPD
5,,SING,N2,HN22,no,N,5,,196740,4260,LPD
6,,SING,CA,N,no,N,6,,196740,4260,LPD
7,,SING,CA,CB,no,N,7,,196740,4260,LPD
8,,SING,CA,HA,no,N,8,,196740,4260,LPD
9,,SING,N,CD,no,N,9,,196740,4260,LPD
10,,SING,N,H,no,N,10,,196740,4260,LPD
11,,SING,CD,CG,no,N,11,,196740,4260,LPD
12,,SING,CD,HD3,no,N,12,,196740,4260,LPD
13,,SING,CD,HD2,no,N,13,,196740,4260,LPD
14,,SING,CG,CB,no,N,14,,196740,4260,LPD
15,,SING,CG,HG3,no,N,15,,196740,4260,LPD
16,,SING,CG,HG2,no,N,16,,196740,4260,LPD
17,,SING,CB,HB2,no,N,17,,196740,4260,LPD
18,,SING,CB,HB3,no,N,18,,196740,4260,LPD
1,,SING,C1,C2,no,N,1,,196741,4260,NAG
2,,SING,C1,O1,no,N,2,,196741,4260,NAG
3,,SING,C1,O5,no,N,3,,196741,4260,NAG
4,,SING,C1,H1,no,N,4,,196741,4260,NAG
5,,SING,C2,C3,no,N,5,,196741,4260,NAG
6,,SING,C2,N2,no,N,6,,196741,4260,NAG
7,,SING,C2,H2,no,N,7,,196741,4260,NAG
8,,SING,C3,C4,no,N,8,,196741,4260,NAG
9,,SING,C3,O3,no,N,9,,196741,4260,NAG
10,,SING,C3,H3,no,N,10,,196741,4260,NAG
11,,SING,C4,C5,no,N,11,,196741,4260,NAG
12,,SING,C4,O4,no,N,12,,196741,4260,NAG
13,,SING,C4,H4,no,N,13,,196741,4260,NAG
14,,SING,C5,C6,no,N,14,,196741,4260,NAG
15,,SING,C5,O5,no,N,15,,196741,4260,NAG
16,,SING,C5,H5,no,N,16,,196741,4260,NAG
17,,SING,C6,O6,no,N,17,,196741,4260,NAG
18,,SING,C6,H61,no,N,18,,196741,4260,NAG
19,,SING,C6,H62,no,N,19,,196741,4260,NAG
20,,SING,C7,C8,no,N,20,,196741,4260,NAG
21,,SING,C7,N2,no,N,21,,196741,4260,NAG
22,,DOUB,C7,O7,no,N,22,,196741,4260,NAG
23,,SING,C8,H81,no,N,23,,196741,4260,NAG
24,,SING,C8,H82,no,N,24,,196741,4260,NAG
25,,SING,C8,H83,no,N,25,,196741,4260,NAG
26,,SING,N2,HN2,no,N,26,,196741,4260,NAG
27,,SING,O1,HO1,no,N,27,,196741,4260,NAG
28,,SING,O3,HO3,no,N,28,,196741,4260,NAG
29,,SING,O4,HO4,no,N,29,,196741,4260,NAG
30,,SING,O6,HO6,no,N,30,,196741,4260,NAG
1,,SING,C1,C2,no,N,1,,196760,4261,NAG
2,,SING,C1,O1,no,N,2,,196760,4261,NAG
3,,SING,C1,O5,no,N,3,,196760,4261,NAG
4,,SING,C1,H1,no,N,4,,196760,4261,NAG
5,,SING,C2,C3,no,N,5,,196760,4261,NAG
6,,SING,C2,N2,no,N,6,,196760,4261,NAG
7,,SING,C2,H2,no,N,7,,196760,4261,NAG
8,,SING,C3,C4,no,N,8,,196760,4261,NAG
9,,SING,C3,O3,no,N,9,,196760,4261,NAG
10,,SING,C3,H3,no,N,10,,196760,4261,NAG
11,,SING,C4,C5,no,N,11,,196760,4261,NAG
12,,SING,C4,O4,no,N,12,,196760,4261,NAG
13,,SING,C4,H4,no,N,13,,196760,4261,NAG
14,,SING,C5,C6,no,N,14,,196760,4261,NAG
15,,SING,C5,O5,no,N,15,,196760,4261,NAG
16,,SING,C5,H5,no,N,16,,196760,4261,NAG
17,,SING,C6,O6,no,N,17,,196760,4261,NAG
18,,SING,C6,H61,no,N,18,,196760,4261,NAG
19,,SING,C6,H62,no,N,19,,196760,4261,NAG
20,,SING,C7,C8,no,N,20,,196760,4261,NAG
21,,SING,C7,N2,no,N,21,,196760,4261,NAG
22,,DOUB,C7,O7,no,N,22,,196760,4261,NAG
23,,SING,C8,H81,no,N,23,,196760,4261,NAG
24,,SING,C8,H82,no,N,24,,196760,4261,NAG
25,,SING,C8,H83,no,N,25,,196760,4261,NAG
26,,SING,N2,HN2,no,N,26,,196760,4261,NAG
27,,SING,O1,HO1,no,N,27,,196760,4261,NAG
28,,SING,O3,HO3,no,N,28,,196760,4261,NAG
29,,SING,O4,HO4,no,N,29,,196760,4261,NAG
30,,SING,O6,HO6,no,N,30,,196760,4261,NAG
1,,DOUB,N1,C2,yes,N,1,,196776,4262,TMQ
2,,SING,N1,C3A,yes,N,2,,196776,4262,TMQ
3,,SING,N1,HN,no,N,3,,196776,4262,TMQ
4,,SING,C2,N3,yes,N,4,,196776,4262,TMQ
5,,SING,C2,N24,no,N,5,,196776,4262,TMQ
6,,DOUB,N3,C4,yes,N,6,,196776,4262,TMQ
7,,SING,C4,C4A,yes,N,7,,196776,4262,TMQ
8,,SING,C4,N25,no,N,8,,196776,4262,TMQ
9,,DOUB,C3A,C4A,yes,N,9,,196776,4262,TMQ
10,,SING,C3A,C8,yes,N,10,,196776,4262,TMQ
11,,SING,C4A,C5,yes,N,11,,196776,4262,TMQ
12,,DOUB,C5,C6,yes,N,12,,196776,4262,TMQ
13,,SING,C5,C17,no,N,13,,196776,4262,TMQ
14,,SING,C6,C7,yes,N,14,,196776,4262,TMQ
15,,SING,C6,C9,no,N,15,,196776,4262,TMQ
16,,DOUB,C7,C8,yes,N,16,,196776,4262,TMQ
17,,SING,C7,H7,no,N,17,,196776,4262,TMQ
18,,SING,C8,H8,no,N,18,,196776,4262,TMQ
19,,SING,C9,N10,no,N,19,,196776,4262,TMQ
20,,SING,C9,H91,no,N,20,,196776,4262,TMQ
21,,SING,C9,H92,no,N,21,,196776,4262,TMQ
22,,SING,N10,C11,no,N,22,,196776,4262,TMQ
23,,SING,N10,HN1,no,N,23,,196776,4262,TMQ
24,,DOUB,C11,C12,yes,N,24,,196776,4262,TMQ
25,,SING,C11,C16,yes,N,25,,196776,4262,TMQ
26,,SING,C12,C13,yes,N,26,,196776,4262,TMQ
27,,SING,C12,H12,no,N,27,,196776,4262,TMQ
28,,DOUB,C13,C14,yes,N,28,,196776,4262,TMQ
29,,SING,C13,O18,no,N,29,,196776,4262,TMQ
30,,SING,C14,C15,yes,N,30,,196776,4262,TMQ
31,,SING,C14,O19,no,N,31,,196776,4262,TMQ
32,,DOUB,C15,C16,yes,N,32,,196776,4262,TMQ
33,,SING,C15,O20,no,N,33,,196776,4262,TMQ
34,,SING,C16,H16,no,N,34,,196776,4262,TMQ
35,,SING,C17,H171,no,N,35,,196776,4262,TMQ
36,,SING,C17,H172,no,N,36,,196776,4262,TMQ
37,,SING,C17,H173,no,N,37,,196776,4262,TMQ
38,,SING,O18,C21,no,N,38,,196776,4262,TMQ
39,,SING,O19,C22,no,N,39,,196776,4262,TMQ
40,,SING,O20,C23,no,N,40,,196776,4262,TMQ
41,,SING,C21,H211,no,N,41,,196776,4262,TMQ
42,,SING,C21,H212,no,N,42,,196776,4262,TMQ
43,,SING,C21,H213,no,N,43,,196776,4262,TMQ
44,,SING,C22,H221,no,N,44,,196776,4262,TMQ
45,,SING,C22,H222,no,N,45,,196776,4262,TMQ
46,,SING,C22,H223,no,N,46,,196776,4262,TMQ
47,,SING,C23,H231,no,N,47,,196776,4262,TMQ
48,,SING,C23,H232,no,N,48,,196776,4262,TMQ
49,,SING,C23,H233,no,N,49,,196776,4262,TMQ
50,,SING,N24,HN21,no,N,50,,196776,4262,TMQ
51,,SING,N24,HN22,no,N,51,,196776,4262,TMQ
52,,SING,N25,HN51,no,N,52,,196776,4262,TMQ
53,,SING,N25,HN52,no,N,53,,196776,4262,TMQ
1,,SING,N,CA,no,N,1,,196804,4263,PTR
2,,SING,N,H,no,N,2,,196804,4263,PTR
3,,SING,N,HN2,no,N,3,,196804,4263,PTR
4,,SING,CA,C,no,N,4,,196804,4263,PTR
5,,SING,CA,CB,no,N,5,,196804,4263,PTR
6,,SING,CA,HA,no,N,6,,196804,4263,PTR
7,,DOUB,C,O,no,N,7,,196804,4263,PTR
8,,SING,C,OXT,no,N,8,,196804,4263,PTR
9,,SING,OXT,HXT,no,N,9,,196804,4263,PTR
10,,SING,CB,CG,no,N,10,,196804,4263,PTR
11,,SING,CB,HB2,no,N,11,,196804,4263,PTR
12,,SING,CB,HB3,no,N,12,,196804,4263,PTR
13,,DOUB,CG,CD1,yes,N,13,,196804,4263,PTR
14,,SING,CG,CD2,yes,N,14,,196804,4263,PTR
15,,SING,CD1,CE1,yes,N,15,,196804,4263,PTR
16,,SING,CD1,HD1,no,N,16,,196804,4263,PTR
17,,DOUB,CD2,CE2,yes,N,17,,196804,4263,PTR
18,,SING,CD2,HD2,no,N,18,,196804,4263,PTR
19,,DOUB,CE1,CZ,yes,N,19,,196804,4263,PTR
20,,SING,CE1,HE1,no,N,20,,196804,4263,PTR
21,,SING,CE2,CZ,yes,N,21,,196804,4263,PTR
22,,SING,CE2,HE2,no,N,22,,196804,4263,PTR
23,,SING,CZ,OH,no,N,23,,196804,4263,PTR
24,,SING,OH,P,no,N,24,,196804,4263,PTR
25,,DOUB,P,O1P,no,N,25,,196804,4263,PTR
26,,SING,P,O2P,no,N,26,,196804,4263,PTR
27,,SING,P,O3P,no,N,27,,196804,4263,PTR
28,,SING,O2P,HO2P,no,N,28,,196804,4263,PTR
29,,SING,O3P,HO3P,no,N,29,,196804,4263,PTR
1,,SING,FE1,S1,no,N,1,,196929,4268,F3S
2,,SING,FE1,S2,no,N,2,,196929,4268,F3S
3,,SING,FE1,S3,no,N,3,,196929,4268,F3S
4,,SING,FE3,S1,no,N,4,,196929,4268,F3S
5,,SING,FE3,S3,no,N,5,,196929,4268,F3S
6,,SING,FE3,S4,no,N,6,,196929,4268,F3S
7,,SING,FE4,S2,no,N,7,,196929,4268,F3S
8,,SING,FE4,S3,no,N,8,,196929,4268,F3S
9,,SING,FE4,S4,no,N,9,,196929,4268,F3S
1,,SING,FE1,S2,no,N,1,,196930,4268,SF4
2,,SING,FE1,S3,no,N,2,,196930,4268,SF4
3,,SING,FE1,S4,no,N,3,,196930,4268,SF4
4,,SING,FE2,S1,no,N,4,,196930,4268,SF4
5,,SING,FE2,S3,no,N,5,,196930,4268,SF4
6,,SING,FE2,S4,no,N,6,,196930,4268,SF4
7,,SING,FE3,S1,no,N,7,,196930,4268,SF4
8,,SING,FE3,S2,no,N,8,,196930,4268,SF4
9,,SING,FE3,S4,no,N,9,,196930,4268,SF4
10,,SING,FE4,S1,no,N,10,,196930,4268,SF4
11,,SING,FE4,S2,no,N,11,,196930,4268,SF4
12,,SING,FE4,S3,no,N,12,,196930,4268,SF4
1,,SING,C1,C2,no,N,1,,197059,4276,AMH
2,,SING,C1,C6,no,N,2,,197059,4276,AMH
3,,SING,C1,C8,no,N,3,,197059,4276,AMH
4,,SING,C1,H1,no,N,4,,197059,4276,AMH
5,,SING,C2,C3,no,N,5,,197059,4276,AMH
6,,SING,C2,H21,no,N,6,,197059,4276,AMH
7,,SING,C2,H22,no,N,7,,197059,4276,AMH
8,,SING,C3,C4,no,N,8,,197059,4276,AMH
9,,SING,C3,H31,no,N,9,,197059,4276,AMH
10,,SING,C3,H32,no,N,10,,197059,4276,AMH
11,,SING,C4,C5,no,N,11,,197059,4276,AMH
12,,SING,C4,C7,no,N,12,,197059,4276,AMH
13,,SING,C4,H4,no,N,13,,197059,4276,AMH
14,,SING,C5,C6,no,N,14,,197059,4276,AMH
15,,SING,C5,H51,no,N,15,,197059,4276,AMH
16,,SING,C5,H52,no,N,16,,197059,4276,AMH
17,,SING,C6,H61,no,N,17,,197059,4276,AMH
18,,SING,C6,H62,no,N,18,,197059,4276,AMH
19,,SING,C7,N,no,N,19,,197059,4276,AMH
20,,SING,C7,H71,no,N,20,,197059,4276,AMH
21,,SING,C7,H72,no,N,21,,197059,4276,AMH
22,,DOUB,C8,O1,no,N,22,,197059,4276,AMH
23,,SING,C8,O2,no,N,23,,197059,4276,AMH
24,,SING,N,HN1,no,N,24,,197059,4276,AMH
25,,SING,N,HN2,no,N,25,,197059,4276,AMH
26,,SING,O2,HO2,no,N,26,,197059,4276,AMH
1,,SING,N,HN1,no,N,1,,197105,4279,NH2
2,,SING,N,HN2,no,N,2,,197105,4279,NH2
1,,SING,N,CA,no,N,1,,197121,428,PCA
2,,SING,N,CD,no,N,2,,197121,428,PCA
3,,SING,N,H,no,N,3,,197121,428,PCA
4,,SING,CA,CB,no,N,4,,197121,428,PCA
5,,SING,CA,C,no,N,5,,197121,428,PCA
6,,SING,CA,HA,no,N,6,,197121,428,PCA
7,,SING,CB,CG,no,N,7,,197121,428,PCA
8,,SING,CB,HB2,no,N,8,,197121,428,PCA
9,,SING,CB,HB3,no,N,9,,197121,428,PCA
10,,SING,CG,CD,no,N,10,,197121,428,PCA
11,,SING,CG,HG2,no,N,11,,197121,428,PCA
12,,SING,CG,HG3,no,N,12,,197121,428,PCA
13,,DOUB,CD,OE,no,N,13,,197121,428,PCA
14,,DOUB,C,O,no,N,14,,197121,428,PCA
15,,SING,C,OXT,no,N,15,,197121,428,PCA
16,,SING,OXT,HXT,no,N,16,,197121,428,PCA
1,,SING,N,CA,no,N,1,,197349,429,PCA
2,,SING,N,CD,no,N,2,,197349,429,PCA
3,,SING,N,H,no,N,3,,197349,429,PCA
4,,SING,CA,CB,no,N,4,,197349,429,PCA
5,,SING,CA,C,no,N,5,,197349,429,PCA
6,,SING,CA,HA,no,N,6,,197349,429,PCA
7,,SING,CB,CG,no,N,7,,197349,429,PCA
8,,SING,CB,HB2,no,N,8,,197349,429,PCA
9,,SING,CB,HB3,no,N,9,,197349,429,PCA
10,,SING,CG,CD,no,N,10,,197349,429,PCA
11,,SING,CG,HG2,no,N,11,,197349,429,PCA
12,,SING,CG,HG3,no,N,12,,197349,429,PCA
13,,DOUB,CD,OE,no,N,13,,197349,429,PCA
14,,DOUB,C,O,no,N,14,,197349,429,PCA
15,,SING,C,OXT,no,N,15,,197349,429,PCA
16,,SING,OXT,HXT,no,N,16,,197349,429,PCA
1,,SING,FE,NA,no,N,1,,197382,4291,HEC
2,,SING,FE,NB,no,N,2,,197382,4291,HEC
3,,SING,FE,NC,no,N,3,,197382,4291,HEC
4,,SING,FE,ND,no,N,4,,197382,4291,HEC
5,,DOUB,CHA,C1A,no,N,5,,197382,4291,HEC
6,,SING,CHA,C4D,no,N,6,,197382,4291,HEC
7,,SING,CHA,HHA,no,N,7,,197382,4291,HEC
8,,DOUB,CHB,C4A,no,N,8,,197382,4291,HEC
9,,SING,CHB,C1B,no,N,9,,197382,4291,HEC
10,,SING,CHB,HHB,no,N,10,,197382,4291,HEC
11,,DOUB,CHC,C4B,no,N,11,,197382,4291,HEC
12,,SING,CHC,C1C,no,N,12,,197382,4291,HEC
13,,SING,CHC,HHC,no,N,13,,197382,4291,HEC
14,,DOUB,CHD,C4C,no,N,14,,197382,4291,HEC
15,,SING,CHD,C1D,no,N,15,,197382,4291,HEC
16,,SING,CHD,HHD,no,N,16,,197382,4291,HEC
17,,SING,NA,C1A,yes,N,17,,197382,4291,HEC
18,,SING,NA,C4A,yes,N,18,,197382,4291,HEC
19,,SING,C1A,C2A,yes,N,19,,197382,4291,HEC
20,,DOUB,C2A,C3A,yes,N,20,,197382,4291,HEC
21,,SING,C2A,CAA,no,N,21,,197382,4291,HEC
22,,SING,C3A,C4A,yes,N,22,,197382,4291,HEC
23,,SING,C3A,CMA,no,N,23,,197382,4291,HEC
24,,SING,CMA,HMA1,no,N,24,,197382,4291,HEC
25,,SING,CMA,HMA2,no,N,25,,197382,4291,HEC
26,,SING,CMA,HMA3,no,N,26,,197382,4291,HEC
27,,SING,CAA,CBA,no,N,27,,197382,4291,HEC
28,,SING,CAA,HAA1,no,N,28,,197382,4291,HEC
29,,SING,CAA,HAA2,no,N,29,,197382,4291,HEC
30,,SING,CBA,CGA,no,N,30,,197382,4291,HEC
31,,SING,CBA,HBA1,no,N,31,,197382,4291,HEC
32,,SING,CBA,HBA2,no,N,32,,197382,4291,HEC
33,,DOUB,CGA,O1A,no,N,33,,197382,4291,HEC
34,,SING,CGA,O2A,no,N,34,,197382,4291,HEC
35,,SING,O2A,H2A,no,N,35,,197382,4291,HEC
36,,SING,NB,C1B,yes,N,36,,197382,4291,HEC
37,,SING,NB,C4B,yes,N,37,,197382,4291,HEC
38,,DOUB,C1B,C2B,yes,N,38,,197382,4291,HEC
39,,SING,C2B,C3B,yes,N,39,,197382,4291,HEC
40,,SING,C2B,CMB,no,N,40,,197382,4291,HEC
41,,SING,C3B,C4B,yes,N,41,,197382,4291,HEC
42,,DOUB,C3B,CAB,no,E,42,,197382,4291,HEC
43,,SING,CMB,HMB1,no,N,43,,197382,4291,HEC
44,,SING,CMB,HMB2,no,N,44,,197382,4291,HEC
45,,SING,CMB,HMB3,no,N,45,,197382,4291,HEC
46,,SING,CAB,CBB,no,N,46,,197382,4291,HEC
47,,SING,CAB,HAB,no,N,47,,197382,4291,HEC
48,,SING,CBB,HBB1,no,N,48,,197382,4291,HEC
49,,SING,CBB,HBB2,no,N,49,,197382,4291,HEC
50,,SING,CBB,HBB3,no,N,50,,197382,4291,HEC
51,,SING,NC,C1C,yes,N,51,,197382,4291,HEC
52,,SING,NC,C4C,yes,N,52,,197382,4291,HEC
53,,DOUB,C1C,C2C,yes,N,53,,197382,4291,HEC
54,,SING,C2C,C3C,yes,N,54,,197382,4291,HEC
55,,SING,C2C,CMC,no,N,55,,197382,4291,HEC
56,,SING,C3C,C4C,yes,N,56,,197382,4291,HEC
57,,DOUB,C3C,CAC,no,E,57,,197382,4291,HEC
58,,SING,CMC,HMC1,no,N,58,,197382,4291,HEC
59,,SING,CMC,HMC2,no,N,59,,197382,4291,HEC
60,,SING,CMC,HMC3,no,N,60,,197382,4291,HEC
61,,SING,CAC,CBC,no,N,61,,197382,4291,HEC
62,,SING,CAC,HAC,no,N,62,,197382,4291,HEC
63,,SING,CBC,HBC1,no,N,63,,197382,4291,HEC
64,,SING,CBC,HBC2,no,N,64,,197382,4291,HEC
65,,SING,CBC,HBC3,no,N,65,,197382,4291,HEC
66,,SING,ND,C1D,yes,N,66,,197382,4291,HEC
67,,SING,ND,C4D,yes,N,67,,197382,4291,HEC
68,,DOUB,C1D,C2D,yes,N,68,,197382,4291,HEC
69,,SING,C2D,C3D,yes,N,69,,197382,4291,HEC
70,,SING,C2D,CMD,no,N,70,,197382,4291,HEC
71,,DOUB,C3D,C4D,yes,N,71,,197382,4291,HEC
72,,SING,C3D,CAD,no,N,72,,197382,4291,HEC
73,,SING,CMD,HMD1,no,N,73,,197382,4291,HEC
74,,SING,CMD,HMD2,no,N,74,,197382,4291,HEC
75,,SING,CMD,HMD3,no,N,75,,197382,4291,HEC
76,,SING,CAD,CBD,no,N,76,,197382,4291,HEC
77,,SING,CAD,HAD1,no,N,77,,197382,4291,HEC
78,,SING,CAD,HAD2,no,N,78,,197382,4291,HEC
79,,SING,CBD,CGD,no,N,79,,197382,4291,HEC
80,,SING,CBD,HBD1,no,N,80,,197382,4291,HEC
81,,SING,CBD,HBD2,no,N,81,,197382,4291,HEC
82,,DOUB,CGD,O1D,no,N,82,,197382,4291,HEC
83,,SING,CGD,O2D,no,N,83,,197382,4291,HEC
84,,SING,O2D,H2D,no,N,84,,197382,4291,HEC
1,,SING,N,CA,no,N,1,,197560,430,PCA
2,,SING,N,CD,no,N,2,,197560,430,PCA
3,,SING,N,H,no,N,3,,197560,430,PCA
4,,SING,CA,CB,no,N,4,,197560,430,PCA
5,,SING,CA,C,no,N,5,,197560,430,PCA
6,,SING,CA,HA,no,N,6,,197560,430,PCA
7,,SING,CB,CG,no,N,7,,197560,430,PCA
8,,SING,CB,HB2,no,N,8,,197560,430,PCA
9,,SING,CB,HB3,no,N,9,,197560,430,PCA
10,,SING,CG,CD,no,N,10,,197560,430,PCA
11,,SING,CG,HG2,no,N,11,,197560,430,PCA
12,,SING,CG,HG3,no,N,12,,197560,430,PCA
13,,DOUB,CD,OE,no,N,13,,197560,430,PCA
14,,DOUB,C,O,no,N,14,,197560,430,PCA
15,,SING,C,OXT,no,N,15,,197560,430,PCA
16,,SING,OXT,HXT,no,N,16,,197560,430,PCA
1,,SING,N1A,C2A,yes,N,1,,198015,4321,COA
2,,DOUB,N1A,C6A,yes,N,2,,198015,4321,COA
3,,DOUB,C2A,N3A,yes,N,3,,198015,4321,COA
4,,SING,C2A,H2A,no,N,4,,198015,4321,COA
5,,SING,N3A,C4A,yes,N,5,,198015,4321,COA
6,,DOUB,C4A,C5A,yes,N,6,,198015,4321,COA
7,,SING,C4A,N9A,yes,N,7,,198015,4321,COA
8,,SING,C5A,C6A,yes,N,8,,198015,4321,COA
9,,SING,C5A,N7A,yes,N,9,,198015,4321,COA
10,,SING,C6A,N6A,no,N,10,,198015,4321,COA
11,,SING,N6A,H61A,no,N,11,,198015,4321,COA
12,,SING,N6A,H62A,no,N,12,,198015,4321,COA
13,,DOUB,N7A,C8A,yes,N,13,,198015,4321,COA
14,,SING,C8A,N9A,yes,N,14,,198015,4321,COA
15,,SING,C8A,H8A,no,N,15,,198015,4321,COA
16,,SING,N9A,C1B,no,N,16,,198015,4321,COA
17,,SING,C1B,C2B,no,N,17,,198015,4321,COA
18,,SING,C1B,O4B,no,N,18,,198015,4321,COA
19,,SING,C1B,H1B,no,N,19,,198015,4321,COA
20,,SING,C2B,O2B,no,N,20,,198015,4321,COA
21,,SING,C2B,C3B,no,N,21,,198015,4321,COA
22,,SING,C2B,H2B,no,N,22,,198015,4321,COA
23,,SING,O2B,HO2A,no,N,23,,198015,4321,COA
24,,SING,C3B,O3B,no,N,24,,198015,4321,COA
25,,SING,C3B,C4B,no,N,25,,198015,4321,COA
26,,SING,C3B,H3B,no,N,26,,198015,4321,COA
27,,SING,O3B,P3B,no,N,27,,198015,4321,COA
28,,DOUB,P3B,O7A,no,N,28,,198015,4321,COA
29,,SING,P3B,O8A,no,N,29,,198015,4321,COA
30,,SING,P3B,O9A,no,N,30,,198015,4321,COA
31,,SING,O8A,HOA8,no,N,31,,198015,4321,COA
32,,SING,O9A,HOA9,no,N,32,,198015,4321,COA
33,,SING,C4B,O4B,no,N,33,,198015,4321,COA
34,,SING,C4B,C5B,no,N,34,,198015,4321,COA
35,,SING,C4B,H4B,no,N,35,,198015,4321,COA
36,,SING,C5B,O5B,no,N,36,,198015,4321,COA
37,,SING,C5B,H51A,no,N,37,,198015,4321,COA
38,,SING,C5B,H52A,no,N,38,,198015,4321,COA
39,,SING,O5B,P1A,no,N,39,,198015,4321,COA
40,,DOUB,P1A,O1A,no,N,40,,198015,4321,COA
41,,SING,P1A,O2A,no,N,41,,198015,4321,COA
42,,SING,P1A,O3A,no,N,42,,198015,4321,COA
43,,SING,O2A,HOA2,no,N,43,,198015,4321,COA
44,,SING,O3A,P2A,no,N,44,,198015,4321,COA
45,,DOUB,P2A,O4A,no,N,45,,198015,4321,COA
46,,SING,P2A,O5A,no,N,46,,198015,4321,COA
47,,SING,P2A,O6A,no,N,47,,198015,4321,COA
48,,SING,O5A,HOA5,no,N,48,,198015,4321,COA
49,,SING,O6A,CCP,no,N,49,,198015,4321,COA
50,,SING,CBP,CCP,no,N,50,,198015,4321,COA
51,,SING,CBP,CDP,no,N,51,,198015,4321,COA
52,,SING,CBP,CEP,no,N,52,,198015,4321,COA
53,,SING,CBP,CAP,no,N,53,,198015,4321,COA
54,,SING,CCP,H121,no,N,54,,198015,4321,COA
55,,SING,CCP,H122,no,N,55,,198015,4321,COA
56,,SING,CDP,H131,no,N,56,,198015,4321,COA
57,,SING,CDP,H132,no,N,57,,198015,4321,COA
58,,SING,CDP,H133,no,N,58,,198015,4321,COA
59,,SING,CEP,H141,no,N,59,,198015,4321,COA
60,,SING,CEP,H142,no,N,60,,198015,4321,COA
61,,SING,CEP,H143,no,N,61,,198015,4321,COA
62,,SING,CAP,OAP,no,N,62,,198015,4321,COA
63,,SING,CAP,C9P,no,N,63,,198015,4321,COA
64,,SING,CAP,H10,no,N,64,,198015,4321,COA
65,,SING,OAP,HO1,no,N,65,,198015,4321,COA
66,,DOUB,C9P,O9P,no,N,66,,198015,4321,COA
67,,SING,C9P,N8P,no,N,67,,198015,4321,COA
68,,SING,N8P,C7P,no,N,68,,198015,4321,COA
69,,SING,N8P,HN8,no,N,69,,198015,4321,COA
70,,SING,C7P,C6P,no,N,70,,198015,4321,COA
71,,SING,C7P,H71,no,N,71,,198015,4321,COA
72,,SING,C7P,H72,no,N,72,,198015,4321,COA
73,,SING,C6P,C5P,no,N,73,,198015,4321,COA
74,,SING,C6P,H61,no,N,74,,198015,4321,COA
75,,SING,C6P,H62,no,N,75,,198015,4321,COA
76,,DOUB,C5P,O5P,no,N,76,,198015,4321,COA
77,,SING,C5P,N4P,no,N,77,,198015,4321,COA
78,,SING,N4P,C3P,no,N,78,,198015,4321,COA
79,,SING,N4P,HN4,no,N,79,,198015,4321,COA
80,,SING,C3P,C2P,no,N,80,,198015,4321,COA
81,,SING,C3P,H31,no,N,81,,198015,4321,COA
82,,SING,C3P,H32,no,N,82,,198015,4321,COA
83,,SING,C2P,S1P,no,N,83,,198015,4321,COA
84,,SING,C2P,H21,no,N,84,,198015,4321,COA
85,,SING,C2P,H22,no,N,85,,198015,4321,COA
86,,SING,S1P,HS1,no,N,86,,198015,4321,COA
1,,DOUB,PA,O1A,no,N,1,,198144,4329,NAP
2,,SING,PA,O2A,no,N,2,,198144,4329,NAP
3,,SING,PA,O5B,no,N,3,,198144,4329,NAP
4,,SING,PA,O3,no,N,4,,198144,4329,NAP
5,,SING,O2A,HOA2,no,N,5,,198144,4329,NAP
6,,SING,O5B,C5B,no,N,6,,198144,4329,NAP
7,,SING,C5B,C4B,no,N,7,,198144,4329,NAP
8,,SING,C5B,H51A,no,N,8,,198144,4329,NAP
9,,SING,C5B,H52A,no,N,9,,198144,4329,NAP
10,,SING,C4B,O4B,no,N,10,,198144,4329,NAP
11,,SING,C4B,C3B,no,N,11,,198144,4329,NAP
12,,SING,C4B,H4B,no,N,12,,198144,4329,NAP
13,,SING,O4B,C1B,no,N,13,,198144,4329,NAP
14,,SING,C3B,O3B,no,N,14,,198144,4329,NAP
15,,SING,C3B,C2B,no,N,15,,198144,4329,NAP
16,,SING,C3B,H3B,no,N,16,,198144,4329,NAP
17,,SING,O3B,HO3A,no,N,17,,198144,4329,NAP
18,,SING,C2B,O2B,no,N,18,,198144,4329,NAP
19,,SING,C2B,C1B,no,N,19,,198144,4329,NAP
20,,SING,C2B,H2B,no,N,20,,198144,4329,NAP
21,,SING,O2B,P2B,no,N,21,,198144,4329,NAP
22,,SING,C1B,N9A,no,N,22,,198144,4329,NAP
23,,SING,C1B,H1B,no,N,23,,198144,4329,NAP
24,,SING,N9A,C8A,yes,N,24,,198144,4329,NAP
25,,SING,N9A,C4A,yes,N,25,,198144,4329,NAP
26,,DOUB,C8A,N7A,yes,N,26,,198144,4329,NAP
27,,SING,C8A,H8A,no,N,27,,198144,4329,NAP
28,,SING,N7A,C5A,yes,N,28,,198144,4329,NAP
29,,SING,C5A,C6A,yes,N,29,,198144,4329,NAP
30,,DOUB,C5A,C4A,yes,N,30,,198144,4329,NAP
31,,SING,C6A,N6A,no,N,31,,198144,4329,NAP
32,,DOUB,C6A,N1A,yes,N,32,,198144,4329,NAP
33,,SING,N6A,H61A,no,N,33,,198144,4329,NAP
34,,SING,N6A,H62A,no,N,34,,198144,4329,NAP
35,,SING,N1A,C2A,yes,N,35,,198144,4329,NAP
36,,DOUB,C2A,N3A,yes,N,36,,198144,4329,NAP
37,,SING,C2A,H2A,no,N,37,,198144,4329,NAP
38,,SING,N3A,C4A,yes,N,38,,198144,4329,NAP
39,,SING,O3,PN,no,N,39,,198144,4329,NAP
40,,DOUB,PN,O1N,no,N,40,,198144,4329,NAP
41,,SING,PN,O2N,no,N,41,,198144,4329,NAP
42,,SING,PN,O5D,no,N,42,,198144,4329,NAP
43,,SING,O5D,C5D,no,N,43,,198144,4329,NAP
44,,SING,C5D,C4D,no,N,44,,198144,4329,NAP
45,,SING,C5D,H51N,no,N,45,,198144,4329,NAP
46,,SING,C5D,H52N,no,N,46,,198144,4329,NAP
47,,SING,C4D,O4D,no,N,47,,198144,4329,NAP
48,,SING,C4D,C3D,no,N,48,,198144,4329,NAP
49,,SING,C4D,H4D,no,N,49,,198144,4329,NAP
50,,SING,O4D,C1D,no,N,50,,198144,4329,NAP
51,,SING,C3D,O3D,no,N,51,,198144,4329,NAP
52,,SING,C3D,C2D,no,N,52,,198144,4329,NAP
53,,SING,C3D,H3D,no,N,53,,198144,4329,NAP
54,,SING,O3D,HO3N,no,N,54,,198144,4329,NAP
55,,SING,C2D,O2D,no,N,55,,198144,4329,NAP
56,,SING,C2D,C1D,no,N,56,,198144,4329,NAP
57,,SING,C2D,H2D,no,N,57,,198144,4329,NAP
58,,SING,O2D,HO2N,no,N,58,,198144,4329,NAP
59,,SING,C1D,N1N,no,N,59,,198144,4329,NAP
60,,SING,C1D,H1D,no,N,60,,198144,4329,NAP
61,,SING,N1N,C2N,yes,N,61,,198144,4329,NAP
62,,DOUB,N1N,C6N,yes,N,62,,198144,4329,NAP
63,,DOUB,C2N,C3N,yes,N,63,,198144,4329,NAP
64,,SING,C2N,H2N,no,N,64,,198144,4329,NAP
65,,SING,C3N,C7N,no,N,65,,198144,4329,NAP
66,,SING,C3N,C4N,yes,N,66,,198144,4329,NAP
67,,DOUB,C7N,O7N,no,N,67,,198144,4329,NAP
68,,SING,C7N,N7N,no,N,68,,198144,4329,NAP
69,,SING,N7N,H71N,no,N,69,,198144,4329,NAP
70,,SING,N7N,H72N,no,N,70,,198144,4329,NAP
71,,DOUB,C4N,C5N,yes,N,71,,198144,4329,NAP
72,,SING,C4N,H4N,no,N,72,,198144,4329,NAP
73,,SING,C5N,C6N,yes,N,73,,198144,4329,NAP
74,,SING,C5N,H5N,no,N,74,,198144,4329,NAP
75,,SING,C6N,H6N,no,N,75,,198144,4329,NAP
76,,DOUB,P2B,O1X,no,N,76,,198144,4329,NAP
77,,SING,P2B,O2X,no,N,77,,198144,4329,NAP
78,,SING,P2B,O3X,no,N,78,,198144,4329,NAP
79,,SING,O2X,HOP2,no,N,79,,198144,4329,NAP
80,,SING,O3X,HOP3,no,N,80,,198144,4329,NAP
1,,SING,O,H1,no,N,1,,198210,4332,HOH
2,,SING,O,H2,no,N,2,,198210,4332,HOH
1,,DOUB,O1,C1,no,N,1,,198310,4337,LPA
2,,SING,O2,C1,no,N,2,,198310,4337,LPA
3,,SING,O2,HO2,no,N,3,,198310,4337,LPA
4,,SING,C1,C2,no,N,4,,198310,4337,LPA
5,,SING,C2,C3,no,N,5,,198310,4337,LPA
6,,SING,C2,H21,no,N,6,,198310,4337,LPA
7,,SING,C2,H22,no,N,7,,198310,4337,LPA
8,,SING,C3,C4,no,N,8,,198310,4337,LPA
9,,SING,C3,H31,no,N,9,,198310,4337,LPA
10,,SING,C3,H32,no,N,10,,198310,4337,LPA
11,,SING,C4,C5,no,N,11,,198310,4337,LPA
12,,SING,C4,H41,no,N,12,,198310,4337,LPA
13,,SING,C4,H42,no,N,13,,198310,4337,LPA
14,,SING,C5,C6,no,N,14,,198310,4337,LPA
15,,SING,C5,H51,no,N,15,,198310,4337,LPA
16,,SING,C5,H52,no,N,16,,198310,4337,LPA
17,,SING,C6,C7,no,N,17,,198310,4337,LPA
18,,SING,C6,S6,no,N,18,,198310,4337,LPA
19,,SING,C6,H6,no,N,19,,198310,4337,LPA
20,,SING,C7,C8,no,N,20,,198310,4337,LPA
21,,SING,C7,H71,no,N,21,,198310,4337,LPA
22,,SING,C7,H72,no,N,22,,198310,4337,LPA
23,,SING,C8,S8,no,N,23,,198310,4337,LPA
24,,SING,C8,H81,no,N,24,,198310,4337,LPA
25,,SING,C8,H82,no,N,25,,198310,4337,LPA
26,,SING,S8,S6,no,N,26,,198310,4337,LPA
1,,SING,O,H1,no,N,1,,198416,4341,HOH
2,,SING,O,H2,no,N,2,,198416,4341,HOH
1,,DOUB,C,O,no,N,1,,198540,4347,ACE
2,,SING,C,CH3,no,N,2,,198540,4347,ACE
3,,SING,C,H,no,N,3,,198540,4347,ACE
4,,SING,CH3,H1,no,N,4,,198540,4347,ACE
5,,SING,CH3,H2,no,N,5,,198540,4347,ACE
6,,SING,CH3,H3,no,N,6,,198540,4347,ACE
1,,SING,N,HN1,no,N,1,,198541,4347,NH2
2,,SING,N,HN2,no,N,2,,198541,4347,NH2
1,,DOUB,C1,C2,yes,N,1,,198584,4349,NPO
2,,SING,C1,C6,yes,N,2,,198584,4349,NPO
3,,SING,C1,N1,no,N,3,,198584,4349,NPO
4,,SING,C2,C3,yes,N,4,,198584,4349,NPO
5,,SING,C2,H2,no,N,5,,198584,4349,NPO
6,,DOUB,C3,C4,yes,N,6,,198584,4349,NPO
7,,SING,C3,H3,no,N,7,,198584,4349,NPO
8,,SING,C4,C5,yes,N,8,,198584,4349,NPO
9,,SING,C4,OH,no,N,9,,198584,4349,NPO
10,,DOUB,C5,C6,yes,N,10,,198584,4349,NPO
11,,SING,C5,H5,no,N,11,,198584,4349,NPO
12,,SING,C6,H6,no,N,12,,198584,4349,NPO
13,,SING,OH,HO,no,N,13,,198584,4349,NPO
14,,SING,N1,O2,no,N,14,,198584,4349,NPO
15,,DOUB,N1,O3,no,N,15,,198584,4349,NPO
1,,SING,C11,C21,no,N,1,,198694,4354,BCD
2,,SING,C11,O51,no,N,2,,198694,4354,BCD
3,,SING,C11,O47,no,N,3,,198694,4354,BCD
4,,SING,C11,H11,no,N,4,,198694,4354,BCD
5,,SING,C21,O21,no,N,5,,198694,4354,BCD
6,,SING,C21,C31,no,N,6,,198694,4354,BCD
7,,SING,C21,H21,no,N,7,,198694,4354,BCD
8,,SING,O21,HO21,no,N,8,,198694,4354,BCD
9,,SING,C31,O31,no,N,9,,198694,4354,BCD
10,,SING,C31,C41,no,N,10,,198694,4354,BCD
11,,SING,C31,H31,no,N,11,,198694,4354,BCD
12,,SING,O31,HO31,no,N,12,,198694,4354,BCD
13,,SING,C41,O41,no,N,13,,198694,4354,BCD
14,,SING,C41,C51,no,N,14,,198694,4354,BCD
15,,SING,C41,H41,no,N,15,,198694,4354,BCD
16,,SING,O41,C12,no,N,16,,198694,4354,BCD
17,,SING,C51,O51,no,N,17,,198694,4354,BCD
18,,SING,C51,C61,no,N,18,,198694,4354,BCD
19,,SING,C51,H51,no,N,19,,198694,4354,BCD
20,,SING,C61,O61,no,N,20,,198694,4354,BCD
21,,SING,C61,H611,no,N,21,,198694,4354,BCD
22,,SING,C61,H612,no,N,22,,198694,4354,BCD
23,,SING,O61,HO61,no,N,23,,198694,4354,BCD
24,,SING,C12,C22,no,N,24,,198694,4354,BCD
25,,SING,C12,O52,no,N,25,,198694,4354,BCD
26,,SING,C12,H12,no,N,26,,198694,4354,BCD
27,,SING,C22,O22,no,N,27,,198694,4354,BCD
28,,SING,C22,C32,no,N,28,,198694,4354,BCD
29,,SING,C22,H22,no,N,29,,198694,4354,BCD
30,,SING,O22,HO22,no,N,30,,198694,4354,BCD
31,,SING,C32,O32,no,N,31,,198694,4354,BCD
32,,SING,C32,C42,no,N,32,,198694,4354,BCD
33,,SING,C32,H32,no,N,33,,198694,4354,BCD
34,,SING,O32,HO32,no,N,34,,198694,4354,BCD
35,,SING,C42,O42,no,N,35,,198694,4354,BCD
36,,SING,C42,C52,no,N,36,,198694,4354,BCD
37,,SING,C42,H42,no,N,37,,198694,4354,BCD
38,,SING,O42,C13,no,N,38,,198694,4354,BCD
39,,SING,C52,O52,no,N,39,,198694,4354,BCD
40,,SING,C52,C62,no,N,40,,198694,4354,BCD
41,,SING,C52,H52,no,N,41,,198694,4354,BCD
42,,SING,C62,O62,no,N,42,,198694,4354,BCD
43,,SING,C62,H621,no,N,43,,198694,4354,BCD
44,,SING,C62,H622,no,N,44,,198694,4354,BCD
45,,SING,O62,HO62,no,N,45,,198694,4354,BCD
46,,SING,C13,C23,no,N,46,,198694,4354,BCD
47,,SING,C13,O53,no,N,47,,198694,4354,BCD
48,,SING,C13,H13,no,N,48,,198694,4354,BCD
49,,SING,C23,O23,no,N,49,,198694,4354,BCD
50,,SING,C23,C33,no,N,50,,198694,4354,BCD
51,,SING,C23,H23,no,N,51,,198694,4354,BCD
52,,SING,O23,HO23,no,N,52,,198694,4354,BCD
53,,SING,C33,O33,no,N,53,,198694,4354,BCD
54,,SING,C33,C43,no,N,54,,198694,4354,BCD
55,,SING,C33,H33,no,N,55,,198694,4354,BCD
56,,SING,O33,HO33,no,N,56,,198694,4354,BCD
57,,SING,C43,O43,no,N,57,,198694,4354,BCD
58,,SING,C43,C53,no,N,58,,198694,4354,BCD
59,,SING,C43,H43,no,N,59,,198694,4354,BCD
60,,SING,O43,C14,no,N,60,,198694,4354,BCD
61,,SING,C53,O53,no,N,61,,198694,4354,BCD
62,,SING,C53,C63,no,N,62,,198694,4354,BCD
63,,SING,C53,H53,no,N,63,,198694,4354,BCD
64,,SING,C63,O63,no,N,64,,198694,4354,BCD
65,,SING,C63,H631,no,N,65,,198694,4354,BCD
66,,SING,C63,H632,no,N,66,,198694,4354,BCD
67,,SING,O63,HO63,no,N,67,,198694,4354,BCD
68,,SING,C14,C24,no,N,68,,198694,4354,BCD
69,,SING,C14,O54,no,N,69,,198694,4354,BCD
70,,SING,C14,H14,no,N,70,,198694,4354,BCD
71,,SING,C24,O24,no,N,71,,198694,4354,BCD
72,,SING,C24,C34,no,N,72,,198694,4354,BCD
73,,SING,C24,H24,no,N,73,,198694,4354,BCD
74,,SING,O24,HO24,no,N,74,,198694,4354,BCD
75,,SING,C34,O34,no,N,75,,198694,4354,BCD
76,,SING,C34,C44,no,N,76,,198694,4354,BCD
77,,SING,C34,H34,no,N,77,,198694,4354,BCD
78,,SING,O34,HO34,no,N,78,,198694,4354,BCD
79,,SING,C44,O44,no,N,79,,198694,4354,BCD
80,,SING,C44,C54,no,N,80,,198694,4354,BCD
81,,SING,C44,H44,no,N,81,,198694,4354,BCD
82,,SING,O44,C15,no,N,82,,198694,4354,BCD
83,,SING,C54,O54,no,N,83,,198694,4354,BCD
84,,SING,C54,C64,no,N,84,,198694,4354,BCD
85,,SING,C54,H54,no,N,85,,198694,4354,BCD
86,,SING,C64,O64,no,N,86,,198694,4354,BCD
87,,SING,C64,H641,no,N,87,,198694,4354,BCD
88,,SING,C64,H642,no,N,88,,198694,4354,BCD
89,,SING,O64,HO64,no,N,89,,198694,4354,BCD
90,,SING,C15,C25,no,N,90,,198694,4354,BCD
91,,SING,C15,O55,no,N,91,,198694,4354,BCD
92,,SING,C15,H15,no,N,92,,198694,4354,BCD
93,,SING,C25,O25,no,N,93,,198694,4354,BCD
94,,SING,C25,C35,no,N,94,,198694,4354,BCD
95,,SING,C25,H25,no,N,95,,198694,4354,BCD
96,,SING,O25,HO25,no,N,96,,198694,4354,BCD
97,,SING,C35,O35,no,N,97,,198694,4354,BCD
98,,SING,C35,C45,no,N,98,,198694,4354,BCD
99,,SING,C35,H35,no,N,99,,198694,4354,BCD
100,,SING,O35,HO35,no,N,100,,198694,4354,BCD
101,,SING,C45,O45,no,N,101,,198694,4354,BCD
102,,SING,C45,C55,no,N,102,,198694,4354,BCD
103,,SING,C45,H45,no,N,103,,198694,4354,BCD
104,,SING,O45,C16,no,N,104,,198694,4354,BCD
105,,SING,C55,O55,no,N,105,,198694,4354,BCD
106,,SING,C55,C65,no,N,106,,198694,4354,BCD
107,,SING,C55,H55,no,N,107,,198694,4354,BCD
108,,SING,C65,O65,no,N,108,,198694,4354,BCD
109,,SING,C65,H651,no,N,109,,198694,4354,BCD
110,,SING,C65,H652,no,N,110,,198694,4354,BCD
111,,SING,O65,HO65,no,N,111,,198694,4354,BCD
112,,SING,C16,C26,no,N,112,,198694,4354,BCD
113,,SING,C16,O56,no,N,113,,198694,4354,BCD
114,,SING,C16,H16,no,N,114,,198694,4354,BCD
115,,SING,C26,O26,no,N,115,,198694,4354,BCD
116,,SING,C26,C36,no,N,116,,198694,4354,BCD
117,,SING,C26,H26,no,N,117,,198694,4354,BCD
118,,SING,O26,HO26,no,N,118,,198694,4354,BCD
119,,SING,C36,O36,no,N,119,,198694,4354,BCD
120,,SING,C36,C46,no,N,120,,198694,4354,BCD
121,,SING,C36,H36,no,N,121,,198694,4354,BCD
122,,SING,O36,HO36,no,N,122,,198694,4354,BCD
123,,SING,C46,O46,no,N,123,,198694,4354,BCD
124,,SING,C46,C56,no,N,124,,198694,4354,BCD
125,,SING,C46,H46,no,N,125,,198694,4354,BCD
126,,SING,O46,C17,no,N,126,,198694,4354,BCD
127,,SING,C56,O56,no,N,127,,198694,4354,BCD
128,,SING,C56,C66,no,N,128,,198694,4354,BCD
129,,SING,C56,H56,no,N,129,,198694,4354,BCD
130,,SING,C66,O66,no,N,130,,198694,4354,BCD
131,,SING,C66,H661,no,N,131,,198694,4354,BCD
132,,SING,C66,H662,no,N,132,,198694,4354,BCD
133,,SING,O66,HO66,no,N,133,,198694,4354,BCD
134,,SING,C17,C27,no,N,134,,198694,4354,BCD
135,,SING,C17,O57,no,N,135,,198694,4354,BCD
136,,SING,C17,H17,no,N,136,,198694,4354,BCD
137,,SING,C27,O27,no,N,137,,198694,4354,BCD
138,,SING,C27,C37,no,N,138,,198694,4354,BCD
139,,SING,C27,H27,no,N,139,,198694,4354,BCD
140,,SING,O27,HO27,no,N,140,,198694,4354,BCD
141,,SING,C37,O37,no,N,141,,198694,4354,BCD
142,,SING,C37,C47,no,N,142,,198694,4354,BCD
143,,SING,C37,H37,no,N,143,,198694,4354,BCD
144,,SING,O37,HO37,no,N,144,,198694,4354,BCD
145,,SING,C47,O47,no,N,145,,198694,4354,BCD
146,,SING,C47,C57,no,N,146,,198694,4354,BCD
147,,SING,C47,H47,no,N,147,,198694,4354,BCD
148,,SING,C57,O57,no,N,148,,198694,4354,BCD
149,,SING,C57,C67,no,N,149,,198694,4354,BCD
150,,SING,C57,H57,no,N,150,,198694,4354,BCD
151,,SING,C67,O67,no,N,151,,198694,4354,BCD
152,,SING,C67,H671,no,N,152,,198694,4354,BCD
153,,SING,C67,H672,no,N,153,,198694,4354,BCD
154,,SING,O67,HO67,no,N,154,,198694,4354,BCD
1,,SING,C1,C2,no,N,1,,198794,436,AAC
2,,SING,C1,O1,no,N,2,,198794,436,AAC
3,,DOUB,C1,O2,no,N,3,,198794,436,AAC
4,,SING,C2,N1,no,N,4,,198794,436,AAC
5,,SING,C2,HC21,no,N,5,,198794,436,AAC
6,,SING,C2,HC22,no,N,6,,198794,436,AAC
7,,SING,C3,C4,no,N,7,,198794,436,AAC
8,,SING,C3,N1,no,N,8,,198794,436,AAC
9,,DOUB,C3,O3,no,N,9,,198794,436,AAC
10,,SING,C4,HC41,no,N,10,,198794,436,AAC
11,,SING,C4,HC42,no,N,11,,198794,436,AAC
12,,SING,C4,HC43,no,N,12,,198794,436,AAC
13,,SING,N1,HN1,no,N,13,,198794,436,AAC
14,,SING,O1,HO1,no,N,14,,198794,436,AAC
1,,SING,FE,NA,no,N,1,,198795,436,HEC
2,,SING,FE,NB,no,N,2,,198795,436,HEC
3,,SING,FE,NC,no,N,3,,198795,436,HEC
4,,SING,FE,ND,no,N,4,,198795,436,HEC
5,,DOUB,CHA,C1A,no,N,5,,198795,436,HEC
6,,SING,CHA,C4D,no,N,6,,198795,436,HEC
7,,SING,CHA,HHA,no,N,7,,198795,436,HEC
8,,DOUB,CHB,C4A,no,N,8,,198795,436,HEC
9,,SING,CHB,C1B,no,N,9,,198795,436,HEC
10,,SING,CHB,HHB,no,N,10,,198795,436,HEC
11,,DOUB,CHC,C4B,no,N,11,,198795,436,HEC
12,,SING,CHC,C1C,no,N,12,,198795,436,HEC
13,,SING,CHC,HHC,no,N,13,,198795,436,HEC
14,,DOUB,CHD,C4C,no,N,14,,198795,436,HEC
15,,SING,CHD,C1D,no,N,15,,198795,436,HEC
16,,SING,CHD,HHD,no,N,16,,198795,436,HEC
17,,SING,NA,C1A,yes,N,17,,198795,436,HEC
18,,SING,NA,C4A,yes,N,18,,198795,436,HEC
19,,SING,C1A,C2A,yes,N,19,,198795,436,HEC
20,,DOUB,C2A,C3A,yes,N,20,,198795,436,HEC
21,,SING,C2A,CAA,no,N,21,,198795,436,HEC
22,,SING,C3A,C4A,yes,N,22,,198795,436,HEC
23,,SING,C3A,CMA,no,N,23,,198795,436,HEC
24,,SING,CMA,HMA1,no,N,24,,198795,436,HEC
25,,SING,CMA,HMA2,no,N,25,,198795,436,HEC
26,,SING,CMA,HMA3,no,N,26,,198795,436,HEC
27,,SING,CAA,CBA,no,N,27,,198795,436,HEC
28,,SING,CAA,HAA1,no,N,28,,198795,436,HEC
29,,SING,CAA,HAA2,no,N,29,,198795,436,HEC
30,,SING,CBA,CGA,no,N,30,,198795,436,HEC
31,,SING,CBA,HBA1,no,N,31,,198795,436,HEC
32,,SING,CBA,HBA2,no,N,32,,198795,436,HEC
33,,DOUB,CGA,O1A,no,N,33,,198795,436,HEC
34,,SING,CGA,O2A,no,N,34,,198795,436,HEC
35,,SING,O2A,H2A,no,N,35,,198795,436,HEC
36,,SING,NB,C1B,yes,N,36,,198795,436,HEC
37,,SING,NB,C4B,yes,N,37,,198795,436,HEC
38,,DOUB,C1B,C2B,yes,N,38,,198795,436,HEC
39,,SING,C2B,C3B,yes,N,39,,198795,436,HEC
40,,SING,C2B,CMB,no,N,40,,198795,436,HEC
41,,SING,C3B,C4B,yes,N,41,,198795,436,HEC
42,,DOUB,C3B,CAB,no,E,42,,198795,436,HEC
43,,SING,CMB,HMB1,no,N,43,,198795,436,HEC
44,,SING,CMB,HMB2,no,N,44,,198795,436,HEC
45,,SING,CMB,HMB3,no,N,45,,198795,436,HEC
46,,SING,CAB,CBB,no,N,46,,198795,436,HEC
47,,SING,CAB,HAB,no,N,47,,198795,436,HEC
48,,SING,CBB,HBB1,no,N,48,,198795,436,HEC
49,,SING,CBB,HBB2,no,N,49,,198795,436,HEC
50,,SING,CBB,HBB3,no,N,50,,198795,436,HEC
51,,SING,NC,C1C,yes,N,51,,198795,436,HEC
52,,SING,NC,C4C,yes,N,52,,198795,436,HEC
53,,DOUB,C1C,C2C,yes,N,53,,198795,436,HEC
54,,SING,C2C,C3C,yes,N,54,,198795,436,HEC
55,,SING,C2C,CMC,no,N,55,,198795,436,HEC
56,,SING,C3C,C4C,yes,N,56,,198795,436,HEC
57,,DOUB,C3C,CAC,no,E,57,,198795,436,HEC
58,,SING,CMC,HMC1,no,N,58,,198795,436,HEC
59,,SING,CMC,HMC2,no,N,59,,198795,436,HEC
60,,SING,CMC,HMC3,no,N,60,,198795,436,HEC
61,,SING,CAC,CBC,no,N,61,,198795,436,HEC
62,,SING,CAC,HAC,no,N,62,,198795,436,HEC
63,,SING,CBC,HBC1,no,N,63,,198795,436,HEC
64,,SING,CBC,HBC2,no,N,64,,198795,436,HEC
65,,SING,CBC,HBC3,no,N,65,,198795,436,HEC
66,,SING,ND,C1D,yes,N,66,,198795,436,HEC
67,,SING,ND,C4D,yes,N,67,,198795,436,HEC
68,,DOUB,C1D,C2D,yes,N,68,,198795,436,HEC
69,,SING,C2D,C3D,yes,N,69,,198795,436,HEC
70,,SING,C2D,CMD,no,N,70,,198795,436,HEC
71,,DOUB,C3D,C4D,yes,N,71,,198795,436,HEC
72,,SING,C3D,CAD,no,N,72,,198795,436,HEC
73,,SING,CMD,HMD1,no,N,73,,198795,436,HEC
74,,SING,CMD,HMD2,no,N,74,,198795,436,HEC
75,,SING,CMD,HMD3,no,N,75,,198795,436,HEC
76,,SING,CAD,CBD,no,N,76,,198795,436,HEC
77,,SING,CAD,HAD1,no,N,77,,198795,436,HEC
78,,SING,CAD,HAD2,no,N,78,,198795,436,HEC
79,,SING,CBD,CGD,no,N,79,,198795,436,HEC
80,,SING,CBD,HBD1,no,N,80,,198795,436,HEC
81,,SING,CBD,HBD2,no,N,81,,198795,436,HEC
82,,DOUB,CGD,O1D,no,N,82,,198795,436,HEC
83,,SING,CGD,O2D,no,N,83,,198795,436,HEC
84,,SING,O2D,H2D,no,N,84,,198795,436,HEC
1,,SING,O1,C1,no,N,1,,198831,4361,1GL
2,,SING,O1,HO1,no,N,2,,198831,4361,1GL
3,,SING,C1,C2,no,N,3,,198831,4361,1GL
4,,SING,C1,O5,no,N,4,,198831,4361,1GL
5,,SING,C1,H1,no,N,5,,198831,4361,1GL
6,,SING,C2,C3,no,N,6,,198831,4361,1GL
7,,SING,C2,H21,no,N,7,,198831,4361,1GL
8,,SING,C2,H22,no,N,8,,198831,4361,1GL
9,,SING,C3,O3,no,N,9,,198831,4361,1GL
10,,SING,C3,C4,no,N,10,,198831,4361,1GL
11,,SING,C3,H3,no,N,11,,198831,4361,1GL
12,,SING,O3,HO3,no,N,12,,198831,4361,1GL
13,,SING,C4,O4,no,N,13,,198831,4361,1GL
14,,SING,C4,C5,no,N,14,,198831,4361,1GL
15,,SING,C4,H4,no,N,15,,198831,4361,1GL
16,,SING,O4,CME,no,N,16,,198831,4361,1GL
17,,SING,CME,HM41,no,N,17,,198831,4361,1GL
18,,SING,CME,HM42,no,N,18,,198831,4361,1GL
19,,SING,CME,HM43,no,N,19,,198831,4361,1GL
20,,SING,C5,O5,no,N,20,,198831,4361,1GL
21,,SING,C5,C6,no,N,21,,198831,4361,1GL
22,,SING,C5,H5,no,N,22,,198831,4361,1GL
23,,SING,C6,H61,no,N,23,,198831,4361,1GL
24,,SING,C6,H62,no,N,24,,198831,4361,1GL
25,,SING,C6,H63,no,N,25,,198831,4361,1GL
1,,SING,O5,C1,no,N,1,,198832,4361,2GL
2,,SING,O1,HO1,no,N,2,,198832,4361,2GL
3,,SING,C1,C2,no,N,3,,198832,4361,2GL
4,,SING,C1,O1,no,N,4,,198832,4361,2GL
5,,SING,C1,H1,no,N,5,,198832,4361,2GL
6,,SING,C2,C3,no,N,6,,198832,4361,2GL
7,,SING,C2,H21,no,N,7,,198832,4361,2GL
8,,SING,C2,H22,no,N,8,,198832,4361,2GL
9,,SING,C3,O3,no,N,9,,198832,4361,2GL
10,,SING,C3,C4,no,N,10,,198832,4361,2GL
11,,SING,C3,H3,no,N,11,,198832,4361,2GL
12,,SING,O3,HO3,no,N,12,,198832,4361,2GL
13,,SING,C4,O4,no,N,13,,198832,4361,2GL
14,,SING,C4,C5,no,N,14,,198832,4361,2GL
15,,SING,C4,H4,no,N,15,,198832,4361,2GL
16,,SING,O4,CO4,no,N,16,,198832,4361,2GL
17,,SING,CME,CO4,no,N,17,,198832,4361,2GL
18,,SING,CME,HM41,no,N,18,,198832,4361,2GL
19,,SING,CME,HM42,no,N,19,,198832,4361,2GL
20,,SING,CME,HM43,no,N,20,,198832,4361,2GL
21,,DOUB,CO4,OC4,no,N,21,,198832,4361,2GL
22,,SING,C5,O5,no,N,22,,198832,4361,2GL
23,,SING,C5,C6,no,N,23,,198832,4361,2GL
24,,SING,C5,H5,no,N,24,,198832,4361,2GL
25,,SING,C6,H61,no,N,25,,198832,4361,2GL
26,,SING,C6,H62,no,N,26,,198832,4361,2GL
27,,SING,C6,H63,no,N,27,,198832,4361,2GL
1,,SING,O1,C1,no,N,1,,198833,4361,1AR
2,,SING,O1,HO1,no,N,2,,198833,4361,1AR
3,,SING,C1,C2,no,N,3,,198833,4361,1AR
4,,SING,C1,O5,no,N,4,,198833,4361,1AR
5,,SING,C1,H1,no,N,5,,198833,4361,1AR
6,,SING,C2,C3,no,N,6,,198833,4361,1AR
7,,SING,C2,H21,no,N,7,,198833,4361,1AR
8,,SING,C2,H22,no,N,8,,198833,4361,1AR
9,,SING,C3,O3,no,N,9,,198833,4361,1AR
10,,SING,C3,CC3,no,N,10,,198833,4361,1AR
11,,SING,C3,C4,no,N,11,,198833,4361,1AR
12,,SING,O3,HO3,no,N,12,,198833,4361,1AR
13,,SING,CC3,HM31,no,N,13,,198833,4361,1AR
14,,SING,CC3,HM32,no,N,14,,198833,4361,1AR
15,,SING,CC3,HM33,no,N,15,,198833,4361,1AR
16,,SING,C4,O4,no,N,16,,198833,4361,1AR
17,,SING,C4,C5,no,N,17,,198833,4361,1AR
18,,SING,C4,H4,no,N,18,,198833,4361,1AR
19,,SING,O4,CO4,no,N,19,,198833,4361,1AR
20,,SING,CME,CO4,no,N,20,,198833,4361,1AR
21,,SING,CME,HM41,no,N,21,,198833,4361,1AR
22,,SING,CME,HM42,no,N,22,,198833,4361,1AR
23,,SING,CME,HM43,no,N,23,,198833,4361,1AR
24,,DOUB,CO4,OC4,no,N,24,,198833,4361,1AR
25,,SING,C5,O5,no,N,25,,198833,4361,1AR
26,,SING,C5,C6,no,N,26,,198833,4361,1AR
27,,SING,C5,H5,no,N,27,,198833,4361,1AR
28,,SING,C6,H61,no,N,28,,198833,4361,1AR
29,,SING,C6,H62,no,N,29,,198833,4361,1AR
30,,SING,C6,H63,no,N,30,,198833,4361,1AR
1,,SING,C1,C2,no,N,1,,198834,4361,DDA
2,,SING,C1,O5,no,N,2,,198834,4361,DDA
3,,SING,C1,O1,no,N,3,,198834,4361,DDA
4,,SING,C1,H1,no,N,4,,198834,4361,DDA
5,,SING,C2,C3,no,N,5,,198834,4361,DDA
6,,SING,C2,H21,no,N,6,,198834,4361,DDA
7,,SING,C2,H22,no,N,7,,198834,4361,DDA
8,,SING,C3,C4,no,N,8,,198834,4361,DDA
9,,SING,C3,O3,no,N,9,,198834,4361,DDA
10,,SING,C3,H3,no,N,10,,198834,4361,DDA
11,,SING,C4,C5,no,N,11,,198834,4361,DDA
12,,SING,C4,O4,no,N,12,,198834,4361,DDA
13,,SING,C4,H4,no,N,13,,198834,4361,DDA
14,,SING,C5,C6,no,N,14,,198834,4361,DDA
15,,SING,C5,O5,no,N,15,,198834,4361,DDA
16,,SING,C5,H5,no,N,16,,198834,4361,DDA
17,,SING,C6,H61,no,N,17,,198834,4361,DDA
18,,SING,C6,H62,no,N,18,,198834,4361,DDA
19,,SING,C6,H63,no,N,19,,198834,4361,DDA
20,,SING,O1,HO1,no,N,20,,198834,4361,DDA
21,,SING,O3,HO3,no,N,21,,198834,4361,DDA
22,,SING,O4,HO4,no,N,22,,198834,4361,DDA
1,,DOUB,C1,O1,no,N,1,,198835,4361,DXB
2,,SING,C1,C9A,no,N,2,,198835,4361,DXB
3,,SING,C1,C2,no,N,3,,198835,4361,DXB
4,,DOUB,C9A,C4A,yes,N,4,,198835,4361,DXB
5,,SING,C9A,C9,yes,N,5,,198835,4361,DXB
6,,SING,C2,C3,no,N,6,,198835,4361,DXB
7,,SING,C2,H21,no,N,7,,198835,4361,DXB
8,,SING,C2,H22,no,N,8,,198835,4361,DXB
9,,SING,C3,C4,no,N,9,,198835,4361,DXB
10,,SING,C3,C1S,no,N,10,,198835,4361,DXB
11,,SING,C3,H3,no,N,11,,198835,4361,DXB
12,,SING,C4,C4A,no,N,12,,198835,4361,DXB
13,,SING,C4,H4A,no,N,13,,198835,4361,DXB
14,,SING,C4,H4E,no,N,14,,198835,4361,DXB
15,,SING,C4A,C10,yes,N,15,,198835,4361,DXB
16,,DOUB,C10,C5A,yes,N,16,,198835,4361,DXB
17,,SING,C10,H10,no,N,17,,198835,4361,DXB
18,,SING,C5A,C5,yes,N,18,,198835,4361,DXB
19,,SING,C5A,C8A,yes,N,19,,198835,4361,DXB
20,,DOUB,C5,C6,yes,N,20,,198835,4361,DXB
21,,SING,C5,H5,no,N,21,,198835,4361,DXB
22,,SING,C6,C7,yes,N,22,,198835,4361,DXB
23,,SING,C6,H6,no,N,23,,198835,4361,DXB
24,,SING,C7,CC7,no,N,24,,198835,4361,DXB
25,,DOUB,C7,C8,yes,N,25,,198835,4361,DXB
26,,SING,CC7,HM71,no,N,26,,198835,4361,DXB
27,,SING,CC7,HM72,no,N,27,,198835,4361,DXB
28,,SING,CC7,HM73,no,N,28,,198835,4361,DXB
29,,SING,C8,O8,no,N,29,,198835,4361,DXB
30,,SING,C8,C8A,yes,N,30,,198835,4361,DXB
31,,SING,O8,HO8,no,N,31,,198835,4361,DXB
32,,DOUB,C8A,C9,yes,N,32,,198835,4361,DXB
33,,SING,C9,O9,no,N,33,,198835,4361,DXB
34,,SING,O9,HO9,no,N,34,,198835,4361,DXB
35,,SING,CME,O1S,no,N,35,,198835,4361,DXB
36,,SING,CME,HM11,no,N,36,,198835,4361,DXB
37,,SING,CME,HM12,no,N,37,,198835,4361,DXB
38,,SING,CME,HM13,no,N,38,,198835,4361,DXB
39,,SING,C1S,O1S,no,N,39,,198835,4361,DXB
40,,SING,C1S,C2S,no,N,40,,198835,4361,DXB
41,,SING,C1S,HS1,no,N,41,,198835,4361,DXB
42,,DOUB,C2S,O2S,no,N,42,,198835,4361,DXB
43,,SING,C2S,C3S,no,N,43,,198835,4361,DXB
44,,SING,C3S,O3S,no,N,44,,198835,4361,DXB
45,,SING,C3S,C4S,no,N,45,,198835,4361,DXB
46,,SING,C3S,HS3,no,N,46,,198835,4361,DXB
47,,SING,O3S,HO3,no,N,47,,198835,4361,DXB
48,,SING,C4S,O4S,no,N,48,,198835,4361,DXB
49,,SING,C4S,C5S,no,N,49,,198835,4361,DXB
50,,SING,C4S,HS4,no,N,50,,198835,4361,DXB
51,,SING,O4S,HO4,no,N,51,,198835,4361,DXB
52,,SING,C5S,HM51,no,N,52,,198835,4361,DXB
53,,SING,C5S,HM52,no,N,53,,198835,4361,DXB
54,,SING,C5S,HM53,no,N,54,,198835,4361,DXB
1,,SING,O1,C1,no,N,1,,198855,4362,1GL
2,,SING,O1,HO1,no,N,2,,198855,4362,1GL
3,,SING,C1,C2,no,N,3,,198855,4362,1GL
4,,SING,C1,O5,no,N,4,,198855,4362,1GL
5,,SING,C1,H1,no,N,5,,198855,4362,1GL
6,,SING,C2,C3,no,N,6,,198855,4362,1GL
7,,SING,C2,H21,no,N,7,,198855,4362,1GL
8,,SING,C2,H22,no,N,8,,198855,4362,1GL
9,,SING,C3,O3,no,N,9,,198855,4362,1GL
10,,SING,C3,C4,no,N,10,,198855,4362,1GL
11,,SING,C3,H3,no,N,11,,198855,4362,1GL
12,,SING,O3,HO3,no,N,12,,198855,4362,1GL
13,,SING,C4,O4,no,N,13,,198855,4362,1GL
14,,SING,C4,C5,no,N,14,,198855,4362,1GL
15,,SING,C4,H4,no,N,15,,198855,4362,1GL
16,,SING,O4,CME,no,N,16,,198855,4362,1GL
17,,SING,CME,HM41,no,N,17,,198855,4362,1GL
18,,SING,CME,HM42,no,N,18,,198855,4362,1GL
19,,SING,CME,HM43,no,N,19,,198855,4362,1GL
20,,SING,C5,O5,no,N,20,,198855,4362,1GL
21,,SING,C5,C6,no,N,21,,198855,4362,1GL
22,,SING,C5,H5,no,N,22,,198855,4362,1GL
23,,SING,C6,H61,no,N,23,,198855,4362,1GL
24,,SING,C6,H62,no,N,24,,198855,4362,1GL
25,,SING,C6,H63,no,N,25,,198855,4362,1GL
1,,SING,O5,C1,no,N,1,,198856,4362,2GL
2,,SING,O1,HO1,no,N,2,,198856,4362,2GL
3,,SING,C1,C2,no,N,3,,198856,4362,2GL
4,,SING,C1,O1,no,N,4,,198856,4362,2GL
5,,SING,C1,H1,no,N,5,,198856,4362,2GL
6,,SING,C2,C3,no,N,6,,198856,4362,2GL
7,,SING,C2,H21,no,N,7,,198856,4362,2GL
8,,SING,C2,H22,no,N,8,,198856,4362,2GL
9,,SING,C3,O3,no,N,9,,198856,4362,2GL
10,,SING,C3,C4,no,N,10,,198856,4362,2GL
11,,SING,C3,H3,no,N,11,,198856,4362,2GL
12,,SING,O3,HO3,no,N,12,,198856,4362,2GL
13,,SING,C4,O4,no,N,13,,198856,4362,2GL
14,,SING,C4,C5,no,N,14,,198856,4362,2GL
15,,SING,C4,H4,no,N,15,,198856,4362,2GL
16,,SING,O4,CO4,no,N,16,,198856,4362,2GL
17,,SING,CME,CO4,no,N,17,,198856,4362,2GL
18,,SING,CME,HM41,no,N,18,,198856,4362,2GL
19,,SING,CME,HM42,no,N,19,,198856,4362,2GL
20,,SING,CME,HM43,no,N,20,,198856,4362,2GL
21,,DOUB,CO4,OC4,no,N,21,,198856,4362,2GL
22,,SING,C5,O5,no,N,22,,198856,4362,2GL
23,,SING,C5,C6,no,N,23,,198856,4362,2GL
24,,SING,C5,H5,no,N,24,,198856,4362,2GL
25,,SING,C6,H61,no,N,25,,198856,4362,2GL
26,,SING,C6,H62,no,N,26,,198856,4362,2GL
27,,SING,C6,H63,no,N,27,,198856,4362,2GL
1,,SING,O1,C1,no,N,1,,198857,4362,1AR
2,,SING,O1,HO1,no,N,2,,198857,4362,1AR
3,,SING,C1,C2,no,N,3,,198857,4362,1AR
4,,SING,C1,O5,no,N,4,,198857,4362,1AR
5,,SING,C1,H1,no,N,5,,198857,4362,1AR
6,,SING,C2,C3,no,N,6,,198857,4362,1AR
7,,SING,C2,H21,no,N,7,,198857,4362,1AR
8,,SING,C2,H22,no,N,8,,198857,4362,1AR
9,,SING,C3,O3,no,N,9,,198857,4362,1AR
10,,SING,C3,CC3,no,N,10,,198857,4362,1AR
11,,SING,C3,C4,no,N,11,,198857,4362,1AR
12,,SING,O3,HO3,no,N,12,,198857,4362,1AR
13,,SING,CC3,HM31,no,N,13,,198857,4362,1AR
14,,SING,CC3,HM32,no,N,14,,198857,4362,1AR
15,,SING,CC3,HM33,no,N,15,,198857,4362,1AR
16,,SING,C4,O4,no,N,16,,198857,4362,1AR
17,,SING,C4,C5,no,N,17,,198857,4362,1AR
18,,SING,C4,H4,no,N,18,,198857,4362,1AR
19,,SING,O4,CO4,no,N,19,,198857,4362,1AR
20,,SING,CME,CO4,no,N,20,,198857,4362,1AR
21,,SING,CME,HM41,no,N,21,,198857,4362,1AR
22,,SING,CME,HM42,no,N,22,,198857,4362,1AR
23,,SING,CME,HM43,no,N,23,,198857,4362,1AR
24,,DOUB,CO4,OC4,no,N,24,,198857,4362,1AR
25,,SING,C5,O5,no,N,25,,198857,4362,1AR
26,,SING,C5,C6,no,N,26,,198857,4362,1AR
27,,SING,C5,H5,no,N,27,,198857,4362,1AR
28,,SING,C6,H61,no,N,28,,198857,4362,1AR
29,,SING,C6,H62,no,N,29,,198857,4362,1AR
30,,SING,C6,H63,no,N,30,,198857,4362,1AR
1,,SING,C1,C2,no,N,1,,198858,4362,DDA
2,,SING,C1,O5,no,N,2,,198858,4362,DDA
3,,SING,C1,O1,no,N,3,,198858,4362,DDA
4,,SING,C1,H1,no,N,4,,198858,4362,DDA
5,,SING,C2,C3,no,N,5,,198858,4362,DDA
6,,SING,C2,H21,no,N,6,,198858,4362,DDA
7,,SING,C2,H22,no,N,7,,198858,4362,DDA
8,,SING,C3,C4,no,N,8,,198858,4362,DDA
9,,SING,C3,O3,no,N,9,,198858,4362,DDA
10,,SING,C3,H3,no,N,10,,198858,4362,DDA
11,,SING,C4,C5,no,N,11,,198858,4362,DDA
12,,SING,C4,O4,no,N,12,,198858,4362,DDA
13,,SING,C4,H4,no,N,13,,198858,4362,DDA
14,,SING,C5,C6,no,N,14,,198858,4362,DDA
15,,SING,C5,O5,no,N,15,,198858,4362,DDA
16,,SING,C5,H5,no,N,16,,198858,4362,DDA
17,,SING,C6,H61,no,N,17,,198858,4362,DDA
18,,SING,C6,H62,no,N,18,,198858,4362,DDA
19,,SING,C6,H63,no,N,19,,198858,4362,DDA
20,,SING,O1,HO1,no,N,20,,198858,4362,DDA
21,,SING,O3,HO3,no,N,21,,198858,4362,DDA
22,,SING,O4,HO4,no,N,22,,198858,4362,DDA
1,,DOUB,C1,O1,no,N,1,,198859,4362,DXB
2,,SING,C1,C9A,no,N,2,,198859,4362,DXB
3,,SING,C1,C2,no,N,3,,198859,4362,DXB
4,,DOUB,C9A,C4A,yes,N,4,,198859,4362,DXB
5,,SING,C9A,C9,yes,N,5,,198859,4362,DXB
6,,SING,C2,C3,no,N,6,,198859,4362,DXB
7,,SING,C2,H21,no,N,7,,198859,4362,DXB
8,,SING,C2,H22,no,N,8,,198859,4362,DXB
9,,SING,C3,C4,no,N,9,,198859,4362,DXB
10,,SING,C3,C1S,no,N,10,,198859,4362,DXB
11,,SING,C3,H3,no,N,11,,198859,4362,DXB
12,,SING,C4,C4A,no,N,12,,198859,4362,DXB
13,,SING,C4,H4A,no,N,13,,198859,4362,DXB
14,,SING,C4,H4E,no,N,14,,198859,4362,DXB
15,,SING,C4A,C10,yes,N,15,,198859,4362,DXB
16,,DOUB,C10,C5A,yes,N,16,,198859,4362,DXB
17,,SING,C10,H10,no,N,17,,198859,4362,DXB
18,,SING,C5A,C5,yes,N,18,,198859,4362,DXB
19,,SING,C5A,C8A,yes,N,19,,198859,4362,DXB
20,,DOUB,C5,C6,yes,N,20,,198859,4362,DXB
21,,SING,C5,H5,no,N,21,,198859,4362,DXB
22,,SING,C6,C7,yes,N,22,,198859,4362,DXB
23,,SING,C6,H6,no,N,23,,198859,4362,DXB
24,,SING,C7,CC7,no,N,24,,198859,4362,DXB
25,,DOUB,C7,C8,yes,N,25,,198859,4362,DXB
26,,SING,CC7,HM71,no,N,26,,198859,4362,DXB
27,,SING,CC7,HM72,no,N,27,,198859,4362,DXB
28,,SING,CC7,HM73,no,N,28,,198859,4362,DXB
29,,SING,C8,O8,no,N,29,,198859,4362,DXB
30,,SING,C8,C8A,yes,N,30,,198859,4362,DXB
31,,SING,O8,HO8,no,N,31,,198859,4362,DXB
32,,DOUB,C8A,C9,yes,N,32,,198859,4362,DXB
33,,SING,C9,O9,no,N,33,,198859,4362,DXB
34,,SING,O9,HO9,no,N,34,,198859,4362,DXB
35,,SING,CME,O1S,no,N,35,,198859,4362,DXB
36,,SING,CME,HM11,no,N,36,,198859,4362,DXB
37,,SING,CME,HM12,no,N,37,,198859,4362,DXB
38,,SING,CME,HM13,no,N,38,,198859,4362,DXB
39,,SING,C1S,O1S,no,N,39,,198859,4362,DXB
40,,SING,C1S,C2S,no,N,40,,198859,4362,DXB
41,,SING,C1S,HS1,no,N,41,,198859,4362,DXB
42,,DOUB,C2S,O2S,no,N,42,,198859,4362,DXB
43,,SING,C2S,C3S,no,N,43,,198859,4362,DXB
44,,SING,C3S,O3S,no,N,44,,198859,4362,DXB
45,,SING,C3S,C4S,no,N,45,,198859,4362,DXB
46,,SING,C3S,HS3,no,N,46,,198859,4362,DXB
47,,SING,O3S,HO3,no,N,47,,198859,4362,DXB
48,,SING,C4S,O4S,no,N,48,,198859,4362,DXB
49,,SING,C4S,C5S,no,N,49,,198859,4362,DXB
50,,SING,C4S,HS4,no,N,50,,198859,4362,DXB
51,,SING,O4S,HO4,no,N,51,,198859,4362,DXB
52,,SING,C5S,HM51,no,N,52,,198859,4362,DXB
53,,SING,C5S,HM52,no,N,53,,198859,4362,DXB
54,,SING,C5S,HM53,no,N,54,,198859,4362,DXB
1,,DOUB,C1,N2,yes,N,1,,198900,4364,PNU
2,,SING,C1,N6,yes,N,2,,198900,4364,PNU
3,,SING,C1,S17,no,N,3,,198900,4364,PNU
4,,SING,N2,C3,yes,N,4,,198900,4364,PNU
5,,DOUB,C3,C4,yes,N,5,,198900,4364,PNU
6,,SING,C3,N18,no,N,6,,198900,4364,PNU
7,,SING,C4,C5,yes,N,7,,198900,4364,PNU
8,,SING,C4,HC4,no,N,8,,198900,4364,PNU
9,,DOUB,C5,N6,yes,N,9,,198900,4364,PNU
10,,SING,C5,CL19,no,N,10,,198900,4364,PNU
11,,DOUB,C7,C8,yes,N,11,,198900,4364,PNU
12,,SING,C7,C12,yes,N,12,,198900,4364,PNU
13,,SING,C7,O14,yes,N,13,,198900,4364,PNU
14,,SING,C8,N9,yes,N,14,,198900,4364,PNU
15,,SING,C8,HC8,no,N,15,,198900,4364,PNU
16,,DOUB,N9,C10,yes,N,16,,198900,4364,PNU
17,,SING,C10,C11,yes,N,17,,198900,4364,PNU
18,,SING,C10,C16,no,N,18,,198900,4364,PNU
19,,DOUB,C11,C12,yes,N,19,,198900,4364,PNU
20,,SING,C11,H11C,no,N,20,,198900,4364,PNU
21,,SING,C12,C13,yes,N,21,,198900,4364,PNU
22,,DOUB,C13,C15,yes,N,22,,198900,4364,PNU
23,,SING,C13,H13C,no,N,23,,198900,4364,PNU
24,,SING,O14,C15,yes,N,24,,198900,4364,PNU
25,,SING,C15,H15C,no,N,25,,198900,4364,PNU
26,,SING,C16,S17,no,N,26,,198900,4364,PNU
27,,SING,C16,C21,no,N,27,,198900,4364,PNU
28,,SING,C16,H16C,no,N,28,,198900,4364,PNU
29,,SING,N18,H181,no,N,29,,198900,4364,PNU
30,,SING,N18,H182,no,N,30,,198900,4364,PNU
31,,SING,C21,H211,no,N,31,,198900,4364,PNU
32,,SING,C21,H212,no,N,32,,198900,4364,PNU
33,,SING,C21,H213,no,N,33,,198900,4364,PNU
1,,DOUB,C1,N2,yes,N,1,,198919,4365,PNU
2,,SING,C1,N6,yes,N,2,,198919,4365,PNU
3,,SING,C1,S17,no,N,3,,198919,4365,PNU
4,,SING,N2,C3,yes,N,4,,198919,4365,PNU
5,,DOUB,C3,C4,yes,N,5,,198919,4365,PNU
6,,SING,C3,N18,no,N,6,,198919,4365,PNU
7,,SING,C4,C5,yes,N,7,,198919,4365,PNU
8,,SING,C4,HC4,no,N,8,,198919,4365,PNU
9,,DOUB,C5,N6,yes,N,9,,198919,4365,PNU
10,,SING,C5,CL19,no,N,10,,198919,4365,PNU
11,,DOUB,C7,C8,yes,N,11,,198919,4365,PNU
12,,SING,C7,C12,yes,N,12,,198919,4365,PNU
13,,SING,C7,O14,yes,N,13,,198919,4365,PNU
14,,SING,C8,N9,yes,N,14,,198919,4365,PNU
15,,SING,C8,HC8,no,N,15,,198919,4365,PNU
16,,DOUB,N9,C10,yes,N,16,,198919,4365,PNU
17,,SING,C10,C11,yes,N,17,,198919,4365,PNU
18,,SING,C10,C16,no,N,18,,198919,4365,PNU
19,,DOUB,C11,C12,yes,N,19,,198919,4365,PNU
20,,SING,C11,H11C,no,N,20,,198919,4365,PNU
21,,SING,C12,C13,yes,N,21,,198919,4365,PNU
22,,DOUB,C13,C15,yes,N,22,,198919,4365,PNU
23,,SING,C13,H13C,no,N,23,,198919,4365,PNU
24,,SING,O14,C15,yes,N,24,,198919,4365,PNU
25,,SING,C15,H15C,no,N,25,,198919,4365,PNU
26,,SING,C16,S17,no,N,26,,198919,4365,PNU
27,,SING,C16,C21,no,N,27,,198919,4365,PNU
28,,SING,C16,H16C,no,N,28,,198919,4365,PNU
29,,SING,N18,H181,no,N,29,,198919,4365,PNU
30,,SING,N18,H182,no,N,30,,198919,4365,PNU
31,,SING,C21,H211,no,N,31,,198919,4365,PNU
32,,SING,C21,H212,no,N,32,,198919,4365,PNU
33,,SING,C21,H213,no,N,33,,198919,4365,PNU
1,,DOUB,C1,N2,yes,N,1,,198940,4366,PNU
2,,SING,C1,N6,yes,N,2,,198940,4366,PNU
3,,SING,C1,S17,no,N,3,,198940,4366,PNU
4,,SING,N2,C3,yes,N,4,,198940,4366,PNU
5,,DOUB,C3,C4,yes,N,5,,198940,4366,PNU
6,,SING,C3,N18,no,N,6,,198940,4366,PNU
7,,SING,C4,C5,yes,N,7,,198940,4366,PNU
8,,SING,C4,HC4,no,N,8,,198940,4366,PNU
9,,DOUB,C5,N6,yes,N,9,,198940,4366,PNU
10,,SING,C5,CL19,no,N,10,,198940,4366,PNU
11,,DOUB,C7,C8,yes,N,11,,198940,4366,PNU
12,,SING,C7,C12,yes,N,12,,198940,4366,PNU
13,,SING,C7,O14,yes,N,13,,198940,4366,PNU
14,,SING,C8,N9,yes,N,14,,198940,4366,PNU
15,,SING,C8,HC8,no,N,15,,198940,4366,PNU
16,,DOUB,N9,C10,yes,N,16,,198940,4366,PNU
17,,SING,C10,C11,yes,N,17,,198940,4366,PNU
18,,SING,C10,C16,no,N,18,,198940,4366,PNU
19,,DOUB,C11,C12,yes,N,19,,198940,4366,PNU
20,,SING,C11,H11C,no,N,20,,198940,4366,PNU
21,,SING,C12,C13,yes,N,21,,198940,4366,PNU
22,,DOUB,C13,C15,yes,N,22,,198940,4366,PNU
23,,SING,C13,H13C,no,N,23,,198940,4366,PNU
24,,SING,O14,C15,yes,N,24,,198940,4366,PNU
25,,SING,C15,H15C,no,N,25,,198940,4366,PNU
26,,SING,C16,S17,no,N,26,,198940,4366,PNU
27,,SING,C16,C21,no,N,27,,198940,4366,PNU
28,,SING,C16,H16C,no,N,28,,198940,4366,PNU
29,,SING,N18,H181,no,N,29,,198940,4366,PNU
30,,SING,N18,H182,no,N,30,,198940,4366,PNU
31,,SING,C21,H211,no,N,31,,198940,4366,PNU
32,,SING,C21,H212,no,N,32,,198940,4366,PNU
33,,SING,C21,H213,no,N,33,,198940,4366,PNU
1,,SING,C1,C2,no,N,1,,199020,437,AAC
2,,SING,C1,O1,no,N,2,,199020,437,AAC
3,,DOUB,C1,O2,no,N,3,,199020,437,AAC
4,,SING,C2,N1,no,N,4,,199020,437,AAC
5,,SING,C2,HC21,no,N,5,,199020,437,AAC
6,,SING,C2,HC22,no,N,6,,199020,437,AAC
7,,SING,C3,C4,no,N,7,,199020,437,AAC
8,,SING,C3,N1,no,N,8,,199020,437,AAC
9,,DOUB,C3,O3,no,N,9,,199020,437,AAC
10,,SING,C4,HC41,no,N,10,,199020,437,AAC
11,,SING,C4,HC42,no,N,11,,199020,437,AAC
12,,SING,C4,HC43,no,N,12,,199020,437,AAC
13,,SING,N1,HN1,no,N,13,,199020,437,AAC
14,,SING,O1,HO1,no,N,14,,199020,437,AAC
1,,SING,FE,NA,no,N,1,,199021,437,HEC
2,,SING,FE,NB,no,N,2,,199021,437,HEC
3,,SING,FE,NC,no,N,3,,199021,437,HEC
4,,SING,FE,ND,no,N,4,,199021,437,HEC
5,,DOUB,CHA,C1A,no,N,5,,199021,437,HEC
6,,SING,CHA,C4D,no,N,6,,199021,437,HEC
7,,SING,CHA,HHA,no,N,7,,199021,437,HEC
8,,DOUB,CHB,C4A,no,N,8,,199021,437,HEC
9,,SING,CHB,C1B,no,N,9,,199021,437,HEC
10,,SING,CHB,HHB,no,N,10,,199021,437,HEC
11,,DOUB,CHC,C4B,no,N,11,,199021,437,HEC
12,,SING,CHC,C1C,no,N,12,,199021,437,HEC
13,,SING,CHC,HHC,no,N,13,,199021,437,HEC
14,,DOUB,CHD,C4C,no,N,14,,199021,437,HEC
15,,SING,CHD,C1D,no,N,15,,199021,437,HEC
16,,SING,CHD,HHD,no,N,16,,199021,437,HEC
17,,SING,NA,C1A,yes,N,17,,199021,437,HEC
18,,SING,NA,C4A,yes,N,18,,199021,437,HEC
19,,SING,C1A,C2A,yes,N,19,,199021,437,HEC
20,,DOUB,C2A,C3A,yes,N,20,,199021,437,HEC
21,,SING,C2A,CAA,no,N,21,,199021,437,HEC
22,,SING,C3A,C4A,yes,N,22,,199021,437,HEC
23,,SING,C3A,CMA,no,N,23,,199021,437,HEC
24,,SING,CMA,HMA1,no,N,24,,199021,437,HEC
25,,SING,CMA,HMA2,no,N,25,,199021,437,HEC
26,,SING,CMA,HMA3,no,N,26,,199021,437,HEC
27,,SING,CAA,CBA,no,N,27,,199021,437,HEC
28,,SING,CAA,HAA1,no,N,28,,199021,437,HEC
29,,SING,CAA,HAA2,no,N,29,,199021,437,HEC
30,,SING,CBA,CGA,no,N,30,,199021,437,HEC
31,,SING,CBA,HBA1,no,N,31,,199021,437,HEC
32,,SING,CBA,HBA2,no,N,32,,199021,437,HEC
33,,DOUB,CGA,O1A,no,N,33,,199021,437,HEC
34,,SING,CGA,O2A,no,N,34,,199021,437,HEC
35,,SING,O2A,H2A,no,N,35,,199021,437,HEC
36,,SING,NB,C1B,yes,N,36,,199021,437,HEC
37,,SING,NB,C4B,yes,N,37,,199021,437,HEC
38,,DOUB,C1B,C2B,yes,N,38,,199021,437,HEC
39,,SING,C2B,C3B,yes,N,39,,199021,437,HEC
40,,SING,C2B,CMB,no,N,40,,199021,437,HEC
41,,SING,C3B,C4B,yes,N,41,,199021,437,HEC
42,,DOUB,C3B,CAB,no,E,42,,199021,437,HEC
43,,SING,CMB,HMB1,no,N,43,,199021,437,HEC
44,,SING,CMB,HMB2,no,N,44,,199021,437,HEC
45,,SING,CMB,HMB3,no,N,45,,199021,437,HEC
46,,SING,CAB,CBB,no,N,46,,199021,437,HEC
47,,SING,CAB,HAB,no,N,47,,199021,437,HEC
48,,SING,CBB,HBB1,no,N,48,,199021,437,HEC
49,,SING,CBB,HBB2,no,N,49,,199021,437,HEC
50,,SING,CBB,HBB3,no,N,50,,199021,437,HEC
51,,SING,NC,C1C,yes,N,51,,199021,437,HEC
52,,SING,NC,C4C,yes,N,52,,199021,437,HEC
53,,DOUB,C1C,C2C,yes,N,53,,199021,437,HEC
54,,SING,C2C,C3C,yes,N,54,,199021,437,HEC
55,,SING,C2C,CMC,no,N,55,,199021,437,HEC
56,,SING,C3C,C4C,yes,N,56,,199021,437,HEC
57,,DOUB,C3C,CAC,no,E,57,,199021,437,HEC
58,,SING,CMC,HMC1,no,N,58,,199021,437,HEC
59,,SING,CMC,HMC2,no,N,59,,199021,437,HEC
60,,SING,CMC,HMC3,no,N,60,,199021,437,HEC
61,,SING,CAC,CBC,no,N,61,,199021,437,HEC
62,,SING,CAC,HAC,no,N,62,,199021,437,HEC
63,,SING,CBC,HBC1,no,N,63,,199021,437,HEC
64,,SING,CBC,HBC2,no,N,64,,199021,437,HEC
65,,SING,CBC,HBC3,no,N,65,,199021,437,HEC
66,,SING,ND,C1D,yes,N,66,,199021,437,HEC
67,,SING,ND,C4D,yes,N,67,,199021,437,HEC
68,,DOUB,C1D,C2D,yes,N,68,,199021,437,HEC
69,,SING,C2D,C3D,yes,N,69,,199021,437,HEC
70,,SING,C2D,CMD,no,N,70,,199021,437,HEC
71,,DOUB,C3D,C4D,yes,N,71,,199021,437,HEC
72,,SING,C3D,CAD,no,N,72,,199021,437,HEC
73,,SING,CMD,HMD1,no,N,73,,199021,437,HEC
74,,SING,CMD,HMD2,no,N,74,,199021,437,HEC
75,,SING,CMD,HMD3,no,N,75,,199021,437,HEC
76,,SING,CAD,CBD,no,N,76,,199021,437,HEC
77,,SING,CAD,HAD1,no,N,77,,199021,437,HEC
78,,SING,CAD,HAD2,no,N,78,,199021,437,HEC
79,,SING,CBD,CGD,no,N,79,,199021,437,HEC
80,,SING,CBD,HBD1,no,N,80,,199021,437,HEC
81,,SING,CBD,HBD2,no,N,81,,199021,437,HEC
82,,DOUB,CGD,O1D,no,N,82,,199021,437,HEC
83,,SING,CGD,O2D,no,N,83,,199021,437,HEC
84,,SING,O2D,H2D,no,N,84,,199021,437,HEC
1,,SING,C1,C2,no,N,1,,199225,438,AAC
2,,SING,C1,O1,no,N,2,,199225,438,AAC
3,,DOUB,C1,O2,no,N,3,,199225,438,AAC
4,,SING,C2,N1,no,N,4,,199225,438,AAC
5,,SING,C2,HC21,no,N,5,,199225,438,AAC
6,,SING,C2,HC22,no,N,6,,199225,438,AAC
7,,SING,C3,C4,no,N,7,,199225,438,AAC
8,,SING,C3,N1,no,N,8,,199225,438,AAC
9,,DOUB,C3,O3,no,N,9,,199225,438,AAC
10,,SING,C4,HC41,no,N,10,,199225,438,AAC
11,,SING,C4,HC42,no,N,11,,199225,438,AAC
12,,SING,C4,HC43,no,N,12,,199225,438,AAC
13,,SING,N1,HN1,no,N,13,,199225,438,AAC
14,,SING,O1,HO1,no,N,14,,199225,438,AAC
1,,SING,FE,NA,no,N,1,,199226,438,HEC
2,,SING,FE,NB,no,N,2,,199226,438,HEC
3,,SING,FE,NC,no,N,3,,199226,438,HEC
4,,SING,FE,ND,no,N,4,,199226,438,HEC
5,,DOUB,CHA,C1A,no,N,5,,199226,438,HEC
6,,SING,CHA,C4D,no,N,6,,199226,438,HEC
7,,SING,CHA,HHA,no,N,7,,199226,438,HEC
8,,DOUB,CHB,C4A,no,N,8,,199226,438,HEC
9,,SING,CHB,C1B,no,N,9,,199226,438,HEC
10,,SING,CHB,HHB,no,N,10,,199226,438,HEC
11,,DOUB,CHC,C4B,no,N,11,,199226,438,HEC
12,,SING,CHC,C1C,no,N,12,,199226,438,HEC
13,,SING,CHC,HHC,no,N,13,,199226,438,HEC
14,,DOUB,CHD,C4C,no,N,14,,199226,438,HEC
15,,SING,CHD,C1D,no,N,15,,199226,438,HEC
16,,SING,CHD,HHD,no,N,16,,199226,438,HEC
17,,SING,NA,C1A,yes,N,17,,199226,438,HEC
18,,SING,NA,C4A,yes,N,18,,199226,438,HEC
19,,SING,C1A,C2A,yes,N,19,,199226,438,HEC
20,,DOUB,C2A,C3A,yes,N,20,,199226,438,HEC
21,,SING,C2A,CAA,no,N,21,,199226,438,HEC
22,,SING,C3A,C4A,yes,N,22,,199226,438,HEC
23,,SING,C3A,CMA,no,N,23,,199226,438,HEC
24,,SING,CMA,HMA1,no,N,24,,199226,438,HEC
25,,SING,CMA,HMA2,no,N,25,,199226,438,HEC
26,,SING,CMA,HMA3,no,N,26,,199226,438,HEC
27,,SING,CAA,CBA,no,N,27,,199226,438,HEC
28,,SING,CAA,HAA1,no,N,28,,199226,438,HEC
29,,SING,CAA,HAA2,no,N,29,,199226,438,HEC
30,,SING,CBA,CGA,no,N,30,,199226,438,HEC
31,,SING,CBA,HBA1,no,N,31,,199226,438,HEC
32,,SING,CBA,HBA2,no,N,32,,199226,438,HEC
33,,DOUB,CGA,O1A,no,N,33,,199226,438,HEC
34,,SING,CGA,O2A,no,N,34,,199226,438,HEC
35,,SING,O2A,H2A,no,N,35,,199226,438,HEC
36,,SING,NB,C1B,yes,N,36,,199226,438,HEC
37,,SING,NB,C4B,yes,N,37,,199226,438,HEC
38,,DOUB,C1B,C2B,yes,N,38,,199226,438,HEC
39,,SING,C2B,C3B,yes,N,39,,199226,438,HEC
40,,SING,C2B,CMB,no,N,40,,199226,438,HEC
41,,SING,C3B,C4B,yes,N,41,,199226,438,HEC
42,,DOUB,C3B,CAB,no,E,42,,199226,438,HEC
43,,SING,CMB,HMB1,no,N,43,,199226,438,HEC
44,,SING,CMB,HMB2,no,N,44,,199226,438,HEC
45,,SING,CMB,HMB3,no,N,45,,199226,438,HEC
46,,SING,CAB,CBB,no,N,46,,199226,438,HEC
47,,SING,CAB,HAB,no,N,47,,199226,438,HEC
48,,SING,CBB,HBB1,no,N,48,,199226,438,HEC
49,,SING,CBB,HBB2,no,N,49,,199226,438,HEC
50,,SING,CBB,HBB3,no,N,50,,199226,438,HEC
51,,SING,NC,C1C,yes,N,51,,199226,438,HEC
52,,SING,NC,C4C,yes,N,52,,199226,438,HEC
53,,DOUB,C1C,C2C,yes,N,53,,199226,438,HEC
54,,SING,C2C,C3C,yes,N,54,,199226,438,HEC
55,,SING,C2C,CMC,no,N,55,,199226,438,HEC
56,,SING,C3C,C4C,yes,N,56,,199226,438,HEC
57,,DOUB,C3C,CAC,no,E,57,,199226,438,HEC
58,,SING,CMC,HMC1,no,N,58,,199226,438,HEC
59,,SING,CMC,HMC2,no,N,59,,199226,438,HEC
60,,SING,CMC,HMC3,no,N,60,,199226,438,HEC
61,,SING,CAC,CBC,no,N,61,,199226,438,HEC
62,,SING,CAC,HAC,no,N,62,,199226,438,HEC
63,,SING,CBC,HBC1,no,N,63,,199226,438,HEC
64,,SING,CBC,HBC2,no,N,64,,199226,438,HEC
65,,SING,CBC,HBC3,no,N,65,,199226,438,HEC
66,,SING,ND,C1D,yes,N,66,,199226,438,HEC
67,,SING,ND,C4D,yes,N,67,,199226,438,HEC
68,,DOUB,C1D,C2D,yes,N,68,,199226,438,HEC
69,,SING,C2D,C3D,yes,N,69,,199226,438,HEC
70,,SING,C2D,CMD,no,N,70,,199226,438,HEC
71,,DOUB,C3D,C4D,yes,N,71,,199226,438,HEC
72,,SING,C3D,CAD,no,N,72,,199226,438,HEC
73,,SING,CMD,HMD1,no,N,73,,199226,438,HEC
74,,SING,CMD,HMD2,no,N,74,,199226,438,HEC
75,,SING,CMD,HMD3,no,N,75,,199226,438,HEC
76,,SING,CAD,CBD,no,N,76,,199226,438,HEC
77,,SING,CAD,HAD1,no,N,77,,199226,438,HEC
78,,SING,CAD,HAD2,no,N,78,,199226,438,HEC
79,,SING,CBD,CGD,no,N,79,,199226,438,HEC
80,,SING,CBD,HBD1,no,N,80,,199226,438,HEC
81,,SING,CBD,HBD2,no,N,81,,199226,438,HEC
82,,DOUB,CGD,O1D,no,N,82,,199226,438,HEC
83,,SING,CGD,O2D,no,N,83,,199226,438,HEC
84,,SING,O2D,H2D,no,N,84,,199226,438,HEC
1,,SING,C1,C2,no,N,1,,199294,4383,E2P
2,,SING,C1,H13,no,N,2,,199294,4383,E2P
3,,SING,C1,H11,no,N,3,,199294,4383,E2P
4,,SING,C1,H12,no,N,4,,199294,4383,E2P
5,,SING,C2,C3,no,N,5,,199294,4383,E2P
6,,SING,C2,H21,no,N,6,,199294,4383,E2P
7,,SING,C2,H22,no,N,7,,199294,4383,E2P
8,,SING,C3,C4,no,N,8,,199294,4383,E2P
9,,SING,C3,H31,no,N,9,,199294,4383,E2P
10,,SING,C3,H32,no,N,10,,199294,4383,E2P
11,,SING,C4,C5,no,N,11,,199294,4383,E2P
12,,SING,C4,H41,no,N,12,,199294,4383,E2P
13,,SING,C4,H42,no,N,13,,199294,4383,E2P
14,,SING,C5,C6,no,N,14,,199294,4383,E2P
15,,SING,C5,H51,no,N,15,,199294,4383,E2P
16,,SING,C5,H52,no,N,16,,199294,4383,E2P
17,,SING,C6,O6,no,N,17,,199294,4383,E2P
18,,SING,C6,C7,no,N,18,,199294,4383,E2P
19,,SING,C6,H6,no,N,19,,199294,4383,E2P
20,,SING,O6,HO6,no,N,20,,199294,4383,E2P
21,,DOUB,C7,C8,no,E,21,,199294,4383,E2P
22,,SING,C7,H7,no,N,22,,199294,4383,E2P
23,,SING,C8,C9,no,N,23,,199294,4383,E2P
24,,SING,C8,H8,no,N,24,,199294,4383,E2P
25,,SING,C9,C10,no,N,25,,199294,4383,E2P
26,,DOUB,C9,C13,no,N,26,,199294,4383,E2P
27,,SING,C10,C11,no,N,27,,199294,4383,E2P
28,,SING,C10,H101,no,N,28,,199294,4383,E2P
29,,SING,C10,H102,no,N,29,,199294,4383,E2P
30,,SING,C11,C12,no,N,30,,199294,4383,E2P
31,,SING,C11,H78,no,N,31,,199294,4383,E2P
32,,SING,C11,H79,no,N,32,,199294,4383,E2P
33,,DOUB,C12,O12,no,N,33,,199294,4383,E2P
34,,SING,C12,C13,no,N,34,,199294,4383,E2P
35,,SING,C13,C14,no,N,35,,199294,4383,E2P
36,,SING,C14,C15,no,N,36,,199294,4383,E2P
37,,SING,C14,H141,no,N,37,,199294,4383,E2P
38,,SING,C14,H142,no,N,38,,199294,4383,E2P
39,,DOUB,C15,C16,no,Z,39,,199294,4383,E2P
40,,SING,C15,H15,no,N,40,,199294,4383,E2P
41,,SING,C16,C17,no,N,41,,199294,4383,E2P
42,,SING,C16,H16,no,N,42,,199294,4383,E2P
43,,SING,C17,C18,no,N,43,,199294,4383,E2P
44,,SING,C17,H171,no,N,44,,199294,4383,E2P
45,,SING,C17,H172,no,N,45,,199294,4383,E2P
46,,SING,C18,C19,no,N,46,,199294,4383,E2P
47,,SING,C18,H181,no,N,47,,199294,4383,E2P
48,,SING,C18,H182,no,N,48,,199294,4383,E2P
49,,SING,C19,C20,no,N,49,,199294,4383,E2P
50,,SING,C19,H191,no,N,50,,199294,4383,E2P
51,,SING,C19,H192,no,N,51,,199294,4383,E2P
52,,DOUB,C20,O21,no,N,52,,199294,4383,E2P
53,,SING,C20,O20,no,N,53,,199294,4383,E2P
54,,SING,O20,HXT,no,N,54,,199294,4383,E2P
1,,SING,C1,C2,no,N,1,,199429,439,AAC
2,,SING,C1,O1,no,N,2,,199429,439,AAC
3,,DOUB,C1,O2,no,N,3,,199429,439,AAC
4,,SING,C2,N1,no,N,4,,199429,439,AAC
5,,SING,C2,HC21,no,N,5,,199429,439,AAC
6,,SING,C2,HC22,no,N,6,,199429,439,AAC
7,,SING,C3,C4,no,N,7,,199429,439,AAC
8,,SING,C3,N1,no,N,8,,199429,439,AAC
9,,DOUB,C3,O3,no,N,9,,199429,439,AAC
10,,SING,C4,HC41,no,N,10,,199429,439,AAC
11,,SING,C4,HC42,no,N,11,,199429,439,AAC
12,,SING,C4,HC43,no,N,12,,199429,439,AAC
13,,SING,N1,HN1,no,N,13,,199429,439,AAC
14,,SING,O1,HO1,no,N,14,,199429,439,AAC
1,,SING,FE,NA,no,N,1,,199430,439,HEC
2,,SING,FE,NB,no,N,2,,199430,439,HEC
3,,SING,FE,NC,no,N,3,,199430,439,HEC
4,,SING,FE,ND,no,N,4,,199430,439,HEC
5,,DOUB,CHA,C1A,no,N,5,,199430,439,HEC
6,,SING,CHA,C4D,no,N,6,,199430,439,HEC
7,,SING,CHA,HHA,no,N,7,,199430,439,HEC
8,,DOUB,CHB,C4A,no,N,8,,199430,439,HEC
9,,SING,CHB,C1B,no,N,9,,199430,439,HEC
10,,SING,CHB,HHB,no,N,10,,199430,439,HEC
11,,DOUB,CHC,C4B,no,N,11,,199430,439,HEC
12,,SING,CHC,C1C,no,N,12,,199430,439,HEC
13,,SING,CHC,HHC,no,N,13,,199430,439,HEC
14,,DOUB,CHD,C4C,no,N,14,,199430,439,HEC
15,,SING,CHD,C1D,no,N,15,,199430,439,HEC
16,,SING,CHD,HHD,no,N,16,,199430,439,HEC
17,,SING,NA,C1A,yes,N,17,,199430,439,HEC
18,,SING,NA,C4A,yes,N,18,,199430,439,HEC
19,,SING,C1A,C2A,yes,N,19,,199430,439,HEC
20,,DOUB,C2A,C3A,yes,N,20,,199430,439,HEC
21,,SING,C2A,CAA,no,N,21,,199430,439,HEC
22,,SING,C3A,C4A,yes,N,22,,199430,439,HEC
23,,SING,C3A,CMA,no,N,23,,199430,439,HEC
24,,SING,CMA,HMA1,no,N,24,,199430,439,HEC
25,,SING,CMA,HMA2,no,N,25,,199430,439,HEC
26,,SING,CMA,HMA3,no,N,26,,199430,439,HEC
27,,SING,CAA,CBA,no,N,27,,199430,439,HEC
28,,SING,CAA,HAA1,no,N,28,,199430,439,HEC
29,,SING,CAA,HAA2,no,N,29,,199430,439,HEC
30,,SING,CBA,CGA,no,N,30,,199430,439,HEC
31,,SING,CBA,HBA1,no,N,31,,199430,439,HEC
32,,SING,CBA,HBA2,no,N,32,,199430,439,HEC
33,,DOUB,CGA,O1A,no,N,33,,199430,439,HEC
34,,SING,CGA,O2A,no,N,34,,199430,439,HEC
35,,SING,O2A,H2A,no,N,35,,199430,439,HEC
36,,SING,NB,C1B,yes,N,36,,199430,439,HEC
37,,SING,NB,C4B,yes,N,37,,199430,439,HEC
38,,DOUB,C1B,C2B,yes,N,38,,199430,439,HEC
39,,SING,C2B,C3B,yes,N,39,,199430,439,HEC
40,,SING,C2B,CMB,no,N,40,,199430,439,HEC
41,,SING,C3B,C4B,yes,N,41,,199430,439,HEC
42,,DOUB,C3B,CAB,no,E,42,,199430,439,HEC
43,,SING,CMB,HMB1,no,N,43,,199430,439,HEC
44,,SING,CMB,HMB2,no,N,44,,199430,439,HEC
45,,SING,CMB,HMB3,no,N,45,,199430,439,HEC
46,,SING,CAB,CBB,no,N,46,,199430,439,HEC
47,,SING,CAB,HAB,no,N,47,,199430,439,HEC
48,,SING,CBB,HBB1,no,N,48,,199430,439,HEC
49,,SING,CBB,HBB2,no,N,49,,199430,439,HEC
50,,SING,CBB,HBB3,no,N,50,,199430,439,HEC
51,,SING,NC,C1C,yes,N,51,,199430,439,HEC
52,,SING,NC,C4C,yes,N,52,,199430,439,HEC
53,,DOUB,C1C,C2C,yes,N,53,,199430,439,HEC
54,,SING,C2C,C3C,yes,N,54,,199430,439,HEC
55,,SING,C2C,CMC,no,N,55,,199430,439,HEC
56,,SING,C3C,C4C,yes,N,56,,199430,439,HEC
57,,DOUB,C3C,CAC,no,E,57,,199430,439,HEC
58,,SING,CMC,HMC1,no,N,58,,199430,439,HEC
59,,SING,CMC,HMC2,no,N,59,,199430,439,HEC
60,,SING,CMC,HMC3,no,N,60,,199430,439,HEC
61,,SING,CAC,CBC,no,N,61,,199430,439,HEC
62,,SING,CAC,HAC,no,N,62,,199430,439,HEC
63,,SING,CBC,HBC1,no,N,63,,199430,439,HEC
64,,SING,CBC,HBC2,no,N,64,,199430,439,HEC
65,,SING,CBC,HBC3,no,N,65,,199430,439,HEC
66,,SING,ND,C1D,yes,N,66,,199430,439,HEC
67,,SING,ND,C4D,yes,N,67,,199430,439,HEC
68,,DOUB,C1D,C2D,yes,N,68,,199430,439,HEC
69,,SING,C2D,C3D,yes,N,69,,199430,439,HEC
70,,SING,C2D,CMD,no,N,70,,199430,439,HEC
71,,DOUB,C3D,C4D,yes,N,71,,199430,439,HEC
72,,SING,C3D,CAD,no,N,72,,199430,439,HEC
73,,SING,CMD,HMD1,no,N,73,,199430,439,HEC
74,,SING,CMD,HMD2,no,N,74,,199430,439,HEC
75,,SING,CMD,HMD3,no,N,75,,199430,439,HEC
76,,SING,CAD,CBD,no,N,76,,199430,439,HEC
77,,SING,CAD,HAD1,no,N,77,,199430,439,HEC
78,,SING,CAD,HAD2,no,N,78,,199430,439,HEC
79,,SING,CBD,CGD,no,N,79,,199430,439,HEC
80,,SING,CBD,HBD1,no,N,80,,199430,439,HEC
81,,SING,CBD,HBD2,no,N,81,,199430,439,HEC
82,,DOUB,CGD,O1D,no,N,82,,199430,439,HEC
83,,SING,CGD,O2D,no,N,83,,199430,439,HEC
84,,SING,O2D,H2D,no,N,84,,199430,439,HEC
1,,DOUB,CA,OA,no,N,1,,199472,4392,AR1
2,,SING,CA,N1,no,N,2,,199472,4392,AR1
3,,SING,CA,HA,no,N,3,,199472,4392,AR1
4,,SING,N1,C11,no,N,4,,199472,4392,AR1
5,,SING,N1,HN1,no,N,5,,199472,4392,AR1
6,,SING,C11,N21,yes,N,6,,199472,4392,AR1
7,,DOUB,C11,C51,yes,N,7,,199472,4392,AR1
8,,DOUB,N21,C31,yes,N,8,,199472,4392,AR1
9,,SING,C31,N41,yes,N,9,,199472,4392,AR1
10,,SING,C31,C1,no,N,10,,199472,4392,AR1
11,,SING,N41,CN1,no,N,11,,199472,4392,AR1
12,,SING,N41,C51,yes,N,12,,199472,4392,AR1
13,,SING,CN1,HN11,no,N,13,,199472,4392,AR1
14,,SING,CN1,HN12,no,N,14,,199472,4392,AR1
15,,SING,CN1,HN13,no,N,15,,199472,4392,AR1
16,,SING,C51,H51,no,N,16,,199472,4392,AR1
17,,DOUB,C1,O1,no,N,17,,199472,4392,AR1
18,,SING,C1,N2,no,N,18,,199472,4392,AR1
19,,SING,N2,C12,no,N,19,,199472,4392,AR1
20,,SING,N2,HN2,no,N,20,,199472,4392,AR1
21,,SING,C12,N22,yes,N,21,,199472,4392,AR1
22,,DOUB,C12,C52,yes,N,22,,199472,4392,AR1
23,,DOUB,N22,C32,yes,N,23,,199472,4392,AR1
24,,SING,C32,N42,yes,N,24,,199472,4392,AR1
25,,SING,C32,C2,no,N,25,,199472,4392,AR1
26,,SING,N42,CN2,no,N,26,,199472,4392,AR1
27,,SING,N42,C52,yes,N,27,,199472,4392,AR1
28,,SING,CN2,HN21,no,N,28,,199472,4392,AR1
29,,SING,CN2,HN22,no,N,29,,199472,4392,AR1
30,,SING,CN2,HN23,no,N,30,,199472,4392,AR1
31,,SING,C52,H52,no,N,31,,199472,4392,AR1
32,,DOUB,C2,O2,no,N,32,,199472,4392,AR1
33,,SING,C2,N3,no,N,33,,199472,4392,AR1
34,,SING,N3,C13,no,N,34,,199472,4392,AR1
35,,SING,N3,HN3,no,N,35,,199472,4392,AR1
36,,SING,C13,N23,yes,N,36,,199472,4392,AR1
37,,DOUB,C13,C53,yes,N,37,,199472,4392,AR1
38,,DOUB,N23,C33,yes,N,38,,199472,4392,AR1
39,,SING,C33,N43,yes,N,39,,199472,4392,AR1
40,,SING,C33,C3,no,N,40,,199472,4392,AR1
41,,SING,N43,CN3,no,N,41,,199472,4392,AR1
42,,SING,N43,C53,yes,N,42,,199472,4392,AR1
43,,SING,CN3,HN31,no,N,43,,199472,4392,AR1
44,,SING,CN3,HN32,no,N,44,,199472,4392,AR1
45,,SING,CN3,HN33,no,N,45,,199472,4392,AR1
46,,SING,C53,H53,no,N,46,,199472,4392,AR1
47,,DOUB,C3,O3,no,N,47,,199472,4392,AR1
48,,SING,C3,NT,no,N,48,,199472,4392,AR1
49,,SING,NT,C1T,no,N,49,,199472,4392,AR1
50,,SING,NT,HT,no,N,50,,199472,4392,AR1
51,,SING,C1T,C2T,no,N,51,,199472,4392,AR1
52,,SING,C1T,H1T1,no,N,52,,199472,4392,AR1
53,,SING,C1T,H1T2,no,N,53,,199472,4392,AR1
54,,SING,C2T,N3T,no,N,54,,199472,4392,AR1
55,,SING,C2T,H2T1,no,N,55,,199472,4392,AR1
56,,SING,C2T,H2T2,no,N,56,,199472,4392,AR1
57,,SING,N3T,CNT,no,N,57,,199472,4392,AR1
58,,SING,N3T,CMT,no,N,58,,199472,4392,AR1
59,,SING,N3T,HNT,no,N,59,,199472,4392,AR1
60,,SING,CNT,HNT1,no,N,60,,199472,4392,AR1
61,,SING,CNT,HNT2,no,N,61,,199472,4392,AR1
62,,SING,CNT,HNT3,no,N,62,,199472,4392,AR1
63,,SING,CMT,HMT1,no,N,63,,199472,4392,AR1
64,,SING,CMT,HMT2,no,N,64,,199472,4392,AR1
65,,SING,CMT,HMT3,no,N,65,,199472,4392,AR1
1,,DOUB,C,O,no,N,1,,199575,4398,ACE
2,,SING,C,CH3,no,N,2,,199575,4398,ACE
3,,SING,C,H,no,N,3,,199575,4398,ACE
4,,SING,CH3,H1,no,N,4,,199575,4398,ACE
5,,SING,CH3,H2,no,N,5,,199575,4398,ACE
6,,SING,CH3,H3,no,N,6,,199575,4398,ACE
1,,SING,N,HN1,no,N,1,,199576,4398,NH2
2,,SING,N,HN2,no,N,2,,199576,4398,NH2
1,,SING,N,HN1,no,N,1,,199591,4399,NH2
2,,SING,N,HN2,no,N,2,,199591,4399,NH2
1,,SING,N,CA,no,N,1,,199764,4406,HYP
2,,SING,N,CD,no,N,2,,199764,4406,HYP
3,,SING,N,H,no,N,3,,199764,4406,HYP
4,,SING,CA,C,no,N,4,,199764,4406,HYP
5,,SING,CA,CB,no,N,5,,199764,4406,HYP
6,,SING,CA,HA,no,N,6,,199764,4406,HYP
7,,DOUB,C,O,no,N,7,,199764,4406,HYP
8,,SING,C,OXT,no,N,8,,199764,4406,HYP
9,,SING,CB,CG,no,N,9,,199764,4406,HYP
10,,SING,CB,HB2,no,N,10,,199764,4406,HYP
11,,SING,CB,HB3,no,N,11,,199764,4406,HYP
12,,SING,CG,CD,no,N,12,,199764,4406,HYP
13,,SING,CG,OD1,no,N,13,,199764,4406,HYP
14,,SING,CG,HG,no,N,14,,199764,4406,HYP
15,,SING,CD,HD22,no,N,15,,199764,4406,HYP
16,,SING,CD,HD23,no,N,16,,199764,4406,HYP
17,,SING,OD1,HD1,no,N,17,,199764,4406,HYP
18,,SING,OXT,HXT,no,N,18,,199764,4406,HYP
1,,SING,N,CA,no,N,1,,199765,4406,DTR
2,,SING,N,H,no,N,2,,199765,4406,DTR
3,,SING,N,HN2,no,N,3,,199765,4406,DTR
4,,SING,CA,CB,no,N,4,,199765,4406,DTR
5,,SING,CA,C,no,N,5,,199765,4406,DTR
6,,SING,CA,HA,no,N,6,,199765,4406,DTR
7,,SING,CB,CG,no,N,7,,199765,4406,DTR
8,,SING,CB,HB2,no,N,8,,199765,4406,DTR
9,,SING,CB,HB3,no,N,9,,199765,4406,DTR
10,,DOUB,CG,CD1,yes,N,10,,199765,4406,DTR
11,,SING,CG,CD2,yes,N,11,,199765,4406,DTR
12,,SING,CD1,NE1,yes,N,12,,199765,4406,DTR
13,,SING,CD1,HD1,no,N,13,,199765,4406,DTR
14,,SING,NE1,CE2,yes,N,14,,199765,4406,DTR
15,,SING,NE1,HE1,no,N,15,,199765,4406,DTR
16,,DOUB,CE2,CZ2,yes,N,16,,199765,4406,DTR
17,,SING,CE2,CD2,yes,N,17,,199765,4406,DTR
18,,SING,CZ2,CH2,yes,N,18,,199765,4406,DTR
19,,SING,CZ2,HZ2,no,N,19,,199765,4406,DTR
20,,DOUB,CH2,CZ3,yes,N,20,,199765,4406,DTR
21,,SING,CH2,HH2,no,N,21,,199765,4406,DTR
22,,SING,CZ3,CE3,yes,N,22,,199765,4406,DTR
23,,SING,CZ3,HZ3,no,N,23,,199765,4406,DTR
24,,DOUB,CE3,CD2,yes,N,24,,199765,4406,DTR
25,,SING,CE3,HE3,no,N,25,,199765,4406,DTR
26,,DOUB,C,O,no,N,26,,199765,4406,DTR
27,,SING,C,OXT,no,N,27,,199765,4406,DTR
28,,SING,OXT,HXT,no,N,28,,199765,4406,DTR
1,,SING,N,HN1,no,N,1,,199766,4406,NH2
2,,SING,N,HN2,no,N,2,,199766,4406,NH2
1,,SING,N,CA,no,N,1,,199804,4408,HYP
2,,SING,N,CD,no,N,2,,199804,4408,HYP
3,,SING,N,H,no,N,3,,199804,4408,HYP
4,,SING,CA,C,no,N,4,,199804,4408,HYP
5,,SING,CA,CB,no,N,5,,199804,4408,HYP
6,,SING,CA,HA,no,N,6,,199804,4408,HYP
7,,DOUB,C,O,no,N,7,,199804,4408,HYP
8,,SING,C,OXT,no,N,8,,199804,4408,HYP
9,,SING,CB,CG,no,N,9,,199804,4408,HYP
10,,SING,CB,HB2,no,N,10,,199804,4408,HYP
11,,SING,CB,HB3,no,N,11,,199804,4408,HYP
12,,SING,CG,CD,no,N,12,,199804,4408,HYP
13,,SING,CG,OD1,no,N,13,,199804,4408,HYP
14,,SING,CG,HG,no,N,14,,199804,4408,HYP
15,,SING,CD,HD22,no,N,15,,199804,4408,HYP
16,,SING,CD,HD23,no,N,16,,199804,4408,HYP
17,,SING,OD1,HD1,no,N,17,,199804,4408,HYP
18,,SING,OXT,HXT,no,N,18,,199804,4408,HYP
1,,SING,N,CA,no,N,1,,199805,4408,DTR
2,,SING,N,H,no,N,2,,199805,4408,DTR
3,,SING,N,HN2,no,N,3,,199805,4408,DTR
4,,SING,CA,CB,no,N,4,,199805,4408,DTR
5,,SING,CA,C,no,N,5,,199805,4408,DTR
6,,SING,CA,HA,no,N,6,,199805,4408,DTR
7,,SING,CB,CG,no,N,7,,199805,4408,DTR
8,,SING,CB,HB2,no,N,8,,199805,4408,DTR
9,,SING,CB,HB3,no,N,9,,199805,4408,DTR
10,,DOUB,CG,CD1,yes,N,10,,199805,4408,DTR
11,,SING,CG,CD2,yes,N,11,,199805,4408,DTR
12,,SING,CD1,NE1,yes,N,12,,199805,4408,DTR
13,,SING,CD1,HD1,no,N,13,,199805,4408,DTR
14,,SING,NE1,CE2,yes,N,14,,199805,4408,DTR
15,,SING,NE1,HE1,no,N,15,,199805,4408,DTR
16,,DOUB,CE2,CZ2,yes,N,16,,199805,4408,DTR
17,,SING,CE2,CD2,yes,N,17,,199805,4408,DTR
18,,SING,CZ2,CH2,yes,N,18,,199805,4408,DTR
19,,SING,CZ2,HZ2,no,N,19,,199805,4408,DTR
20,,DOUB,CH2,CZ3,yes,N,20,,199805,4408,DTR
21,,SING,CH2,HH2,no,N,21,,199805,4408,DTR
22,,SING,CZ3,CE3,yes,N,22,,199805,4408,DTR
23,,SING,CZ3,HZ3,no,N,23,,199805,4408,DTR
24,,DOUB,CE3,CD2,yes,N,24,,199805,4408,DTR
25,,SING,CE3,HE3,no,N,25,,199805,4408,DTR
26,,DOUB,C,O,no,N,26,,199805,4408,DTR
27,,SING,C,OXT,no,N,27,,199805,4408,DTR
28,,SING,OXT,HXT,no,N,28,,199805,4408,DTR
1,,SING,N,HN1,no,N,1,,199806,4408,NH2
2,,SING,N,HN2,no,N,2,,199806,4408,NH2
1,,DOUB,P,OP1,no,N,1,,199823,4409,64T
2,,SING,P,OP2,no,N,2,,199823,4409,64T
3,,SING,P,O5',no,N,3,,199823,4409,64T
4,,SING,P,OP3,no,N,4,,199823,4409,64T
5,,SING,OP2,HOP2,no,N,5,,199823,4409,64T
6,,SING,O5',C5',no,N,6,,199823,4409,64T
7,,SING,C5',C4',no,N,7,,199823,4409,64T
8,,SING,C5',H5',no,N,8,,199823,4409,64T
9,,SING,C5',H5'',no,N,9,,199823,4409,64T
10,,SING,C4',O4',no,N,10,,199823,4409,64T
11,,SING,C4',C3',no,N,11,,199823,4409,64T
12,,SING,C4',H4',no,N,12,,199823,4409,64T
13,,SING,O4',C1',no,N,13,,199823,4409,64T
14,,SING,C3',O3',no,N,14,,199823,4409,64T
15,,SING,C3',C2',no,N,15,,199823,4409,64T
16,,SING,C3',H3',no,N,16,,199823,4409,64T
17,,SING,O3',HO3',no,N,17,,199823,4409,64T
18,,SING,C2',C1',no,N,18,,199823,4409,64T
19,,SING,C2',H2',no,N,19,,199823,4409,64T
20,,SING,C2',H2'',no,N,20,,199823,4409,64T
21,,SING,C1',N1,no,N,21,,199823,4409,64T
22,,SING,C1',H1',no,N,22,,199823,4409,64T
23,,SING,N1,C2,no,N,23,,199823,4409,64T
24,,SING,N1,C6,no,N,24,,199823,4409,64T
25,,DOUB,C2,O2,no,N,25,,199823,4409,64T
26,,SING,C2,N3,no,N,26,,199823,4409,64T
27,,SING,N3,C4,no,N,27,,199823,4409,64T
28,,SING,N3,H3,no,N,28,,199823,4409,64T
29,,DOUB,C4,O4,no,N,29,,199823,4409,64T
30,,SING,C4,C5,no,N,30,,199823,4409,64T
31,,SING,C5,C5M,no,N,31,,199823,4409,64T
32,,SING,C5,O5,no,N,32,,199823,4409,64T
33,,SING,C5,C6,no,N,33,,199823,4409,64T
34,,SING,C5M,H71,no,N,34,,199823,4409,64T
35,,SING,C5M,H72,no,N,35,,199823,4409,64T
36,,SING,C5M,H73,no,N,36,,199823,4409,64T
37,,SING,O5,HO5,no,N,37,,199823,4409,64T
38,,SING,C6,H61,no,N,38,,199823,4409,64T
39,,SING,C6,H62,no,N,39,,199823,4409,64T
40,,SING,OP3,HOP3,no,N,40,,199823,4409,64T
1,,DOUB,OP3,P,no,N,1,,199824,4409,TA3
2,,SING,P,OP2,no,N,2,,199824,4409,TA3
3,,SING,P,O5',no,N,3,,199824,4409,TA3
4,,SING,P,OP1,no,N,4,,199824,4409,TA3
5,,SING,OP1,HO1P,no,N,5,,199824,4409,TA3
6,,SING,OP2,HO2P,no,N,6,,199824,4409,TA3
7,,SING,O5',C5',no,N,7,,199824,4409,TA3
8,,SING,C5',C4',no,N,8,,199824,4409,TA3
9,,SING,C5',H5',no,N,9,,199824,4409,TA3
10,,SING,C5',H5'',no,N,10,,199824,4409,TA3
11,,SING,C4',O4',no,N,11,,199824,4409,TA3
12,,SING,C4',C3',no,N,12,,199824,4409,TA3
13,,SING,C4',H4',no,N,13,,199824,4409,TA3
14,,SING,O4',C1',no,N,14,,199824,4409,TA3
15,,SING,C3',C2',no,N,15,,199824,4409,TA3
16,,SING,C3',O3',no,N,16,,199824,4409,TA3
17,,SING,C3',H3',no,N,17,,199824,4409,TA3
18,,SING,O3',HO3',no,N,18,,199824,4409,TA3
19,,SING,C2',C1',no,N,19,,199824,4409,TA3
20,,SING,C2',H2',no,N,20,,199824,4409,TA3
21,,SING,C2',H2'',no,N,21,,199824,4409,TA3
22,,SING,C1',N1,no,N,22,,199824,4409,TA3
23,,SING,C1',H1',no,N,23,,199824,4409,TA3
24,,SING,N1,C2,no,N,24,,199824,4409,TA3
25,,SING,N1,C6,no,N,25,,199824,4409,TA3
26,,DOUB,C2,O2,no,N,26,,199824,4409,TA3
27,,SING,C2,N3,no,N,27,,199824,4409,TA3
28,,SING,N3,C4,no,N,28,,199824,4409,TA3
29,,SING,N3,C6,no,N,29,,199824,4409,TA3
30,,SING,C4,C5,no,N,30,,199824,4409,TA3
31,,SING,C4,H41,no,N,31,,199824,4409,TA3
32,,SING,C4,H42,no,N,32,,199824,4409,TA3
33,,SING,C5,C5M,no,N,33,,199824,4409,TA3
34,,SING,C5,C6,no,N,34,,199824,4409,TA3
35,,SING,C5,H5,no,N,35,,199824,4409,TA3
36,,SING,C5M,H71,no,N,36,,199824,4409,TA3
37,,SING,C5M,H72,no,N,37,,199824,4409,TA3
38,,SING,C5M,H73,no,N,38,,199824,4409,TA3
39,,SING,C6,H6,no,N,39,,199824,4409,TA3
1,,SING,P,O1P,no,N,1,,199897,4412,PBT
2,,SING,P,O2P,no,N,2,,199897,4412,PBT
3,,DOUB,P,O3P,no,N,3,,199897,4412,PBT
4,,SING,P,O5',no,N,4,,199897,4412,PBT
5,,SING,O1P,H1P,no,N,5,,199897,4412,PBT
6,,SING,O2P,H2P,no,N,6,,199897,4412,PBT
7,,SING,O5',C5',no,N,7,,199897,4412,PBT
8,,SING,C5',C4',no,N,8,,199897,4412,PBT
9,,SING,C5',H5'1,no,N,9,,199897,4412,PBT
10,,SING,C5',H5'2,no,N,10,,199897,4412,PBT
11,,SING,C4',O4',no,N,11,,199897,4412,PBT
12,,SING,C4',C3',no,N,12,,199897,4412,PBT
13,,SING,C4',H4',no,N,13,,199897,4412,PBT
14,,SING,O4',C1',no,N,14,,199897,4412,PBT
15,,SING,C3',O3',no,N,15,,199897,4412,PBT
16,,SING,C3',C2',no,N,16,,199897,4412,PBT
17,,SING,C3',H3',no,N,17,,199897,4412,PBT
18,,SING,O3',HA,no,N,18,,199897,4412,PBT
19,,SING,C2',C1',no,N,19,,199897,4412,PBT
20,,SING,C2',H2'1,no,N,20,,199897,4412,PBT
21,,SING,C2',H2'2,no,N,21,,199897,4412,PBT
22,,SING,C1',N1,no,N,22,,199897,4412,PBT
23,,SING,C1',H1',no,N,23,,199897,4412,PBT
24,,SING,N1,C2,no,N,24,,199897,4412,PBT
25,,SING,N1,C6,no,N,25,,199897,4412,PBT
26,,DOUB,C2,O2,no,N,26,,199897,4412,PBT
27,,SING,C2,N3,no,N,27,,199897,4412,PBT
28,,SING,N3,C4,no,N,28,,199897,4412,PBT
29,,SING,N3,H3,no,N,29,,199897,4412,PBT
30,,DOUB,C4,O4,no,N,30,,199897,4412,PBT
31,,SING,C4,C5,no,N,31,,199897,4412,PBT
32,,SING,C5,C5M,no,N,32,,199897,4412,PBT
33,,SING,C5,C6,no,N,33,,199897,4412,PBT
34,,SING,C5,H5,no,N,34,,199897,4412,PBT
35,,SING,C5M,H5M1,no,N,35,,199897,4412,PBT
36,,SING,C5M,H5M2,no,N,36,,199897,4412,PBT
37,,SING,C5M,H5M3,no,N,37,,199897,4412,PBT
38,,SING,C6,H6C1,no,N,38,,199897,4412,PBT
39,,SING,C6,H6C2,no,N,39,,199897,4412,PBT
1,,DOUB,P,OP1,no,N,1,,199968,4415,TTD
2,,SING,P,OP2,no,N,2,,199968,4415,TTD
3,,SING,P,OP3,no,N,3,,199968,4415,TTD
4,,SING,P,O5',no,N,4,,199968,4415,TTD
5,,SING,OP2,HOP2,no,N,5,,199968,4415,TTD
6,,SING,OP3,HOP3,no,N,6,,199968,4415,TTD
7,,SING,O5',C5',no,N,7,,199968,4415,TTD
8,,SING,C5',C4R,no,N,8,,199968,4415,TTD
9,,SING,C5',H5',no,N,9,,199968,4415,TTD
10,,SING,C5',H5'',no,N,10,,199968,4415,TTD
11,,SING,C4R,O4',no,N,11,,199968,4415,TTD
12,,SING,C4R,C3R,no,N,12,,199968,4415,TTD
13,,SING,C4R,H4R,no,N,13,,199968,4415,TTD
14,,SING,O4',C1',no,N,14,,199968,4415,TTD
15,,SING,C3R,O3R,no,N,15,,199968,4415,TTD
16,,SING,C3R,C2',no,N,16,,199968,4415,TTD
17,,SING,C3R,H3R,no,N,17,,199968,4415,TTD
18,,SING,O3R,PB,no,N,18,,199968,4415,TTD
19,,SING,C2',C1',no,N,19,,199968,4415,TTD
20,,SING,C2',H2',no,N,20,,199968,4415,TTD
21,,SING,C2',H2'',no,N,21,,199968,4415,TTD
22,,SING,C1',N1,no,N,22,,199968,4415,TTD
23,,SING,C1',H1',no,N,23,,199968,4415,TTD
24,,SING,N1,C2,no,N,24,,199968,4415,TTD
25,,SING,N1,C6,no,N,25,,199968,4415,TTD
26,,DOUB,C2,O2,no,N,26,,199968,4415,TTD
27,,SING,C2,N3,no,N,27,,199968,4415,TTD
28,,SING,N3,C4,no,N,28,,199968,4415,TTD
29,,SING,N3,HN3,no,N,29,,199968,4415,TTD
30,,DOUB,C4,O4,no,N,30,,199968,4415,TTD
31,,SING,C4,C5,no,N,31,,199968,4415,TTD
32,,SING,C5,C5A,no,N,32,,199968,4415,TTD
33,,SING,C5,C6,no,N,33,,199968,4415,TTD
34,,SING,C5,C5T,no,N,34,,199968,4415,TTD
35,,SING,C5A,H5A1,no,N,35,,199968,4415,TTD
36,,SING,C5A,H5A2,no,N,36,,199968,4415,TTD
37,,SING,C5A,H5A3,no,N,37,,199968,4415,TTD
38,,SING,C6,C6T,no,N,38,,199968,4415,TTD
39,,SING,C6,H6,no,N,39,,199968,4415,TTD
40,,DOUB,PB,O5P,no,N,40,,199968,4415,TTD
41,,SING,PB,O4P,no,N,41,,199968,4415,TTD
42,,SING,PB,O5R,no,N,42,,199968,4415,TTD
43,,SING,O4P,H4P,no,N,43,,199968,4415,TTD
44,,SING,O5R,C5R,no,N,44,,199968,4415,TTD
45,,SING,C5R,C4',no,N,45,,199968,4415,TTD
46,,SING,C5R,H5R1,no,N,46,,199968,4415,TTD
47,,SING,C5R,H5R2,no,N,47,,199968,4415,TTD
48,,SING,O4R,C1R,no,N,48,,199968,4415,TTD
49,,SING,O4R,C4',no,N,49,,199968,4415,TTD
50,,SING,C2R,C1R,no,N,50,,199968,4415,TTD
51,,SING,C2R,C3',no,N,51,,199968,4415,TTD
52,,SING,C2R,H2R1,no,N,52,,199968,4415,TTD
53,,SING,C2R,H2R2,no,N,53,,199968,4415,TTD
54,,SING,C1R,N1T,no,N,54,,199968,4415,TTD
55,,SING,C1R,H1R,no,N,55,,199968,4415,TTD
56,,SING,N1T,C2T,no,N,56,,199968,4415,TTD
57,,SING,N1T,C6T,no,N,57,,199968,4415,TTD
58,,DOUB,C2T,O2T,no,N,58,,199968,4415,TTD
59,,SING,C2T,N3T,no,N,59,,199968,4415,TTD
60,,SING,N3T,C4T,no,N,60,,199968,4415,TTD
61,,SING,N3T,HT,no,N,61,,199968,4415,TTD
62,,DOUB,C4T,O4T,no,N,62,,199968,4415,TTD
63,,SING,C4T,C5T,no,N,63,,199968,4415,TTD
64,,SING,C5T,C5M,no,N,64,,199968,4415,TTD
65,,SING,C5T,C6T,no,N,65,,199968,4415,TTD
66,,SING,C5M,H71,no,N,66,,199968,4415,TTD
67,,SING,C5M,H72,no,N,67,,199968,4415,TTD
68,,SING,C5M,H73,no,N,68,,199968,4415,TTD
69,,SING,C6T,H6T,no,N,69,,199968,4415,TTD
70,,SING,C4',C3',no,N,70,,199968,4415,TTD
71,,SING,C4',H4',no,N,71,,199968,4415,TTD
72,,SING,C3',O3',no,N,72,,199968,4415,TTD
73,,SING,C3',H1,no,N,73,,199968,4415,TTD
74,,SING,O3',HO3',no,N,74,,199968,4415,TTD
1,,SING,N,HN1,no,N,1,,200101,4420,NH2
2,,SING,N,HN2,no,N,2,,200101,4420,NH2
1,,DOUB,C11,O11,no,N,1,,200234,4426,BTN
2,,SING,C11,O12,no,N,2,,200234,4426,BTN
3,,SING,C11,C10,no,N,3,,200234,4426,BTN
4,,SING,O12,HO2,no,N,4,,200234,4426,BTN
5,,SING,C10,C9,no,N,5,,200234,4426,BTN
6,,SING,C10,H101,no,N,6,,200234,4426,BTN
7,,SING,C10,H102,no,N,7,,200234,4426,BTN
8,,SING,C9,C8,no,N,8,,200234,4426,BTN
9,,SING,C9,H91,no,N,9,,200234,4426,BTN
10,,SING,C9,H92,no,N,10,,200234,4426,BTN
11,,SING,C8,C7,no,N,11,,200234,4426,BTN
12,,SING,C8,H81,no,N,12,,200234,4426,BTN
13,,SING,C8,H82,no,N,13,,200234,4426,BTN
14,,SING,C7,C2,no,N,14,,200234,4426,BTN
15,,SING,C7,H71,no,N,15,,200234,4426,BTN
16,,SING,C7,H72,no,N,16,,200234,4426,BTN
17,,SING,C2,S1,no,N,17,,200234,4426,BTN
18,,SING,C2,C4,no,N,18,,200234,4426,BTN
19,,SING,C2,H2,no,N,19,,200234,4426,BTN
20,,SING,S1,C6,no,N,20,,200234,4426,BTN
21,,SING,C6,C5,no,N,21,,200234,4426,BTN
22,,SING,C6,H61,no,N,22,,200234,4426,BTN
23,,SING,C6,H62,no,N,23,,200234,4426,BTN
24,,SING,C5,N1,no,N,24,,200234,4426,BTN
25,,SING,C5,C4,no,N,25,,200234,4426,BTN
26,,SING,C5,H5,no,N,26,,200234,4426,BTN
27,,SING,N1,C3,no,N,27,,200234,4426,BTN
28,,SING,N1,HN1,no,N,28,,200234,4426,BTN
29,,DOUB,C3,O3,no,N,29,,200234,4426,BTN
30,,SING,C3,N2,no,N,30,,200234,4426,BTN
31,,SING,N2,C4,no,N,31,,200234,4426,BTN
32,,SING,N2,HN2,no,N,32,,200234,4426,BTN
33,,SING,C4,H4,no,N,33,,200234,4426,BTN
1,,SING,FE,NA,no,N,1,,200451,4435,HEC
2,,SING,FE,NB,no,N,2,,200451,4435,HEC
3,,SING,FE,NC,no,N,3,,200451,4435,HEC
4,,SING,FE,ND,no,N,4,,200451,4435,HEC
5,,DOUB,CHA,C1A,no,N,5,,200451,4435,HEC
6,,SING,CHA,C4D,no,N,6,,200451,4435,HEC
7,,SING,CHA,HHA,no,N,7,,200451,4435,HEC
8,,DOUB,CHB,C4A,no,N,8,,200451,4435,HEC
9,,SING,CHB,C1B,no,N,9,,200451,4435,HEC
10,,SING,CHB,HHB,no,N,10,,200451,4435,HEC
11,,DOUB,CHC,C4B,no,N,11,,200451,4435,HEC
12,,SING,CHC,C1C,no,N,12,,200451,4435,HEC
13,,SING,CHC,HHC,no,N,13,,200451,4435,HEC
14,,DOUB,CHD,C4C,no,N,14,,200451,4435,HEC
15,,SING,CHD,C1D,no,N,15,,200451,4435,HEC
16,,SING,CHD,HHD,no,N,16,,200451,4435,HEC
17,,SING,NA,C1A,yes,N,17,,200451,4435,HEC
18,,SING,NA,C4A,yes,N,18,,200451,4435,HEC
19,,SING,C1A,C2A,yes,N,19,,200451,4435,HEC
20,,DOUB,C2A,C3A,yes,N,20,,200451,4435,HEC
21,,SING,C2A,CAA,no,N,21,,200451,4435,HEC
22,,SING,C3A,C4A,yes,N,22,,200451,4435,HEC
23,,SING,C3A,CMA,no,N,23,,200451,4435,HEC
24,,SING,CMA,HMA1,no,N,24,,200451,4435,HEC
25,,SING,CMA,HMA2,no,N,25,,200451,4435,HEC
26,,SING,CMA,HMA3,no,N,26,,200451,4435,HEC
27,,SING,CAA,CBA,no,N,27,,200451,4435,HEC
28,,SING,CAA,HAA1,no,N,28,,200451,4435,HEC
29,,SING,CAA,HAA2,no,N,29,,200451,4435,HEC
30,,SING,CBA,CGA,no,N,30,,200451,4435,HEC
31,,SING,CBA,HBA1,no,N,31,,200451,4435,HEC
32,,SING,CBA,HBA2,no,N,32,,200451,4435,HEC
33,,DOUB,CGA,O1A,no,N,33,,200451,4435,HEC
34,,SING,CGA,O2A,no,N,34,,200451,4435,HEC
35,,SING,O2A,H2A,no,N,35,,200451,4435,HEC
36,,SING,NB,C1B,yes,N,36,,200451,4435,HEC
37,,SING,NB,C4B,yes,N,37,,200451,4435,HEC
38,,DOUB,C1B,C2B,yes,N,38,,200451,4435,HEC
39,,SING,C2B,C3B,yes,N,39,,200451,4435,HEC
40,,SING,C2B,CMB,no,N,40,,200451,4435,HEC
41,,SING,C3B,C4B,yes,N,41,,200451,4435,HEC
42,,DOUB,C3B,CAB,no,E,42,,200451,4435,HEC
43,,SING,CMB,HMB1,no,N,43,,200451,4435,HEC
44,,SING,CMB,HMB2,no,N,44,,200451,4435,HEC
45,,SING,CMB,HMB3,no,N,45,,200451,4435,HEC
46,,SING,CAB,CBB,no,N,46,,200451,4435,HEC
47,,SING,CAB,HAB,no,N,47,,200451,4435,HEC
48,,SING,CBB,HBB1,no,N,48,,200451,4435,HEC
49,,SING,CBB,HBB2,no,N,49,,200451,4435,HEC
50,,SING,CBB,HBB3,no,N,50,,200451,4435,HEC
51,,SING,NC,C1C,yes,N,51,,200451,4435,HEC
52,,SING,NC,C4C,yes,N,52,,200451,4435,HEC
53,,DOUB,C1C,C2C,yes,N,53,,200451,4435,HEC
54,,SING,C2C,C3C,yes,N,54,,200451,4435,HEC
55,,SING,C2C,CMC,no,N,55,,200451,4435,HEC
56,,SING,C3C,C4C,yes,N,56,,200451,4435,HEC
57,,DOUB,C3C,CAC,no,E,57,,200451,4435,HEC
58,,SING,CMC,HMC1,no,N,58,,200451,4435,HEC
59,,SING,CMC,HMC2,no,N,59,,200451,4435,HEC
60,,SING,CMC,HMC3,no,N,60,,200451,4435,HEC
61,,SING,CAC,CBC,no,N,61,,200451,4435,HEC
62,,SING,CAC,HAC,no,N,62,,200451,4435,HEC
63,,SING,CBC,HBC1,no,N,63,,200451,4435,HEC
64,,SING,CBC,HBC2,no,N,64,,200451,4435,HEC
65,,SING,CBC,HBC3,no,N,65,,200451,4435,HEC
66,,SING,ND,C1D,yes,N,66,,200451,4435,HEC
67,,SING,ND,C4D,yes,N,67,,200451,4435,HEC
68,,DOUB,C1D,C2D,yes,N,68,,200451,4435,HEC
69,,SING,C2D,C3D,yes,N,69,,200451,4435,HEC
70,,SING,C2D,CMD,no,N,70,,200451,4435,HEC
71,,DOUB,C3D,C4D,yes,N,71,,200451,4435,HEC
72,,SING,C3D,CAD,no,N,72,,200451,4435,HEC
73,,SING,CMD,HMD1,no,N,73,,200451,4435,HEC
74,,SING,CMD,HMD2,no,N,74,,200451,4435,HEC
75,,SING,CMD,HMD3,no,N,75,,200451,4435,HEC
76,,SING,CAD,CBD,no,N,76,,200451,4435,HEC
77,,SING,CAD,HAD1,no,N,77,,200451,4435,HEC
78,,SING,CAD,HAD2,no,N,78,,200451,4435,HEC
79,,SING,CBD,CGD,no,N,79,,200451,4435,HEC
80,,SING,CBD,HBD1,no,N,80,,200451,4435,HEC
81,,SING,CBD,HBD2,no,N,81,,200451,4435,HEC
82,,DOUB,CGD,O1D,no,N,82,,200451,4435,HEC
83,,SING,CGD,O2D,no,N,83,,200451,4435,HEC
84,,SING,O2D,H2D,no,N,84,,200451,4435,HEC
1,,SING,FE,NA,no,N,1,,200474,4436,HEC
2,,SING,FE,NB,no,N,2,,200474,4436,HEC
3,,SING,FE,NC,no,N,3,,200474,4436,HEC
4,,SING,FE,ND,no,N,4,,200474,4436,HEC
5,,DOUB,CHA,C1A,no,N,5,,200474,4436,HEC
6,,SING,CHA,C4D,no,N,6,,200474,4436,HEC
7,,SING,CHA,HHA,no,N,7,,200474,4436,HEC
8,,DOUB,CHB,C4A,no,N,8,,200474,4436,HEC
9,,SING,CHB,C1B,no,N,9,,200474,4436,HEC
10,,SING,CHB,HHB,no,N,10,,200474,4436,HEC
11,,DOUB,CHC,C4B,no,N,11,,200474,4436,HEC
12,,SING,CHC,C1C,no,N,12,,200474,4436,HEC
13,,SING,CHC,HHC,no,N,13,,200474,4436,HEC
14,,DOUB,CHD,C4C,no,N,14,,200474,4436,HEC
15,,SING,CHD,C1D,no,N,15,,200474,4436,HEC
16,,SING,CHD,HHD,no,N,16,,200474,4436,HEC
17,,SING,NA,C1A,yes,N,17,,200474,4436,HEC
18,,SING,NA,C4A,yes,N,18,,200474,4436,HEC
19,,SING,C1A,C2A,yes,N,19,,200474,4436,HEC
20,,DOUB,C2A,C3A,yes,N,20,,200474,4436,HEC
21,,SING,C2A,CAA,no,N,21,,200474,4436,HEC
22,,SING,C3A,C4A,yes,N,22,,200474,4436,HEC
23,,SING,C3A,CMA,no,N,23,,200474,4436,HEC
24,,SING,CMA,HMA1,no,N,24,,200474,4436,HEC
25,,SING,CMA,HMA2,no,N,25,,200474,4436,HEC
26,,SING,CMA,HMA3,no,N,26,,200474,4436,HEC
27,,SING,CAA,CBA,no,N,27,,200474,4436,HEC
28,,SING,CAA,HAA1,no,N,28,,200474,4436,HEC
29,,SING,CAA,HAA2,no,N,29,,200474,4436,HEC
30,,SING,CBA,CGA,no,N,30,,200474,4436,HEC
31,,SING,CBA,HBA1,no,N,31,,200474,4436,HEC
32,,SING,CBA,HBA2,no,N,32,,200474,4436,HEC
33,,DOUB,CGA,O1A,no,N,33,,200474,4436,HEC
34,,SING,CGA,O2A,no,N,34,,200474,4436,HEC
35,,SING,O2A,H2A,no,N,35,,200474,4436,HEC
36,,SING,NB,C1B,yes,N,36,,200474,4436,HEC
37,,SING,NB,C4B,yes,N,37,,200474,4436,HEC
38,,DOUB,C1B,C2B,yes,N,38,,200474,4436,HEC
39,,SING,C2B,C3B,yes,N,39,,200474,4436,HEC
40,,SING,C2B,CMB,no,N,40,,200474,4436,HEC
41,,SING,C3B,C4B,yes,N,41,,200474,4436,HEC
42,,DOUB,C3B,CAB,no,E,42,,200474,4436,HEC
43,,SING,CMB,HMB1,no,N,43,,200474,4436,HEC
44,,SING,CMB,HMB2,no,N,44,,200474,4436,HEC
45,,SING,CMB,HMB3,no,N,45,,200474,4436,HEC
46,,SING,CAB,CBB,no,N,46,,200474,4436,HEC
47,,SING,CAB,HAB,no,N,47,,200474,4436,HEC
48,,SING,CBB,HBB1,no,N,48,,200474,4436,HEC
49,,SING,CBB,HBB2,no,N,49,,200474,4436,HEC
50,,SING,CBB,HBB3,no,N,50,,200474,4436,HEC
51,,SING,NC,C1C,yes,N,51,,200474,4436,HEC
52,,SING,NC,C4C,yes,N,52,,200474,4436,HEC
53,,DOUB,C1C,C2C,yes,N,53,,200474,4436,HEC
54,,SING,C2C,C3C,yes,N,54,,200474,4436,HEC
55,,SING,C2C,CMC,no,N,55,,200474,4436,HEC
56,,SING,C3C,C4C,yes,N,56,,200474,4436,HEC
57,,DOUB,C3C,CAC,no,E,57,,200474,4436,HEC
58,,SING,CMC,HMC1,no,N,58,,200474,4436,HEC
59,,SING,CMC,HMC2,no,N,59,,200474,4436,HEC
60,,SING,CMC,HMC3,no,N,60,,200474,4436,HEC
61,,SING,CAC,CBC,no,N,61,,200474,4436,HEC
62,,SING,CAC,HAC,no,N,62,,200474,4436,HEC
63,,SING,CBC,HBC1,no,N,63,,200474,4436,HEC
64,,SING,CBC,HBC2,no,N,64,,200474,4436,HEC
65,,SING,CBC,HBC3,no,N,65,,200474,4436,HEC
66,,SING,ND,C1D,yes,N,66,,200474,4436,HEC
67,,SING,ND,C4D,yes,N,67,,200474,4436,HEC
68,,DOUB,C1D,C2D,yes,N,68,,200474,4436,HEC
69,,SING,C2D,C3D,yes,N,69,,200474,4436,HEC
70,,SING,C2D,CMD,no,N,70,,200474,4436,HEC
71,,DOUB,C3D,C4D,yes,N,71,,200474,4436,HEC
72,,SING,C3D,CAD,no,N,72,,200474,4436,HEC
73,,SING,CMD,HMD1,no,N,73,,200474,4436,HEC
74,,SING,CMD,HMD2,no,N,74,,200474,4436,HEC
75,,SING,CMD,HMD3,no,N,75,,200474,4436,HEC
76,,SING,CAD,CBD,no,N,76,,200474,4436,HEC
77,,SING,CAD,HAD1,no,N,77,,200474,4436,HEC
78,,SING,CAD,HAD2,no,N,78,,200474,4436,HEC
79,,SING,CBD,CGD,no,N,79,,200474,4436,HEC
80,,SING,CBD,HBD1,no,N,80,,200474,4436,HEC
81,,SING,CBD,HBD2,no,N,81,,200474,4436,HEC
82,,DOUB,CGD,O1D,no,N,82,,200474,4436,HEC
83,,SING,CGD,O2D,no,N,83,,200474,4436,HEC
84,,SING,O2D,H2D,no,N,84,,200474,4436,HEC
1,,SING,FE1,S1,no,N,1,,200560,4439,FES
2,,SING,FE1,S2,no,N,2,,200560,4439,FES
3,,SING,FE2,S1,no,N,3,,200560,4439,FES
4,,SING,FE2,S2,no,N,4,,200560,4439,FES
1,,SING,FE1,S1,no,N,1,,200588,4440,FES
2,,SING,FE1,S2,no,N,2,,200588,4440,FES
3,,SING,FE2,S1,no,N,3,,200588,4440,FES
4,,SING,FE2,S2,no,N,4,,200588,4440,FES
1,,SING,FE1,S1,no,N,1,,200603,4441,FES
2,,SING,FE1,S2,no,N,2,,200603,4441,FES
3,,SING,FE2,S1,no,N,3,,200603,4441,FES
4,,SING,FE2,S2,no,N,4,,200603,4441,FES
1,,SING,FE1,S1,no,N,1,,200618,4442,FES
2,,SING,FE1,S2,no,N,2,,200618,4442,FES
3,,SING,FE2,S1,no,N,3,,200618,4442,FES
4,,SING,FE2,S2,no,N,4,,200618,4442,FES
1,,DOUB,OH,CH,no,N,1,,200653,4444,ALY
2,,SING,CH,CH3,no,N,2,,200653,4444,ALY
3,,SING,CH,NZ,no,N,3,,200653,4444,ALY
4,,SING,CH3,HH31,no,N,4,,200653,4444,ALY
5,,SING,CH3,HH32,no,N,5,,200653,4444,ALY
6,,SING,CH3,HH33,no,N,6,,200653,4444,ALY
7,,SING,NZ,CE,no,N,7,,200653,4444,ALY
8,,SING,NZ,HZ,no,N,8,,200653,4444,ALY
9,,SING,CE,CD,no,N,9,,200653,4444,ALY
10,,SING,CE,HE3,no,N,10,,200653,4444,ALY
11,,SING,CE,HE2,no,N,11,,200653,4444,ALY
12,,SING,CD,CG,no,N,12,,200653,4444,ALY
13,,SING,CD,HD3,no,N,13,,200653,4444,ALY
14,,SING,CD,HD2,no,N,14,,200653,4444,ALY
15,,SING,CG,CB,no,N,15,,200653,4444,ALY
16,,SING,CG,HG3,no,N,16,,200653,4444,ALY
17,,SING,CG,HG2,no,N,17,,200653,4444,ALY
18,,SING,CB,CA,no,N,18,,200653,4444,ALY
19,,SING,CB,HB3,no,N,19,,200653,4444,ALY
20,,SING,CB,HB2,no,N,20,,200653,4444,ALY
21,,SING,CA,N,no,N,21,,200653,4444,ALY
22,,SING,CA,C,no,N,22,,200653,4444,ALY
23,,SING,CA,HCA,no,N,23,,200653,4444,ALY
24,,SING,N,H,no,N,24,,200653,4444,ALY
25,,SING,N,H2,no,N,25,,200653,4444,ALY
26,,DOUB,C,O,no,N,26,,200653,4444,ALY
27,,SING,C,OXT,no,N,27,,200653,4444,ALY
28,,SING,OXT,HXT,no,N,28,,200653,4444,ALY
1,,SING,FE1,S1,no,N,1,,200654,4444,FES
2,,SING,FE1,S2,no,N,2,,200654,4444,FES
3,,SING,FE2,S1,no,N,3,,200654,4444,FES
4,,SING,FE2,S2,no,N,4,,200654,4444,FES
1,,SING,N,CA,no,N,1,,201139,4464,HYP
2,,SING,N,CD,no,N,2,,201139,4464,HYP
3,,SING,N,H,no,N,3,,201139,4464,HYP
4,,SING,CA,C,no,N,4,,201139,4464,HYP
5,,SING,CA,CB,no,N,5,,201139,4464,HYP
6,,SING,CA,HA,no,N,6,,201139,4464,HYP
7,,DOUB,C,O,no,N,7,,201139,4464,HYP
8,,SING,C,OXT,no,N,8,,201139,4464,HYP
9,,SING,CB,CG,no,N,9,,201139,4464,HYP
10,,SING,CB,HB2,no,N,10,,201139,4464,HYP
11,,SING,CB,HB3,no,N,11,,201139,4464,HYP
12,,SING,CG,CD,no,N,12,,201139,4464,HYP
13,,SING,CG,OD1,no,N,13,,201139,4464,HYP
14,,SING,CG,HG,no,N,14,,201139,4464,HYP
15,,SING,CD,HD22,no,N,15,,201139,4464,HYP
16,,SING,CD,HD23,no,N,16,,201139,4464,HYP
17,,SING,OD1,HD1,no,N,17,,201139,4464,HYP
18,,SING,OXT,HXT,no,N,18,,201139,4464,HYP
1,,SING,N,CA,no,N,1,,201140,4464,DTR
2,,SING,N,H,no,N,2,,201140,4464,DTR
3,,SING,N,HN2,no,N,3,,201140,4464,DTR
4,,SING,CA,CB,no,N,4,,201140,4464,DTR
5,,SING,CA,C,no,N,5,,201140,4464,DTR
6,,SING,CA,HA,no,N,6,,201140,4464,DTR
7,,SING,CB,CG,no,N,7,,201140,4464,DTR
8,,SING,CB,HB2,no,N,8,,201140,4464,DTR
9,,SING,CB,HB3,no,N,9,,201140,4464,DTR
10,,DOUB,CG,CD1,yes,N,10,,201140,4464,DTR
11,,SING,CG,CD2,yes,N,11,,201140,4464,DTR
12,,SING,CD1,NE1,yes,N,12,,201140,4464,DTR
13,,SING,CD1,HD1,no,N,13,,201140,4464,DTR
14,,SING,NE1,CE2,yes,N,14,,201140,4464,DTR
15,,SING,NE1,HE1,no,N,15,,201140,4464,DTR
16,,DOUB,CE2,CZ2,yes,N,16,,201140,4464,DTR
17,,SING,CE2,CD2,yes,N,17,,201140,4464,DTR
18,,SING,CZ2,CH2,yes,N,18,,201140,4464,DTR
19,,SING,CZ2,HZ2,no,N,19,,201140,4464,DTR
20,,DOUB,CH2,CZ3,yes,N,20,,201140,4464,DTR
21,,SING,CH2,HH2,no,N,21,,201140,4464,DTR
22,,SING,CZ3,CE3,yes,N,22,,201140,4464,DTR
23,,SING,CZ3,HZ3,no,N,23,,201140,4464,DTR
24,,DOUB,CE3,CD2,yes,N,24,,201140,4464,DTR
25,,SING,CE3,HE3,no,N,25,,201140,4464,DTR
26,,DOUB,C,O,no,N,26,,201140,4464,DTR
27,,SING,C,OXT,no,N,27,,201140,4464,DTR
28,,SING,OXT,HXT,no,N,28,,201140,4464,DTR
1,,SING,N,CA,no,N,1,,201235,4468,HYP
2,,SING,N,CD,no,N,2,,201235,4468,HYP
3,,SING,N,H,no,N,3,,201235,4468,HYP
4,,SING,CA,C,no,N,4,,201235,4468,HYP
5,,SING,CA,CB,no,N,5,,201235,4468,HYP
6,,SING,CA,HA,no,N,6,,201235,4468,HYP
7,,DOUB,C,O,no,N,7,,201235,4468,HYP
8,,SING,C,OXT,no,N,8,,201235,4468,HYP
9,,SING,CB,CG,no,N,9,,201235,4468,HYP
10,,SING,CB,HB2,no,N,10,,201235,4468,HYP
11,,SING,CB,HB3,no,N,11,,201235,4468,HYP
12,,SING,CG,CD,no,N,12,,201235,4468,HYP
13,,SING,CG,OD1,no,N,13,,201235,4468,HYP
14,,SING,CG,HG,no,N,14,,201235,4468,HYP
15,,SING,CD,HD22,no,N,15,,201235,4468,HYP
16,,SING,CD,HD23,no,N,16,,201235,4468,HYP
17,,SING,OD1,HD1,no,N,17,,201235,4468,HYP
18,,SING,OXT,HXT,no,N,18,,201235,4468,HYP
1,,SING,N,CA,no,N,1,,201236,4468,DTR
2,,SING,N,H,no,N,2,,201236,4468,DTR
3,,SING,N,HN2,no,N,3,,201236,4468,DTR
4,,SING,CA,CB,no,N,4,,201236,4468,DTR
5,,SING,CA,C,no,N,5,,201236,4468,DTR
6,,SING,CA,HA,no,N,6,,201236,4468,DTR
7,,SING,CB,CG,no,N,7,,201236,4468,DTR
8,,SING,CB,HB2,no,N,8,,201236,4468,DTR
9,,SING,CB,HB3,no,N,9,,201236,4468,DTR
10,,DOUB,CG,CD1,yes,N,10,,201236,4468,DTR
11,,SING,CG,CD2,yes,N,11,,201236,4468,DTR
12,,SING,CD1,NE1,yes,N,12,,201236,4468,DTR
13,,SING,CD1,HD1,no,N,13,,201236,4468,DTR
14,,SING,NE1,CE2,yes,N,14,,201236,4468,DTR
15,,SING,NE1,HE1,no,N,15,,201236,4468,DTR
16,,DOUB,CE2,CZ2,yes,N,16,,201236,4468,DTR
17,,SING,CE2,CD2,yes,N,17,,201236,4468,DTR
18,,SING,CZ2,CH2,yes,N,18,,201236,4468,DTR
19,,SING,CZ2,HZ2,no,N,19,,201236,4468,DTR
20,,DOUB,CH2,CZ3,yes,N,20,,201236,4468,DTR
21,,SING,CH2,HH2,no,N,21,,201236,4468,DTR
22,,SING,CZ3,CE3,yes,N,22,,201236,4468,DTR
23,,SING,CZ3,HZ3,no,N,23,,201236,4468,DTR
24,,DOUB,CE3,CD2,yes,N,24,,201236,4468,DTR
25,,SING,CE3,HE3,no,N,25,,201236,4468,DTR
26,,DOUB,C,O,no,N,26,,201236,4468,DTR
27,,SING,C,OXT,no,N,27,,201236,4468,DTR
28,,SING,OXT,HXT,no,N,28,,201236,4468,DTR
1,,SING,N,CA,no,N,1,,201251,4469,HYP
2,,SING,N,CD,no,N,2,,201251,4469,HYP
3,,SING,N,H,no,N,3,,201251,4469,HYP
4,,SING,CA,C,no,N,4,,201251,4469,HYP
5,,SING,CA,CB,no,N,5,,201251,4469,HYP
6,,SING,CA,HA,no,N,6,,201251,4469,HYP
7,,DOUB,C,O,no,N,7,,201251,4469,HYP
8,,SING,C,OXT,no,N,8,,201251,4469,HYP
9,,SING,CB,CG,no,N,9,,201251,4469,HYP
10,,SING,CB,HB2,no,N,10,,201251,4469,HYP
11,,SING,CB,HB3,no,N,11,,201251,4469,HYP
12,,SING,CG,CD,no,N,12,,201251,4469,HYP
13,,SING,CG,OD1,no,N,13,,201251,4469,HYP
14,,SING,CG,HG,no,N,14,,201251,4469,HYP
15,,SING,CD,HD22,no,N,15,,201251,4469,HYP
16,,SING,CD,HD23,no,N,16,,201251,4469,HYP
17,,SING,OD1,HD1,no,N,17,,201251,4469,HYP
18,,SING,OXT,HXT,no,N,18,,201251,4469,HYP
1,,SING,N,CA,no,N,1,,201252,4469,DTR
2,,SING,N,H,no,N,2,,201252,4469,DTR
3,,SING,N,HN2,no,N,3,,201252,4469,DTR
4,,SING,CA,CB,no,N,4,,201252,4469,DTR
5,,SING,CA,C,no,N,5,,201252,4469,DTR
6,,SING,CA,HA,no,N,6,,201252,4469,DTR
7,,SING,CB,CG,no,N,7,,201252,4469,DTR
8,,SING,CB,HB2,no,N,8,,201252,4469,DTR
9,,SING,CB,HB3,no,N,9,,201252,4469,DTR
10,,DOUB,CG,CD1,yes,N,10,,201252,4469,DTR
11,,SING,CG,CD2,yes,N,11,,201252,4469,DTR
12,,SING,CD1,NE1,yes,N,12,,201252,4469,DTR
13,,SING,CD1,HD1,no,N,13,,201252,4469,DTR
14,,SING,NE1,CE2,yes,N,14,,201252,4469,DTR
15,,SING,NE1,HE1,no,N,15,,201252,4469,DTR
16,,DOUB,CE2,CZ2,yes,N,16,,201252,4469,DTR
17,,SING,CE2,CD2,yes,N,17,,201252,4469,DTR
18,,SING,CZ2,CH2,yes,N,18,,201252,4469,DTR
19,,SING,CZ2,HZ2,no,N,19,,201252,4469,DTR
20,,DOUB,CH2,CZ3,yes,N,20,,201252,4469,DTR
21,,SING,CH2,HH2,no,N,21,,201252,4469,DTR
22,,SING,CZ3,CE3,yes,N,22,,201252,4469,DTR
23,,SING,CZ3,HZ3,no,N,23,,201252,4469,DTR
24,,DOUB,CE3,CD2,yes,N,24,,201252,4469,DTR
25,,SING,CE3,HE3,no,N,25,,201252,4469,DTR
26,,DOUB,C,O,no,N,26,,201252,4469,DTR
27,,SING,C,OXT,no,N,27,,201252,4469,DTR
28,,SING,OXT,HXT,no,N,28,,201252,4469,DTR
1,,SING,CHA,C1A,yes,N,1,,201302,4471,HEM
2,,DOUB,CHA,C4D,yes,N,2,,201302,4471,HEM
3,,SING,CHA,HHA,no,N,3,,201302,4471,HEM
4,,SING,CHB,C4A,yes,N,4,,201302,4471,HEM
5,,DOUB,CHB,C1B,yes,N,5,,201302,4471,HEM
6,,SING,CHB,HHB,no,N,6,,201302,4471,HEM
7,,SING,CHC,C4B,yes,N,7,,201302,4471,HEM
8,,DOUB,CHC,C1C,yes,N,8,,201302,4471,HEM
9,,SING,CHC,HHC,no,N,9,,201302,4471,HEM
10,,DOUB,CHD,C4C,yes,N,10,,201302,4471,HEM
11,,SING,CHD,C1D,yes,N,11,,201302,4471,HEM
12,,SING,CHD,HHD,no,N,12,,201302,4471,HEM
13,,DOUB,C1A,C2A,yes,N,13,,201302,4471,HEM
14,,SING,C1A,NA,yes,N,14,,201302,4471,HEM
15,,SING,C2A,C3A,yes,N,15,,201302,4471,HEM
16,,SING,C2A,CAA,no,N,16,,201302,4471,HEM
17,,DOUB,C3A,C4A,yes,N,17,,201302,4471,HEM
18,,SING,C3A,CMA,no,N,18,,201302,4471,HEM
19,,SING,C4A,NA,yes,N,19,,201302,4471,HEM
20,,SING,CMA,HMA,no,N,20,,201302,4471,HEM
21,,SING,CMA,HMAA,no,N,21,,201302,4471,HEM
22,,SING,CMA,HMAB,no,N,22,,201302,4471,HEM
23,,SING,CAA,CBA,no,N,23,,201302,4471,HEM
24,,SING,CAA,HAA,no,N,24,,201302,4471,HEM
25,,SING,CAA,HAAA,no,N,25,,201302,4471,HEM
26,,SING,CBA,CGA,no,N,26,,201302,4471,HEM
27,,SING,CBA,HBA,no,N,27,,201302,4471,HEM
28,,SING,CBA,HBAA,no,N,28,,201302,4471,HEM
29,,DOUB,CGA,O1A,no,N,29,,201302,4471,HEM
30,,SING,CGA,O2A,no,N,30,,201302,4471,HEM
31,,SING,C1B,C2B,no,N,31,,201302,4471,HEM
32,,SING,C1B,NB,yes,N,32,,201302,4471,HEM
33,,DOUB,C2B,C3B,yes,N,33,,201302,4471,HEM
34,,SING,C2B,CMB,yes,N,34,,201302,4471,HEM
35,,SING,C3B,C4B,no,N,35,,201302,4471,HEM
36,,SING,C3B,CAB,yes,N,36,,201302,4471,HEM
37,,DOUB,C4B,NB,no,N,37,,201302,4471,HEM
38,,SING,CMB,HMB,yes,N,38,,201302,4471,HEM
39,,SING,CMB,HMBA,no,N,39,,201302,4471,HEM
40,,SING,CMB,HMBB,no,N,40,,201302,4471,HEM
41,,DOUB,CAB,CBB,no,N,41,,201302,4471,HEM
42,,SING,CAB,HAB,no,N,42,,201302,4471,HEM
43,,SING,CBB,HBB,no,N,43,,201302,4471,HEM
44,,SING,CBB,HBBA,no,N,44,,201302,4471,HEM
45,,SING,C1C,C2C,no,N,45,,201302,4471,HEM
46,,SING,C1C,NC,yes,N,46,,201302,4471,HEM
47,,DOUB,C2C,C3C,yes,N,47,,201302,4471,HEM
48,,SING,C2C,CMC,yes,N,48,,201302,4471,HEM
49,,SING,C3C,C4C,no,N,49,,201302,4471,HEM
50,,SING,C3C,CAC,yes,N,50,,201302,4471,HEM
51,,SING,C4C,NC,no,N,51,,201302,4471,HEM
52,,SING,CMC,HMC,yes,N,52,,201302,4471,HEM
53,,SING,CMC,HMCA,no,N,53,,201302,4471,HEM
54,,SING,CMC,HMCB,no,N,54,,201302,4471,HEM
55,,DOUB,CAC,CBC,no,N,55,,201302,4471,HEM
56,,SING,CAC,HAC,no,N,56,,201302,4471,HEM
57,,SING,CBC,HBC,no,N,57,,201302,4471,HEM
58,,SING,CBC,HBCA,no,N,58,,201302,4471,HEM
59,,SING,C1D,C2D,no,N,59,,201302,4471,HEM
60,,DOUB,C1D,ND,yes,N,60,,201302,4471,HEM
61,,DOUB,C2D,C3D,yes,N,61,,201302,4471,HEM
62,,SING,C2D,CMD,yes,N,62,,201302,4471,HEM
63,,SING,C3D,C4D,no,N,63,,201302,4471,HEM
64,,SING,C3D,CAD,yes,N,64,,201302,4471,HEM
65,,SING,C4D,ND,no,N,65,,201302,4471,HEM
66,,SING,CMD,HMD,yes,N,66,,201302,4471,HEM
67,,SING,CMD,HMDA,no,N,67,,201302,4471,HEM
68,,SING,CMD,HMDB,no,N,68,,201302,4471,HEM
69,,SING,CAD,CBD,no,N,69,,201302,4471,HEM
70,,SING,CAD,HAD,no,N,70,,201302,4471,HEM
71,,SING,CAD,HADA,no,N,71,,201302,4471,HEM
72,,SING,CBD,CGD,no,N,72,,201302,4471,HEM
73,,SING,CBD,HBD,no,N,73,,201302,4471,HEM
74,,SING,CBD,HBDA,no,N,74,,201302,4471,HEM
75,,DOUB,CGD,O1D,no,N,75,,201302,4471,HEM
76,,SING,CGD,O2D,no,N,76,,201302,4471,HEM
77,,SING,O2A,H2A,no,N,77,,201302,4471,HEM
78,,SING,O2D,H2D,no,N,78,,201302,4471,HEM
79,,SING,FE,NA,no,N,79,,201302,4471,HEM
80,,SING,FE,NB,no,N,80,,201302,4471,HEM
81,,SING,FE,NC,no,N,81,,201302,4471,HEM
82,,SING,FE,ND,no,N,82,,201302,4471,HEM
1,,SING,BE,F1,no,N,1,,201335,4472,BF2
2,,SING,BE,F2,no,N,2,,201335,4472,BF2
1,,SING,N,CA,no,N,1,,201395,4476,SEP
2,,SING,N,H,no,N,2,,201395,4476,SEP
3,,SING,N,H2,no,N,3,,201395,4476,SEP
4,,SING,CA,CB,no,N,4,,201395,4476,SEP
5,,SING,CA,C,no,N,5,,201395,4476,SEP
6,,SING,CA,HA,no,N,6,,201395,4476,SEP
7,,SING,CB,OG,no,N,7,,201395,4476,SEP
8,,SING,CB,HB2,no,N,8,,201395,4476,SEP
9,,SING,CB,HB3,no,N,9,,201395,4476,SEP
10,,SING,OG,P,no,N,10,,201395,4476,SEP
11,,DOUB,C,O,no,N,11,,201395,4476,SEP
12,,SING,C,OXT,no,N,12,,201395,4476,SEP
13,,SING,OXT,HXT,no,N,13,,201395,4476,SEP
14,,DOUB,P,O1P,no,N,14,,201395,4476,SEP
15,,SING,P,O2P,no,N,15,,201395,4476,SEP
16,,SING,P,O3P,no,N,16,,201395,4476,SEP
17,,SING,O2P,HOP2,no,N,17,,201395,4476,SEP
18,,SING,O3P,HOP3,no,N,18,,201395,4476,SEP
1,,SING,N,CA,no,N,1,,201410,4477,SEP
2,,SING,N,H,no,N,2,,201410,4477,SEP
3,,SING,N,H2,no,N,3,,201410,4477,SEP
4,,SING,CA,CB,no,N,4,,201410,4477,SEP
5,,SING,CA,C,no,N,5,,201410,4477,SEP
6,,SING,CA,HA,no,N,6,,201410,4477,SEP
7,,SING,CB,OG,no,N,7,,201410,4477,SEP
8,,SING,CB,HB2,no,N,8,,201410,4477,SEP
9,,SING,CB,HB3,no,N,9,,201410,4477,SEP
10,,SING,OG,P,no,N,10,,201410,4477,SEP
11,,DOUB,C,O,no,N,11,,201410,4477,SEP
12,,SING,C,OXT,no,N,12,,201410,4477,SEP
13,,SING,OXT,HXT,no,N,13,,201410,4477,SEP
14,,DOUB,P,O1P,no,N,14,,201410,4477,SEP
15,,SING,P,O2P,no,N,15,,201410,4477,SEP
16,,SING,P,O3P,no,N,16,,201410,4477,SEP
17,,SING,O2P,HOP2,no,N,17,,201410,4477,SEP
18,,SING,O3P,HOP3,no,N,18,,201410,4477,SEP
1,,DOUB,C,O,no,N,1,,201452,4483,ACE
2,,SING,C,CH3,no,N,2,,201452,4483,ACE
3,,SING,C,H,no,N,3,,201452,4483,ACE
4,,SING,CH3,H1,no,N,4,,201452,4483,ACE
5,,SING,CH3,H2,no,N,5,,201452,4483,ACE
6,,SING,CH3,H3,no,N,6,,201452,4483,ACE
1,,SING,N,HN1,no,N,1,,201453,4483,NH2
2,,SING,N,HN2,no,N,2,,201453,4483,NH2
1,,DOUB,P,OP1,no,N,1,,201501,4488,64T
2,,SING,P,OP2,no,N,2,,201501,4488,64T
3,,SING,P,O5',no,N,3,,201501,4488,64T
4,,SING,P,OP3,no,N,4,,201501,4488,64T
5,,SING,OP2,HOP2,no,N,5,,201501,4488,64T
6,,SING,O5',C5',no,N,6,,201501,4488,64T
7,,SING,C5',C4',no,N,7,,201501,4488,64T
8,,SING,C5',H5',no,N,8,,201501,4488,64T
9,,SING,C5',H5'',no,N,9,,201501,4488,64T
10,,SING,C4',O4',no,N,10,,201501,4488,64T
11,,SING,C4',C3',no,N,11,,201501,4488,64T
12,,SING,C4',H4',no,N,12,,201501,4488,64T
13,,SING,O4',C1',no,N,13,,201501,4488,64T
14,,SING,C3',O3',no,N,14,,201501,4488,64T
15,,SING,C3',C2',no,N,15,,201501,4488,64T
16,,SING,C3',H3',no,N,16,,201501,4488,64T
17,,SING,O3',HO3',no,N,17,,201501,4488,64T
18,,SING,C2',C1',no,N,18,,201501,4488,64T
19,,SING,C2',H2',no,N,19,,201501,4488,64T
20,,SING,C2',H2'',no,N,20,,201501,4488,64T
21,,SING,C1',N1,no,N,21,,201501,4488,64T
22,,SING,C1',H1',no,N,22,,201501,4488,64T
23,,SING,N1,C2,no,N,23,,201501,4488,64T
24,,SING,N1,C6,no,N,24,,201501,4488,64T
25,,DOUB,C2,O2,no,N,25,,201501,4488,64T
26,,SING,C2,N3,no,N,26,,201501,4488,64T
27,,SING,N3,C4,no,N,27,,201501,4488,64T
28,,SING,N3,H3,no,N,28,,201501,4488,64T
29,,DOUB,C4,O4,no,N,29,,201501,4488,64T
30,,SING,C4,C5,no,N,30,,201501,4488,64T
31,,SING,C5,C5M,no,N,31,,201501,4488,64T
32,,SING,C5,O5,no,N,32,,201501,4488,64T
33,,SING,C5,C6,no,N,33,,201501,4488,64T
34,,SING,C5M,H71,no,N,34,,201501,4488,64T
35,,SING,C5M,H72,no,N,35,,201501,4488,64T
36,,SING,C5M,H73,no,N,36,,201501,4488,64T
37,,SING,O5,HO5,no,N,37,,201501,4488,64T
38,,SING,C6,H61,no,N,38,,201501,4488,64T
39,,SING,C6,H62,no,N,39,,201501,4488,64T
40,,SING,OP3,HOP3,no,N,40,,201501,4488,64T
1,,SING,N,HN1,no,N,1,,201517,449,NH2
2,,SING,N,HN2,no,N,2,,201517,449,NH2
1,,SING,N,HN1,no,N,1,,201704,450,NH2
2,,SING,N,HN2,no,N,2,,201704,450,NH2
1,,SING,N,HN1,no,N,1,,201718,4500,NH2
2,,SING,N,HN2,no,N,2,,201718,4500,NH2
1,,SING,N,HN1,no,N,1,,201741,4503,NH2
2,,SING,N,HN2,no,N,2,,201741,4503,NH2
1,,SING,N,HN1,no,N,1,,201821,451,NH2
2,,SING,N,HN2,no,N,2,,201821,451,NH2
1,,SING,N,HN1,no,N,1,,201941,452,NH2
2,,SING,N,HN2,no,N,2,,201941,452,NH2
1,,DOUB,P,O1,no,N,1,,202048,4528,PO4
2,,SING,P,O2,no,N,2,,202048,4528,PO4
3,,SING,P,O3,no,N,3,,202048,4528,PO4
4,,SING,P,O4,no,N,4,,202048,4528,PO4
1,,SING,N,HN1,no,N,1,,202070,453,NH2
2,,SING,N,HN2,no,N,2,,202070,453,NH2
1,,SING,N1,C2,no,N,1,,202085,4536,DUR
2,,SING,N1,C6,no,N,2,,202085,4536,DUR
3,,SING,N1,C1',no,N,3,,202085,4536,DUR
4,,SING,C2,N3,no,N,4,,202085,4536,DUR
5,,DOUB,C2,O2,no,N,5,,202085,4536,DUR
6,,SING,N3,C4,no,N,6,,202085,4536,DUR
7,,SING,N3,HN3,no,N,7,,202085,4536,DUR
8,,SING,C4,C5,no,N,8,,202085,4536,DUR
9,,DOUB,C4,O4,no,N,9,,202085,4536,DUR
10,,DOUB,C5,C6,no,N,10,,202085,4536,DUR
11,,SING,C5,H5,no,N,11,,202085,4536,DUR
12,,SING,C6,H6,no,N,12,,202085,4536,DUR
13,,SING,C1',C2',no,N,13,,202085,4536,DUR
14,,SING,C1',O4',no,N,14,,202085,4536,DUR
15,,SING,C1',H1',no,N,15,,202085,4536,DUR
16,,SING,C2',C3',no,N,16,,202085,4536,DUR
17,,SING,C2',H2'1,no,N,17,,202085,4536,DUR
18,,SING,C2',H2'2,no,N,18,,202085,4536,DUR
19,,SING,C3',C4',no,N,19,,202085,4536,DUR
20,,SING,C3',O3',no,N,20,,202085,4536,DUR
21,,SING,C3',H3',no,N,21,,202085,4536,DUR
22,,SING,C4',O4',no,N,22,,202085,4536,DUR
23,,SING,C4',C5',no,N,23,,202085,4536,DUR
24,,SING,C4',H4',no,N,24,,202085,4536,DUR
25,,SING,O3',HO3',no,N,25,,202085,4536,DUR
26,,SING,C5',O5',no,N,26,,202085,4536,DUR
27,,SING,C5',H5'1,no,N,27,,202085,4536,DUR
28,,SING,C5',H5'2,no,N,28,,202085,4536,DUR
29,,SING,O5',HO5',no,N,29,,202085,4536,DUR
1,,SING,N,HN1,no,N,1,,202107,454,NH2
2,,SING,N,HN2,no,N,2,,202107,454,NH2
1,,SING,N,HN1,no,N,1,,202134,4541,NH2
2,,SING,N,HN2,no,N,2,,202134,4541,NH2
1,,SING,OP3,P,no,N,1,,202152,4542,DU
2,,SING,OP3,HOP3,no,N,2,,202152,4542,DU
3,,DOUB,P,OP1,no,N,3,,202152,4542,DU
4,,SING,P,OP2,no,N,4,,202152,4542,DU
5,,SING,P,O5',no,N,5,,202152,4542,DU
6,,SING,OP2,HOP2,no,N,6,,202152,4542,DU
7,,SING,O5',C5',no,N,7,,202152,4542,DU
8,,SING,C5',C4',no,N,8,,202152,4542,DU
9,,SING,C5',H5',no,N,9,,202152,4542,DU
10,,SING,C5',H5'',no,N,10,,202152,4542,DU
11,,SING,C4',O4',no,N,11,,202152,4542,DU
12,,SING,C4',C3',no,N,12,,202152,4542,DU
13,,SING,C4',H4',no,N,13,,202152,4542,DU
14,,SING,O4',C1',no,N,14,,202152,4542,DU
15,,SING,C3',O3',no,N,15,,202152,4542,DU
16,,SING,C3',C2',no,N,16,,202152,4542,DU
17,,SING,C3',H3',no,N,17,,202152,4542,DU
18,,SING,O3',HO3',no,N,18,,202152,4542,DU
19,,SING,C2',C1',no,N,19,,202152,4542,DU
20,,SING,C2',H2',no,N,20,,202152,4542,DU
21,,SING,C2',H2'',no,N,21,,202152,4542,DU
22,,SING,C1',N1,no,N,22,,202152,4542,DU
23,,SING,C1',H1',no,N,23,,202152,4542,DU
24,,SING,N1,C2,no,N,24,,202152,4542,DU
25,,SING,N1,C6,no,N,25,,202152,4542,DU
26,,DOUB,C2,O2,no,N,26,,202152,4542,DU
27,,SING,C2,N3,no,N,27,,202152,4542,DU
28,,SING,N3,C4,no,N,28,,202152,4542,DU
29,,SING,N3,H3,no,N,29,,202152,4542,DU
30,,DOUB,C4,O4,no,N,30,,202152,4542,DU
31,,SING,C4,C5,no,N,31,,202152,4542,DU
32,,DOUB,C5,C6,no,N,32,,202152,4542,DU
33,,SING,C5,H5,no,N,33,,202152,4542,DU
34,,SING,C6,H6,no,N,34,,202152,4542,DU
1,,DOUB,P,OP1,no,N,1,,202175,4547,T3P
2,,SING,P,OP2,no,N,2,,202175,4547,T3P
3,,SING,P,OP3,no,N,3,,202175,4547,T3P
4,,SING,P,O3',no,N,4,,202175,4547,T3P
5,,SING,OP2,HOP2,no,N,5,,202175,4547,T3P
6,,SING,OP3,HOP3,no,N,6,,202175,4547,T3P
7,,SING,O5',C5',no,N,7,,202175,4547,T3P
8,,SING,O5',H5',no,N,8,,202175,4547,T3P
9,,SING,C5',C4',no,N,9,,202175,4547,T3P
10,,SING,C5',H5'1,no,N,10,,202175,4547,T3P
11,,SING,C5',H5'',no,N,11,,202175,4547,T3P
12,,SING,C4',O4',no,N,12,,202175,4547,T3P
13,,SING,C4',C3',no,N,13,,202175,4547,T3P
14,,SING,C4',H4',no,N,14,,202175,4547,T3P
15,,SING,O4',C1',no,N,15,,202175,4547,T3P
16,,SING,C3',O3',no,N,16,,202175,4547,T3P
17,,SING,C3',C2',no,N,17,,202175,4547,T3P
18,,SING,C3',H3',no,N,18,,202175,4547,T3P
19,,SING,C2',C1',no,N,19,,202175,4547,T3P
20,,SING,C2',H2',no,N,20,,202175,4547,T3P
21,,SING,C2',H2'',no,N,21,,202175,4547,T3P
22,,SING,C1',N1,no,N,22,,202175,4547,T3P
23,,SING,C1',H1',no,N,23,,202175,4547,T3P
24,,SING,N1,C2,no,N,24,,202175,4547,T3P
25,,SING,N1,C6,no,N,25,,202175,4547,T3P
26,,DOUB,C2,O2,no,N,26,,202175,4547,T3P
27,,SING,C2,N3,no,N,27,,202175,4547,T3P
28,,SING,N3,C4,no,N,28,,202175,4547,T3P
29,,SING,N3,H3,no,N,29,,202175,4547,T3P
30,,DOUB,C4,O4,no,N,30,,202175,4547,T3P
31,,SING,C4,C5,no,N,31,,202175,4547,T3P
32,,SING,C5,C5M,no,N,32,,202175,4547,T3P
33,,DOUB,C5,C6,no,N,33,,202175,4547,T3P
34,,SING,C5M,H51,no,N,34,,202175,4547,T3P
35,,SING,C5M,H52,no,N,35,,202175,4547,T3P
36,,SING,C5M,H53,no,N,36,,202175,4547,T3P
37,,SING,C6,H6,no,N,37,,202175,4547,T3P
1,,SING,N,HN1,no,N,1,,202203,455,NH2
2,,SING,N,HN2,no,N,2,,202203,455,NH2
1,,SING,N,HN1,no,N,1,,202253,4552,NH2
2,,SING,N,HN2,no,N,2,,202253,4552,NH2
1,,DOUB,PA,O1A,no,N,1,,202304,4554,NDP
2,,SING,PA,O2A,no,N,2,,202304,4554,NDP
3,,SING,PA,O5B,no,N,3,,202304,4554,NDP
4,,SING,PA,O3,no,N,4,,202304,4554,NDP
5,,SING,O2A,HOA2,no,N,5,,202304,4554,NDP
6,,SING,O5B,C5B,no,N,6,,202304,4554,NDP
7,,SING,C5B,C4B,no,N,7,,202304,4554,NDP
8,,SING,C5B,H51A,no,N,8,,202304,4554,NDP
9,,SING,C5B,H52A,no,N,9,,202304,4554,NDP
10,,SING,C4B,O4B,no,N,10,,202304,4554,NDP
11,,SING,C4B,C3B,no,N,11,,202304,4554,NDP
12,,SING,C4B,H4B,no,N,12,,202304,4554,NDP
13,,SING,O4B,C1B,no,N,13,,202304,4554,NDP
14,,SING,C3B,O3B,no,N,14,,202304,4554,NDP
15,,SING,C3B,C2B,no,N,15,,202304,4554,NDP
16,,SING,C3B,H3B,no,N,16,,202304,4554,NDP
17,,SING,O3B,HO3A,no,N,17,,202304,4554,NDP
18,,SING,C2B,O2B,no,N,18,,202304,4554,NDP
19,,SING,C2B,C1B,no,N,19,,202304,4554,NDP
20,,SING,C2B,H2B,no,N,20,,202304,4554,NDP
21,,SING,O2B,P2B,no,N,21,,202304,4554,NDP
22,,SING,C1B,N9A,no,N,22,,202304,4554,NDP
23,,SING,C1B,H1B,no,N,23,,202304,4554,NDP
24,,SING,N9A,C8A,yes,N,24,,202304,4554,NDP
25,,SING,N9A,C4A,yes,N,25,,202304,4554,NDP
26,,DOUB,C8A,N7A,yes,N,26,,202304,4554,NDP
27,,SING,C8A,H8A,no,N,27,,202304,4554,NDP
28,,SING,N7A,C5A,yes,N,28,,202304,4554,NDP
29,,SING,C5A,C6A,yes,N,29,,202304,4554,NDP
30,,DOUB,C5A,C4A,yes,N,30,,202304,4554,NDP
31,,SING,C6A,N6A,no,N,31,,202304,4554,NDP
32,,DOUB,C6A,N1A,yes,N,32,,202304,4554,NDP
33,,SING,N6A,H61A,no,N,33,,202304,4554,NDP
34,,SING,N6A,H62A,no,N,34,,202304,4554,NDP
35,,SING,N1A,C2A,yes,N,35,,202304,4554,NDP
36,,DOUB,C2A,N3A,yes,N,36,,202304,4554,NDP
37,,SING,C2A,H2A,no,N,37,,202304,4554,NDP
38,,SING,N3A,C4A,yes,N,38,,202304,4554,NDP
39,,SING,O3,PN,no,N,39,,202304,4554,NDP
40,,DOUB,PN,O1N,no,N,40,,202304,4554,NDP
41,,SING,PN,O2N,no,N,41,,202304,4554,NDP
42,,SING,PN,O5D,no,N,42,,202304,4554,NDP
43,,SING,O2N,H21N,no,N,43,,202304,4554,NDP
44,,SING,O5D,C5D,no,N,44,,202304,4554,NDP
45,,SING,C5D,C4D,no,N,45,,202304,4554,NDP
46,,SING,C5D,H51N,no,N,46,,202304,4554,NDP
47,,SING,C5D,H52N,no,N,47,,202304,4554,NDP
48,,SING,C4D,O4D,no,N,48,,202304,4554,NDP
49,,SING,C4D,C3D,no,N,49,,202304,4554,NDP
50,,SING,C4D,H4D,no,N,50,,202304,4554,NDP
51,,SING,O4D,C1D,no,N,51,,202304,4554,NDP
52,,SING,C3D,O3D,no,N,52,,202304,4554,NDP
53,,SING,C3D,C2D,no,N,53,,202304,4554,NDP
54,,SING,C3D,H3D,no,N,54,,202304,4554,NDP
55,,SING,O3D,HO3N,no,N,55,,202304,4554,NDP
56,,SING,C2D,O2D,no,N,56,,202304,4554,NDP
57,,SING,C2D,C1D,no,N,57,,202304,4554,NDP
58,,SING,C2D,H2D,no,N,58,,202304,4554,NDP
59,,SING,O2D,HO2N,no,N,59,,202304,4554,NDP
60,,SING,C1D,N1N,no,N,60,,202304,4554,NDP
61,,SING,C1D,H1D,no,N,61,,202304,4554,NDP
62,,SING,N1N,C2N,no,N,62,,202304,4554,NDP
63,,SING,N1N,C6N,no,N,63,,202304,4554,NDP
64,,DOUB,C2N,C3N,no,N,64,,202304,4554,NDP
65,,SING,C2N,H2N,no,N,65,,202304,4554,NDP
66,,SING,C3N,C7N,no,N,66,,202304,4554,NDP
67,,SING,C3N,C4N,no,N,67,,202304,4554,NDP
68,,DOUB,C7N,O7N,no,N,68,,202304,4554,NDP
69,,SING,C7N,N7N,no,N,69,,202304,4554,NDP
70,,SING,N7N,H71N,no,N,70,,202304,4554,NDP
71,,SING,N7N,H72N,no,N,71,,202304,4554,NDP
72,,SING,C4N,C5N,no,N,72,,202304,4554,NDP
73,,SING,C4N,H41N,no,N,73,,202304,4554,NDP
74,,SING,C4N,H42N,no,N,74,,202304,4554,NDP
75,,DOUB,C5N,C6N,no,N,75,,202304,4554,NDP
76,,SING,C5N,H5N,no,N,76,,202304,4554,NDP
77,,SING,C6N,H6N,no,N,77,,202304,4554,NDP
78,,DOUB,P2B,O1X,no,N,78,,202304,4554,NDP
79,,SING,P2B,O2X,no,N,79,,202304,4554,NDP
80,,SING,P2B,O3X,no,N,80,,202304,4554,NDP
81,,SING,O2X,HOP2,no,N,81,,202304,4554,NDP
82,,SING,O3X,HOP3,no,N,82,,202304,4554,NDP
1,,SING,N,HN1,no,N,1,,202450,456,NH2
2,,SING,N,HN2,no,N,2,,202450,456,NH2
1,,SING,C38,C39,no,N,1,,202593,4565,I52
2,,SING,C38,C37,no,N,2,,202593,4565,I52
3,,SING,C38,H381,no,N,3,,202593,4565,I52
4,,SING,C38,H382,no,N,4,,202593,4565,I52
5,,SING,C39,H391,no,N,5,,202593,4565,I52
6,,SING,C39,H392,no,N,6,,202593,4565,I52
7,,SING,C39,H393,no,N,7,,202593,4565,I52
8,,SING,C37,C36,no,N,8,,202593,4565,I52
9,,SING,C37,H371,no,N,9,,202593,4565,I52
10,,SING,C37,H372,no,N,10,,202593,4565,I52
11,,SING,C35,C36,no,N,11,,202593,4565,I52
12,,SING,C35,C32,no,N,12,,202593,4565,I52
13,,SING,C35,H351,no,N,13,,202593,4565,I52
14,,SING,C35,H352,no,N,14,,202593,4565,I52
15,,SING,C36,H361,no,N,15,,202593,4565,I52
16,,SING,C36,H362,no,N,16,,202593,4565,I52
17,,SING,C25,C23,no,N,17,,202593,4565,I52
18,,SING,C25,H251,no,N,18,,202593,4565,I52
19,,SING,C25,H252,no,N,19,,202593,4565,I52
20,,SING,C25,H253,no,N,20,,202593,4565,I52
21,,SING,C24,C23,no,N,21,,202593,4565,I52
22,,SING,C24,H241,no,N,22,,202593,4565,I52
23,,SING,C24,H242,no,N,23,,202593,4565,I52
24,,SING,C24,H243,no,N,24,,202593,4565,I52
25,,SING,N8,C7,no,N,25,,202593,4565,I52
26,,SING,N8,C9,no,N,26,,202593,4565,I52
27,,SING,N8,C13,no,N,27,,202593,4565,I52
28,,SING,C7,C6,no,N,28,,202593,4565,I52
29,,SING,C7,H71,no,N,29,,202593,4565,I52
30,,SING,C7,H72,no,N,30,,202593,4565,I52
31,,SING,C9,C10,no,N,31,,202593,4565,I52
32,,SING,C9,H91,no,N,32,,202593,4565,I52
33,,SING,C9,H92,no,N,33,,202593,4565,I52
34,,SING,C13,C12,no,N,34,,202593,4565,I52
35,,SING,C13,H131,no,N,35,,202593,4565,I52
36,,SING,C13,H132,no,N,36,,202593,4565,I52
37,,SING,O11,C12,no,N,37,,202593,4565,I52
38,,SING,O11,C10,no,N,38,,202593,4565,I52
39,,SING,C12,H121,no,N,39,,202593,4565,I52
40,,SING,C12,H122,no,N,40,,202593,4565,I52
41,,SING,C10,H101,no,N,41,,202593,4565,I52
42,,SING,C10,H102,no,N,42,,202593,4565,I52
43,,DOUB,C31,C30,yes,N,43,,202593,4565,I52
44,,SING,C31,C32,yes,N,44,,202593,4565,I52
45,,SING,C31,H31,no,N,45,,202593,4565,I52
46,,SING,C23,C4,no,N,46,,202593,4565,I52
47,,SING,C23,H23,no,N,47,,202593,4565,I52
48,,DOUB,O26,C3,no,N,48,,202593,4565,I52
49,,SING,C4,N5,no,N,49,,202593,4565,I52
50,,SING,C4,C3,no,N,50,,202593,4565,I52
51,,SING,C4,H4,no,N,51,,202593,4565,I52
52,,SING,C6,N5,no,N,52,,202593,4565,I52
53,,SING,C6,H61,no,N,53,,202593,4565,I52
54,,SING,C6,H62,no,N,54,,202593,4565,I52
55,,SING,S14,N5,no,N,55,,202593,4565,I52
56,,DOUB,S14,O21,no,N,56,,202593,4565,I52
57,,SING,S14,C15,no,N,57,,202593,4565,I52
58,,DOUB,S14,O22,no,N,58,,202593,4565,I52
59,,SING,C3,N2,no,N,59,,202593,4565,I52
60,,SING,O1,N2,no,N,60,,202593,4565,I52
61,,SING,O1,H1,no,N,61,,202593,4565,I52
62,,SING,N2,H2,no,N,62,,202593,4565,I52
63,,DOUB,O41,C28,no,N,63,,202593,4565,I52
64,,SING,C28,N27,no,N,64,,202593,4565,I52
65,,SING,C28,C29,no,N,65,,202593,4565,I52
66,,SING,N27,C18,no,N,66,,202593,4565,I52
67,,SING,N27,H27,no,N,67,,202593,4565,I52
68,,DOUB,C29,C34,yes,N,68,,202593,4565,I52
69,,SING,C29,C30,yes,N,69,,202593,4565,I52
70,,SING,C33,C34,yes,N,70,,202593,4565,I52
71,,DOUB,C33,C32,yes,N,71,,202593,4565,I52
72,,SING,C33,H33,no,N,72,,202593,4565,I52
73,,SING,C34,H34,no,N,73,,202593,4565,I52
74,,SING,C30,H30,no,N,74,,202593,4565,I52
75,,DOUB,C16,C15,yes,N,75,,202593,4565,I52
76,,SING,C16,C17,yes,N,76,,202593,4565,I52
77,,SING,C16,H16,no,N,77,,202593,4565,I52
78,,DOUB,C18,C17,yes,N,78,,202593,4565,I52
79,,SING,C18,C19,yes,N,79,,202593,4565,I52
80,,SING,C15,C20,yes,N,80,,202593,4565,I52
81,,DOUB,C20,C19,yes,N,81,,202593,4565,I52
82,,SING,C20,H20,no,N,82,,202593,4565,I52
83,,SING,C17,H17,no,N,83,,202593,4565,I52
84,,SING,C19,H19,no,N,84,,202593,4565,I52
1,,SING,FE1,S1,no,N,1,,202618,4566,FES
2,,SING,FE1,S2,no,N,2,,202618,4566,FES
3,,SING,FE2,S1,no,N,3,,202618,4566,FES
4,,SING,FE2,S2,no,N,4,,202618,4566,FES
1,,SING,N,HN1,no,N,1,,202695,457,NH2
2,,SING,N,HN2,no,N,2,,202695,457,NH2
1,,SING,C1,O1,no,N,1,,202802,4575,NOV
2,,SING,C1,H11A,no,N,2,,202802,4575,NOV
3,,SING,C1,H12,no,N,3,,202802,4575,NOV
4,,SING,C1,H13,no,N,4,,202802,4575,NOV
5,,SING,O1,C27,no,N,5,,202802,4575,NOV
6,,SING,N1,C12,no,N,6,,202802,4575,NOV
7,,SING,N1,HN11,no,N,7,,202802,4575,NOV
8,,SING,N1,HN12,no,N,8,,202802,4575,NOV
9,,DOUB,C12,O4,no,N,9,,202802,4575,NOV
10,,SING,C12,O5,no,N,10,,202802,4575,NOV
11,,SING,O5,C28,no,N,11,,202802,4575,NOV
12,,SING,C27,C28,no,N,12,,202802,4575,NOV
13,,SING,C27,C31,no,N,13,,202802,4575,NOV
14,,SING,C27,H27,no,N,14,,202802,4575,NOV
15,,SING,C28,C29,no,N,15,,202802,4575,NOV
16,,SING,C28,H28,no,N,16,,202802,4575,NOV
17,,SING,C29,O6,no,N,17,,202802,4575,NOV
18,,SING,C29,C30,no,N,18,,202802,4575,NOV
19,,SING,C29,H29,no,N,19,,202802,4575,NOV
20,,SING,O6,HO6,no,N,20,,202802,4575,NOV
21,,SING,C30,O7,no,N,21,,202802,4575,NOV
22,,SING,C30,O8,no,N,22,,202802,4575,NOV
23,,SING,C30,H30,no,N,23,,202802,4575,NOV
24,,SING,O7,C31,no,N,24,,202802,4575,NOV
25,,SING,C31,C23,no,N,25,,202802,4575,NOV
26,,SING,C31,C26,no,N,26,,202802,4575,NOV
27,,SING,C23,H231,no,N,27,,202802,4575,NOV
28,,SING,C23,H232,no,N,28,,202802,4575,NOV
29,,SING,C23,H233,no,N,29,,202802,4575,NOV
30,,SING,C26,H261,no,N,30,,202802,4575,NOV
31,,SING,C26,H262,no,N,31,,202802,4575,NOV
32,,SING,C26,H263,no,N,32,,202802,4575,NOV
33,,SING,O8,C3,no,N,33,,202802,4575,NOV
34,,DOUB,C3,C4,yes,N,34,,202802,4575,NOV
35,,SING,C3,C11,yes,N,35,,202802,4575,NOV
36,,SING,C4,C2,no,N,36,,202802,4575,NOV
37,,SING,C4,C5,yes,N,37,,202802,4575,NOV
38,,SING,C2,H21A,no,N,38,,202802,4575,NOV
39,,SING,C2,H22,no,N,39,,202802,4575,NOV
40,,SING,C2,H23,no,N,40,,202802,4575,NOV
41,,DOUB,C5,C9,yes,N,41,,202802,4575,NOV
42,,SING,C5,O10,no,N,42,,202802,4575,NOV
43,,SING,C9,C10,yes,N,43,,202802,4575,NOV
44,,SING,C9,C8,no,N,44,,202802,4575,NOV
45,,DOUB,C10,C11,yes,N,45,,202802,4575,NOV
46,,SING,C10,H10,no,N,46,,202802,4575,NOV
47,,SING,C11,H11,no,N,47,,202802,4575,NOV
48,,SING,O10,C6,no,N,48,,202802,4575,NOV
49,,DOUB,C6,O11,no,N,49,,202802,4575,NOV
50,,SING,C6,C7,no,N,50,,202802,4575,NOV
51,,DOUB,C7,C8,no,N,51,,202802,4575,NOV
52,,SING,C7,N2,no,N,52,,202802,4575,NOV
53,,SING,C8,O9,no,N,53,,202802,4575,NOV
54,,SING,O9,HO9,no,N,54,,202802,4575,NOV
55,,SING,N2,C13,no,N,55,,202802,4575,NOV
56,,SING,N2,HN2,no,N,56,,202802,4575,NOV
57,,DOUB,C13,O2,no,N,57,,202802,4575,NOV
58,,SING,C13,C14,no,N,58,,202802,4575,NOV
59,,DOUB,C14,C15,yes,N,59,,202802,4575,NOV
60,,SING,C14,C19,yes,N,60,,202802,4575,NOV
61,,SING,C15,C16,yes,N,61,,202802,4575,NOV
62,,SING,C15,H15,no,N,62,,202802,4575,NOV
63,,DOUB,C16,C17,yes,N,63,,202802,4575,NOV
64,,SING,C16,C20,no,N,64,,202802,4575,NOV
65,,SING,C17,O3,no,N,65,,202802,4575,NOV
66,,SING,C17,C18,yes,N,66,,202802,4575,NOV
67,,SING,O3,HO3,no,N,67,,202802,4575,NOV
68,,DOUB,C18,C19,yes,N,68,,202802,4575,NOV
69,,SING,C18,H18,no,N,69,,202802,4575,NOV
70,,SING,C19,H19,no,N,70,,202802,4575,NOV
71,,SING,C20,C21,no,N,71,,202802,4575,NOV
72,,SING,C20,H201,no,N,72,,202802,4575,NOV
73,,SING,C20,H202,no,N,73,,202802,4575,NOV
74,,DOUB,C21,C22,no,N,74,,202802,4575,NOV
75,,SING,C21,H21,no,N,75,,202802,4575,NOV
76,,SING,C22,C24,no,N,76,,202802,4575,NOV
77,,SING,C22,C25,no,N,77,,202802,4575,NOV
78,,SING,C24,H241,no,N,78,,202802,4575,NOV
79,,SING,C24,H242,no,N,79,,202802,4575,NOV
80,,SING,C24,H243,no,N,80,,202802,4575,NOV
81,,SING,C25,H251,no,N,81,,202802,4575,NOV
82,,SING,C25,H252,no,N,82,,202802,4575,NOV
83,,SING,C25,H253,no,N,83,,202802,4575,NOV
1,,SING,OP3,P,no,N,1,,202824,4576,A
2,,SING,OP3,HOP3,no,N,2,,202824,4576,A
3,,DOUB,P,OP1,no,N,3,,202824,4576,A
4,,SING,P,OP2,no,N,4,,202824,4576,A
5,,SING,P,O5',no,N,5,,202824,4576,A
6,,SING,OP2,HOP2,no,N,6,,202824,4576,A
7,,SING,O5',C5',no,N,7,,202824,4576,A
8,,SING,C5',C4',no,N,8,,202824,4576,A
9,,SING,C5',H5',no,N,9,,202824,4576,A
10,,SING,C5',H5'',no,N,10,,202824,4576,A
11,,SING,C4',O4',no,N,11,,202824,4576,A
12,,SING,C4',C3',no,N,12,,202824,4576,A
13,,SING,C4',H4',no,N,13,,202824,4576,A
14,,SING,O4',C1',no,N,14,,202824,4576,A
15,,SING,C3',O3',no,N,15,,202824,4576,A
16,,SING,C3',C2',no,N,16,,202824,4576,A
17,,SING,C3',H3',no,N,17,,202824,4576,A
18,,SING,O3',HO3',no,N,18,,202824,4576,A
19,,SING,C2',O2',no,N,19,,202824,4576,A
20,,SING,C2',C1',no,N,20,,202824,4576,A
21,,SING,C2',H2',no,N,21,,202824,4576,A
22,,SING,O2',HO2',no,N,22,,202824,4576,A
23,,SING,C1',N9,no,N,23,,202824,4576,A
24,,SING,C1',H1',no,N,24,,202824,4576,A
25,,SING,N9,C8,yes,N,25,,202824,4576,A
26,,SING,N9,C4,yes,N,26,,202824,4576,A
27,,DOUB,C8,N7,yes,N,27,,202824,4576,A
28,,SING,C8,H8,no,N,28,,202824,4576,A
29,,SING,N7,C5,yes,N,29,,202824,4576,A
30,,SING,C5,C6,yes,N,30,,202824,4576,A
31,,DOUB,C5,C4,yes,N,31,,202824,4576,A
32,,SING,C6,N6,no,N,32,,202824,4576,A
33,,DOUB,C6,N1,yes,N,33,,202824,4576,A
34,,SING,N6,H61,no,N,34,,202824,4576,A
35,,SING,N6,H62,no,N,35,,202824,4576,A
36,,SING,N1,C2,yes,N,36,,202824,4576,A
37,,DOUB,C2,N3,yes,N,37,,202824,4576,A
38,,SING,C2,H2,no,N,38,,202824,4576,A
39,,SING,N3,C4,yes,N,39,,202824,4576,A
1,,SING,FE,NA,no,N,1,,202886,4578,HEC
2,,SING,FE,NB,no,N,2,,202886,4578,HEC
3,,SING,FE,NC,no,N,3,,202886,4578,HEC
4,,SING,FE,ND,no,N,4,,202886,4578,HEC
5,,DOUB,CHA,C1A,no,N,5,,202886,4578,HEC
6,,SING,CHA,C4D,no,N,6,,202886,4578,HEC
7,,SING,CHA,HHA,no,N,7,,202886,4578,HEC
8,,DOUB,CHB,C4A,no,N,8,,202886,4578,HEC
9,,SING,CHB,C1B,no,N,9,,202886,4578,HEC
10,,SING,CHB,HHB,no,N,10,,202886,4578,HEC
11,,DOUB,CHC,C4B,no,N,11,,202886,4578,HEC
12,,SING,CHC,C1C,no,N,12,,202886,4578,HEC
13,,SING,CHC,HHC,no,N,13,,202886,4578,HEC
14,,DOUB,CHD,C4C,no,N,14,,202886,4578,HEC
15,,SING,CHD,C1D,no,N,15,,202886,4578,HEC
16,,SING,CHD,HHD,no,N,16,,202886,4578,HEC
17,,SING,NA,C1A,yes,N,17,,202886,4578,HEC
18,,SING,NA,C4A,yes,N,18,,202886,4578,HEC
19,,SING,C1A,C2A,yes,N,19,,202886,4578,HEC
20,,DOUB,C2A,C3A,yes,N,20,,202886,4578,HEC
21,,SING,C2A,CAA,no,N,21,,202886,4578,HEC
22,,SING,C3A,C4A,yes,N,22,,202886,4578,HEC
23,,SING,C3A,CMA,no,N,23,,202886,4578,HEC
24,,SING,CMA,HMA1,no,N,24,,202886,4578,HEC
25,,SING,CMA,HMA2,no,N,25,,202886,4578,HEC
26,,SING,CMA,HMA3,no,N,26,,202886,4578,HEC
27,,SING,CAA,CBA,no,N,27,,202886,4578,HEC
28,,SING,CAA,HAA1,no,N,28,,202886,4578,HEC
29,,SING,CAA,HAA2,no,N,29,,202886,4578,HEC
30,,SING,CBA,CGA,no,N,30,,202886,4578,HEC
31,,SING,CBA,HBA1,no,N,31,,202886,4578,HEC
32,,SING,CBA,HBA2,no,N,32,,202886,4578,HEC
33,,DOUB,CGA,O1A,no,N,33,,202886,4578,HEC
34,,SING,CGA,O2A,no,N,34,,202886,4578,HEC
35,,SING,O2A,H2A,no,N,35,,202886,4578,HEC
36,,SING,NB,C1B,yes,N,36,,202886,4578,HEC
37,,SING,NB,C4B,yes,N,37,,202886,4578,HEC
38,,DOUB,C1B,C2B,yes,N,38,,202886,4578,HEC
39,,SING,C2B,C3B,yes,N,39,,202886,4578,HEC
40,,SING,C2B,CMB,no,N,40,,202886,4578,HEC
41,,SING,C3B,C4B,yes,N,41,,202886,4578,HEC
42,,DOUB,C3B,CAB,no,E,42,,202886,4578,HEC
43,,SING,CMB,HMB1,no,N,43,,202886,4578,HEC
44,,SING,CMB,HMB2,no,N,44,,202886,4578,HEC
45,,SING,CMB,HMB3,no,N,45,,202886,4578,HEC
46,,SING,CAB,CBB,no,N,46,,202886,4578,HEC
47,,SING,CAB,HAB,no,N,47,,202886,4578,HEC
48,,SING,CBB,HBB1,no,N,48,,202886,4578,HEC
49,,SING,CBB,HBB2,no,N,49,,202886,4578,HEC
50,,SING,CBB,HBB3,no,N,50,,202886,4578,HEC
51,,SING,NC,C1C,yes,N,51,,202886,4578,HEC
52,,SING,NC,C4C,yes,N,52,,202886,4578,HEC
53,,DOUB,C1C,C2C,yes,N,53,,202886,4578,HEC
54,,SING,C2C,C3C,yes,N,54,,202886,4578,HEC
55,,SING,C2C,CMC,no,N,55,,202886,4578,HEC
56,,SING,C3C,C4C,yes,N,56,,202886,4578,HEC
57,,DOUB,C3C,CAC,no,E,57,,202886,4578,HEC
58,,SING,CMC,HMC1,no,N,58,,202886,4578,HEC
59,,SING,CMC,HMC2,no,N,59,,202886,4578,HEC
60,,SING,CMC,HMC3,no,N,60,,202886,4578,HEC
61,,SING,CAC,CBC,no,N,61,,202886,4578,HEC
62,,SING,CAC,HAC,no,N,62,,202886,4578,HEC
63,,SING,CBC,HBC1,no,N,63,,202886,4578,HEC
64,,SING,CBC,HBC2,no,N,64,,202886,4578,HEC
65,,SING,CBC,HBC3,no,N,65,,202886,4578,HEC
66,,SING,ND,C1D,yes,N,66,,202886,4578,HEC
67,,SING,ND,C4D,yes,N,67,,202886,4578,HEC
68,,DOUB,C1D,C2D,yes,N,68,,202886,4578,HEC
69,,SING,C2D,C3D,yes,N,69,,202886,4578,HEC
70,,SING,C2D,CMD,no,N,70,,202886,4578,HEC
71,,DOUB,C3D,C4D,yes,N,71,,202886,4578,HEC
72,,SING,C3D,CAD,no,N,72,,202886,4578,HEC
73,,SING,CMD,HMD1,no,N,73,,202886,4578,HEC
74,,SING,CMD,HMD2,no,N,74,,202886,4578,HEC
75,,SING,CMD,HMD3,no,N,75,,202886,4578,HEC
76,,SING,CAD,CBD,no,N,76,,202886,4578,HEC
77,,SING,CAD,HAD1,no,N,77,,202886,4578,HEC
78,,SING,CAD,HAD2,no,N,78,,202886,4578,HEC
79,,SING,CBD,CGD,no,N,79,,202886,4578,HEC
80,,SING,CBD,HBD1,no,N,80,,202886,4578,HEC
81,,SING,CBD,HBD2,no,N,81,,202886,4578,HEC
82,,DOUB,CGD,O1D,no,N,82,,202886,4578,HEC
83,,SING,CGD,O2D,no,N,83,,202886,4578,HEC
84,,SING,O2D,H2D,no,N,84,,202886,4578,HEC
1,,SING,N,HN1,no,N,1,,202948,458,NH2
2,,SING,N,HN2,no,N,2,,202948,458,NH2
1,,SING,N,HN1,no,N,1,,203142,459,NH2
2,,SING,N,HN2,no,N,2,,203142,459,NH2
1,,SING,P1,O12,no,N,1,,203196,4592,PT5
2,,SING,P1,O1,no,N,2,,203196,4592,PT5
3,,SING,P1,O13,no,N,3,,203196,4592,PT5
4,,SING,O13,C7,no,N,4,,203196,4592,PT5
5,,DOUB,O11,P1,no,N,5,,203196,4592,PT5
6,,SING,O6,C6,no,N,6,,203196,4592,PT5
7,,SING,C1,O1,no,N,7,,203196,4592,PT5
8,,SING,C1,C2,no,N,8,,203196,4592,PT5
9,,SING,C6,C1,no,N,9,,203196,4592,PT5
10,,SING,C2,O2,no,N,10,,203196,4592,PT5
11,,SING,C3,C2,no,N,11,,203196,4592,PT5
12,,SING,C3,O3,no,N,12,,203196,4592,PT5
13,,SING,C4,C3,no,N,13,,203196,4592,PT5
14,,SING,O4,C4,no,N,14,,203196,4592,PT5
15,,SING,P4,O4,no,N,15,,203196,4592,PT5
16,,SING,P4,O41,no,N,16,,203196,4592,PT5
17,,SING,P4,O43,no,N,17,,203196,4592,PT5
18,,DOUB,O42,P4,no,N,18,,203196,4592,PT5
19,,SING,C5,C6,no,N,19,,203196,4592,PT5
20,,SING,C5,C4,no,N,20,,203196,4592,PT5
21,,SING,C5,O5,no,N,21,,203196,4592,PT5
22,,SING,P5,O5,no,N,22,,203196,4592,PT5
23,,SING,P5,O53,no,N,23,,203196,4592,PT5
24,,SING,P5,O52,no,N,24,,203196,4592,PT5
25,,DOUB,O51,P5,no,N,25,,203196,4592,PT5
26,,SING,C7,C8,no,N,26,,203196,4592,PT5
27,,SING,C8,C9,no,N,27,,203196,4592,PT5
28,,SING,C8,O16,no,N,28,,203196,4592,PT5
29,,SING,O16,C10,no,N,29,,203196,4592,PT5
30,,DOUB,C10,O17,no,N,30,,203196,4592,PT5
31,,SING,C9,O18,no,N,31,,203196,4592,PT5
32,,SING,O18,C11,no,N,32,,203196,4592,PT5
33,,DOUB,C11,O19,no,N,33,,203196,4592,PT5
34,,SING,C10,C12,no,N,34,,203196,4592,PT5
35,,SING,C12,C13,no,N,35,,203196,4592,PT5
36,,SING,C13,C14,no,N,36,,203196,4592,PT5
37,,SING,C14,C15,no,N,37,,203196,4592,PT5
38,,DOUB,C15,C16,no,N,38,,203196,4592,PT5
39,,SING,C16,C17,no,N,39,,203196,4592,PT5
40,,SING,C17,C18,no,N,40,,203196,4592,PT5
41,,DOUB,C18,C19,no,N,41,,203196,4592,PT5
42,,SING,C19,C20,no,N,42,,203196,4592,PT5
43,,SING,C20,C21,no,N,43,,203196,4592,PT5
44,,DOUB,C21,C22,no,N,44,,203196,4592,PT5
45,,SING,C22,C23,no,N,45,,203196,4592,PT5
46,,SING,C23,C24,no,N,46,,203196,4592,PT5
47,,DOUB,C24,C25,no,N,47,,203196,4592,PT5
48,,SING,C25,C26,no,N,48,,203196,4592,PT5
49,,SING,C26,C27,no,N,49,,203196,4592,PT5
50,,SING,C27,C28,no,N,50,,203196,4592,PT5
51,,SING,C28,C29,no,N,51,,203196,4592,PT5
52,,SING,C29,C30,no,N,52,,203196,4592,PT5
53,,SING,C11,C31,no,N,53,,203196,4592,PT5
54,,SING,C31,C32,no,N,54,,203196,4592,PT5
55,,SING,C32,C33,no,N,55,,203196,4592,PT5
56,,SING,C33,C34,no,N,56,,203196,4592,PT5
57,,SING,C34,C35,no,N,57,,203196,4592,PT5
58,,SING,C35,C36,no,N,58,,203196,4592,PT5
59,,SING,C36,C37,no,N,59,,203196,4592,PT5
60,,SING,C37,C38,no,N,60,,203196,4592,PT5
61,,SING,C38,C39,no,N,61,,203196,4592,PT5
62,,SING,C39,C40,no,N,62,,203196,4592,PT5
63,,SING,C40,C41,no,N,63,,203196,4592,PT5
64,,SING,C41,C42,no,E,64,,203196,4592,PT5
65,,SING,C42,C43,no,N,65,,203196,4592,PT5
66,,SING,C43,C44,no,N,66,,203196,4592,PT5
67,,SING,C44,C45,no,N,67,,203196,4592,PT5
68,,SING,C45,C46,no,N,68,,203196,4592,PT5
69,,SING,C46,C47,no,N,69,,203196,4592,PT5
70,,SING,O12,HO12,no,N,70,,203196,4592,PT5
71,,SING,O6,HO6,no,E,71,,203196,4592,PT5
72,,SING,C1,H1,no,N,72,,203196,4592,PT5
73,,SING,C6,H6,no,N,73,,203196,4592,PT5
74,,SING,C2,H2,no,N,74,,203196,4592,PT5
75,,SING,O2,HO2,no,N,75,,203196,4592,PT5
76,,SING,C3,H3,no,N,76,,203196,4592,PT5
77,,SING,O3,HO3,no,N,77,,203196,4592,PT5
78,,SING,C4,H4,no,E,78,,203196,4592,PT5
79,,SING,O41,HO41,no,N,79,,203196,4592,PT5
80,,SING,O43,HO43,no,N,80,,203196,4592,PT5
81,,SING,C5,H5,no,N,81,,203196,4592,PT5
82,,SING,O52,HO52,no,N,82,,203196,4592,PT5
83,,SING,O53,HO53,no,N,83,,203196,4592,PT5
84,,SING,C7,H15,no,N,84,,203196,4592,PT5
85,,SING,C7,H16,no,E,85,,203196,4592,PT5
86,,SING,C8,H17,no,N,86,,203196,4592,PT5
87,,SING,C9,H18,no,N,87,,203196,4592,PT5
88,,SING,C9,H19,no,N,88,,203196,4592,PT5
89,,SING,C12,H20,no,N,89,,203196,4592,PT5
90,,SING,C12,H21,no,N,90,,203196,4592,PT5
91,,SING,C13,H22,no,N,91,,203196,4592,PT5
92,,SING,C13,H23,no,N,92,,203196,4592,PT5
93,,SING,C14,H24,no,N,93,,203196,4592,PT5
94,,SING,C14,H25,no,N,94,,203196,4592,PT5
95,,SING,C15,H26,no,N,95,,203196,4592,PT5
96,,SING,C16,H27,no,N,96,,203196,4592,PT5
97,,SING,C17,H28,no,N,97,,203196,4592,PT5
98,,SING,C17,H29,no,N,98,,203196,4592,PT5
99,,SING,C18,H30,no,N,99,,203196,4592,PT5
100,,SING,C19,H31,no,N,100,,203196,4592,PT5
101,,SING,C20,H32,no,N,101,,203196,4592,PT5
102,,SING,C20,H33,no,N,102,,203196,4592,PT5
103,,SING,C21,H34,no,N,103,,203196,4592,PT5
104,,SING,C22,H35,no,N,104,,203196,4592,PT5
105,,SING,C23,H36,no,N,105,,203196,4592,PT5
106,,SING,C23,H37,no,N,106,,203196,4592,PT5
107,,SING,C24,H38,no,N,107,,203196,4592,PT5
108,,SING,C25,H39,no,N,108,,203196,4592,PT5
109,,SING,C26,H40,no,N,109,,203196,4592,PT5
110,,SING,C26,H41,no,N,110,,203196,4592,PT5
111,,SING,C27,H42,no,N,111,,203196,4592,PT5
112,,SING,C27,H43,no,N,112,,203196,4592,PT5
113,,SING,C28,H44,no,N,113,,203196,4592,PT5
114,,SING,C28,H45,no,N,114,,203196,4592,PT5
115,,SING,C29,H46,no,N,115,,203196,4592,PT5
116,,SING,C29,H47,no,N,116,,203196,4592,PT5
117,,SING,C30,H48,no,N,117,,203196,4592,PT5
118,,SING,C30,H49,no,N,118,,203196,4592,PT5
119,,SING,C30,H50,no,N,119,,203196,4592,PT5
120,,SING,C31,H51,no,N,120,,203196,4592,PT5
121,,SING,C31,H52,no,N,121,,203196,4592,PT5
122,,SING,C32,H53,no,N,122,,203196,4592,PT5
123,,SING,C32,H54,no,N,123,,203196,4592,PT5
124,,SING,C33,H55,no,N,124,,203196,4592,PT5
125,,SING,C33,H56,no,N,125,,203196,4592,PT5
126,,SING,C34,H57,no,N,126,,203196,4592,PT5
127,,SING,C34,H58,no,N,127,,203196,4592,PT5
128,,SING,C35,H59,no,N,128,,203196,4592,PT5
129,,SING,C35,H60,no,N,129,,203196,4592,PT5
130,,SING,C36,H61,no,N,130,,203196,4592,PT5
131,,SING,C36,H62,no,N,131,,203196,4592,PT5
132,,SING,C37,H63,no,N,132,,203196,4592,PT5
133,,SING,C37,H64,no,N,133,,203196,4592,PT5
134,,SING,C38,H65,no,N,134,,203196,4592,PT5
135,,SING,C38,H66,no,N,135,,203196,4592,PT5
136,,SING,C39,H67,no,N,136,,203196,4592,PT5
137,,SING,C39,H68,no,N,137,,203196,4592,PT5
138,,SING,C40,H69,no,N,138,,203196,4592,PT5
139,,SING,C40,H70,no,N,139,,203196,4592,PT5
140,,SING,C41,H71,no,N,140,,203196,4592,PT5
141,,SING,C41,H72,no,N,141,,203196,4592,PT5
142,,SING,C42,H73,no,N,142,,203196,4592,PT5
143,,SING,C42,H74,no,N,143,,203196,4592,PT5
144,,SING,C43,H75,no,N,144,,203196,4592,PT5
145,,SING,C43,H76,no,N,145,,203196,4592,PT5
146,,SING,C44,H77,no,N,146,,203196,4592,PT5
147,,SING,C44,H78,no,N,147,,203196,4592,PT5
148,,SING,C45,H79,no,N,148,,203196,4592,PT5
149,,SING,C45,H80,no,N,149,,203196,4592,PT5
150,,SING,C46,H81,no,N,150,,203196,4592,PT5
151,,SING,C46,H82,no,N,151,,203196,4592,PT5
152,,SING,C47,H83,no,N,152,,203196,4592,PT5
153,,SING,C47,H84,no,N,153,,203196,4592,PT5
154,,SING,C47,H85,no,N,154,,203196,4592,PT5
1,,SING,N,HN1,no,N,1,,203355,460,NH2
2,,SING,N,HN2,no,N,2,,203355,460,NH2
1,,SING,N,CA,no,N,1,,203385,4601,DIV
2,,SING,N,H,no,N,2,,203385,4601,DIV
3,,SING,N,H2,no,N,3,,203385,4601,DIV
4,,SING,CA,CB1,no,N,4,,203385,4601,DIV
5,,SING,CA,CB2,no,N,5,,203385,4601,DIV
6,,SING,CA,C,no,N,6,,203385,4601,DIV
7,,SING,CB1,CG1,no,N,7,,203385,4601,DIV
8,,SING,CB1,HB11,no,N,8,,203385,4601,DIV
9,,SING,CB1,HB12,no,N,9,,203385,4601,DIV
10,,SING,CG1,HG11,no,N,10,,203385,4601,DIV
11,,SING,CG1,HG12,no,N,11,,203385,4601,DIV
12,,SING,CG1,HG13,no,N,12,,203385,4601,DIV
13,,SING,CB2,HB21,no,N,13,,203385,4601,DIV
14,,SING,CB2,HB22,no,N,14,,203385,4601,DIV
15,,SING,CB2,HB23,no,N,15,,203385,4601,DIV
16,,DOUB,C,O,no,N,16,,203385,4601,DIV
17,,SING,C,OXT,no,N,17,,203385,4601,DIV
18,,SING,OXT,HXT,no,N,18,,203385,4601,DIV
1,,DOUB,C,O,no,N,1,,203386,4601,ACE
2,,SING,C,CH3,no,N,2,,203386,4601,ACE
3,,SING,C,H,no,N,3,,203386,4601,ACE
4,,SING,CH3,H1,no,N,4,,203386,4601,ACE
5,,SING,CH3,H2,no,N,5,,203386,4601,ACE
6,,SING,CH3,H3,no,N,6,,203386,4601,ACE
1,,SING,N,CA,no,N,1,,203387,4601,AIB
2,,SING,N,H,no,N,2,,203387,4601,AIB
3,,SING,N,H2,no,N,3,,203387,4601,AIB
4,,SING,CA,C,no,N,4,,203387,4601,AIB
5,,SING,CA,CB1,no,N,5,,203387,4601,AIB
6,,SING,CA,CB2,no,N,6,,203387,4601,AIB
7,,DOUB,C,O,no,N,7,,203387,4601,AIB
8,,SING,C,OXT,no,N,8,,203387,4601,AIB
9,,SING,OXT,HO2,no,N,9,,203387,4601,AIB
10,,SING,CB1,HB11,no,N,10,,203387,4601,AIB
11,,SING,CB1,HB12,no,N,11,,203387,4601,AIB
12,,SING,CB1,HB13,no,N,12,,203387,4601,AIB
13,,SING,CB2,HB21,no,N,13,,203387,4601,AIB
14,,SING,CB2,HB22,no,N,14,,203387,4601,AIB
15,,SING,CB2,HB23,no,N,15,,203387,4601,AIB
1,,SING,N,CA,no,N,1,,203388,4601,PHL
2,,SING,N,H,no,N,2,,203388,4601,PHL
3,,SING,N,H2,no,N,3,,203388,4601,PHL
4,,SING,CA,C,no,N,4,,203388,4601,PHL
5,,SING,CA,CB,no,N,5,,203388,4601,PHL
6,,SING,CA,HA,no,N,6,,203388,4601,PHL
7,,SING,C,O,no,N,7,,203388,4601,PHL
8,,SING,C,HC1,no,N,8,,203388,4601,PHL
9,,SING,C,HC2,no,N,9,,203388,4601,PHL
10,,SING,O,HO,no,N,10,,203388,4601,PHL
11,,SING,CB,CG,no,N,11,,203388,4601,PHL
12,,SING,CB,HB2,no,N,12,,203388,4601,PHL
13,,SING,CB,HB3,no,N,13,,203388,4601,PHL
14,,DOUB,CG,CD1,yes,N,14,,203388,4601,PHL
15,,SING,CG,CD2,yes,N,15,,203388,4601,PHL
16,,SING,CD1,CE1,yes,N,16,,203388,4601,PHL
17,,SING,CD1,HD1,no,N,17,,203388,4601,PHL
18,,DOUB,CD2,CE2,yes,N,18,,203388,4601,PHL
19,,SING,CD2,HD2,no,N,19,,203388,4601,PHL
20,,DOUB,CE1,CZ,yes,N,20,,203388,4601,PHL
21,,SING,CE1,HE1,no,N,21,,203388,4601,PHL
22,,SING,CE2,CZ,yes,N,22,,203388,4601,PHL
23,,SING,CE2,HE2,no,N,23,,203388,4601,PHL
24,,SING,CZ,HZ,no,N,24,,203388,4601,PHL
1,,SING,N,CA,no,N,1,,203389,4601,HYP
2,,SING,N,CD,no,N,2,,203389,4601,HYP
3,,SING,N,H,no,N,3,,203389,4601,HYP
4,,SING,CA,C,no,N,4,,203389,4601,HYP
5,,SING,CA,CB,no,N,5,,203389,4601,HYP
6,,SING,CA,HA,no,N,6,,203389,4601,HYP
7,,DOUB,C,O,no,N,7,,203389,4601,HYP
8,,SING,C,OXT,no,N,8,,203389,4601,HYP
9,,SING,CB,CG,no,N,9,,203389,4601,HYP
10,,SING,CB,HB2,no,N,10,,203389,4601,HYP
11,,SING,CB,HB3,no,N,11,,203389,4601,HYP
12,,SING,CG,CD,no,N,12,,203389,4601,HYP
13,,SING,CG,OD1,no,N,13,,203389,4601,HYP
14,,SING,CG,HG,no,N,14,,203389,4601,HYP
15,,SING,CD,HD22,no,N,15,,203389,4601,HYP
16,,SING,CD,HD23,no,N,16,,203389,4601,HYP
17,,SING,OD1,HD1,no,N,17,,203389,4601,HYP
18,,SING,OXT,HXT,no,N,18,,203389,4601,HYP
1,,SING,CHA,C1A,yes,N,1,,203409,4602,HEM
2,,DOUB,CHA,C4D,yes,N,2,,203409,4602,HEM
3,,SING,CHA,HHA,no,N,3,,203409,4602,HEM
4,,SING,CHB,C4A,yes,N,4,,203409,4602,HEM
5,,DOUB,CHB,C1B,yes,N,5,,203409,4602,HEM
6,,SING,CHB,HHB,no,N,6,,203409,4602,HEM
7,,SING,CHC,C4B,yes,N,7,,203409,4602,HEM
8,,DOUB,CHC,C1C,yes,N,8,,203409,4602,HEM
9,,SING,CHC,HHC,no,N,9,,203409,4602,HEM
10,,DOUB,CHD,C4C,yes,N,10,,203409,4602,HEM
11,,SING,CHD,C1D,yes,N,11,,203409,4602,HEM
12,,SING,CHD,HHD,no,N,12,,203409,4602,HEM
13,,DOUB,C1A,C2A,yes,N,13,,203409,4602,HEM
14,,SING,C1A,NA,yes,N,14,,203409,4602,HEM
15,,SING,C2A,C3A,yes,N,15,,203409,4602,HEM
16,,SING,C2A,CAA,no,N,16,,203409,4602,HEM
17,,DOUB,C3A,C4A,yes,N,17,,203409,4602,HEM
18,,SING,C3A,CMA,no,N,18,,203409,4602,HEM
19,,SING,C4A,NA,yes,N,19,,203409,4602,HEM
20,,SING,CMA,HMA,no,N,20,,203409,4602,HEM
21,,SING,CMA,HMAA,no,N,21,,203409,4602,HEM
22,,SING,CMA,HMAB,no,N,22,,203409,4602,HEM
23,,SING,CAA,CBA,no,N,23,,203409,4602,HEM
24,,SING,CAA,HAA,no,N,24,,203409,4602,HEM
25,,SING,CAA,HAAA,no,N,25,,203409,4602,HEM
26,,SING,CBA,CGA,no,N,26,,203409,4602,HEM
27,,SING,CBA,HBA,no,N,27,,203409,4602,HEM
28,,SING,CBA,HBAA,no,N,28,,203409,4602,HEM
29,,DOUB,CGA,O1A,no,N,29,,203409,4602,HEM
30,,SING,CGA,O2A,no,N,30,,203409,4602,HEM
31,,SING,C1B,C2B,no,N,31,,203409,4602,HEM
32,,SING,C1B,NB,yes,N,32,,203409,4602,HEM
33,,DOUB,C2B,C3B,yes,N,33,,203409,4602,HEM
34,,SING,C2B,CMB,yes,N,34,,203409,4602,HEM
35,,SING,C3B,C4B,no,N,35,,203409,4602,HEM
36,,SING,C3B,CAB,yes,N,36,,203409,4602,HEM
37,,DOUB,C4B,NB,no,N,37,,203409,4602,HEM
38,,SING,CMB,HMB,yes,N,38,,203409,4602,HEM
39,,SING,CMB,HMBA,no,N,39,,203409,4602,HEM
40,,SING,CMB,HMBB,no,N,40,,203409,4602,HEM
41,,DOUB,CAB,CBB,no,N,41,,203409,4602,HEM
42,,SING,CAB,HAB,no,N,42,,203409,4602,HEM
43,,SING,CBB,HBB,no,N,43,,203409,4602,HEM
44,,SING,CBB,HBBA,no,N,44,,203409,4602,HEM
45,,SING,C1C,C2C,no,N,45,,203409,4602,HEM
46,,SING,C1C,NC,yes,N,46,,203409,4602,HEM
47,,DOUB,C2C,C3C,yes,N,47,,203409,4602,HEM
48,,SING,C2C,CMC,yes,N,48,,203409,4602,HEM
49,,SING,C3C,C4C,no,N,49,,203409,4602,HEM
50,,SING,C3C,CAC,yes,N,50,,203409,4602,HEM
51,,SING,C4C,NC,no,N,51,,203409,4602,HEM
52,,SING,CMC,HMC,yes,N,52,,203409,4602,HEM
53,,SING,CMC,HMCA,no,N,53,,203409,4602,HEM
54,,SING,CMC,HMCB,no,N,54,,203409,4602,HEM
55,,DOUB,CAC,CBC,no,N,55,,203409,4602,HEM
56,,SING,CAC,HAC,no,N,56,,203409,4602,HEM
57,,SING,CBC,HBC,no,N,57,,203409,4602,HEM
58,,SING,CBC,HBCA,no,N,58,,203409,4602,HEM
59,,SING,C1D,C2D,no,N,59,,203409,4602,HEM
60,,DOUB,C1D,ND,yes,N,60,,203409,4602,HEM
61,,DOUB,C2D,C3D,yes,N,61,,203409,4602,HEM
62,,SING,C2D,CMD,yes,N,62,,203409,4602,HEM
63,,SING,C3D,C4D,no,N,63,,203409,4602,HEM
64,,SING,C3D,CAD,yes,N,64,,203409,4602,HEM
65,,SING,C4D,ND,no,N,65,,203409,4602,HEM
66,,SING,CMD,HMD,yes,N,66,,203409,4602,HEM
67,,SING,CMD,HMDA,no,N,67,,203409,4602,HEM
68,,SING,CMD,HMDB,no,N,68,,203409,4602,HEM
69,,SING,CAD,CBD,no,N,69,,203409,4602,HEM
70,,SING,CAD,HAD,no,N,70,,203409,4602,HEM
71,,SING,CAD,HADA,no,N,71,,203409,4602,HEM
72,,SING,CBD,CGD,no,N,72,,203409,4602,HEM
73,,SING,CBD,HBD,no,N,73,,203409,4602,HEM
74,,SING,CBD,HBDA,no,N,74,,203409,4602,HEM
75,,DOUB,CGD,O1D,no,N,75,,203409,4602,HEM
76,,SING,CGD,O2D,no,N,76,,203409,4602,HEM
77,,SING,O2A,H2A,no,N,77,,203409,4602,HEM
78,,SING,O2D,H2D,no,N,78,,203409,4602,HEM
79,,SING,FE,NA,no,N,79,,203409,4602,HEM
80,,SING,FE,NB,no,N,80,,203409,4602,HEM
81,,SING,FE,NC,no,N,81,,203409,4602,HEM
82,,SING,FE,ND,no,N,82,,203409,4602,HEM
1,,SING,N,CA,no,N,1,,203446,4604,AIB
2,,SING,N,H,no,N,2,,203446,4604,AIB
3,,SING,N,H2,no,N,3,,203446,4604,AIB
4,,SING,CA,C,no,N,4,,203446,4604,AIB
5,,SING,CA,CB1,no,N,5,,203446,4604,AIB
6,,SING,CA,CB2,no,N,6,,203446,4604,AIB
7,,DOUB,C,O,no,N,7,,203446,4604,AIB
8,,SING,C,OXT,no,N,8,,203446,4604,AIB
9,,SING,OXT,HO2,no,N,9,,203446,4604,AIB
10,,SING,CB1,HB11,no,N,10,,203446,4604,AIB
11,,SING,CB1,HB12,no,N,11,,203446,4604,AIB
12,,SING,CB1,HB13,no,N,12,,203446,4604,AIB
13,,SING,CB2,HB21,no,N,13,,203446,4604,AIB
14,,SING,CB2,HB22,no,N,14,,203446,4604,AIB
15,,SING,CB2,HB23,no,N,15,,203446,4604,AIB
1,,SING,N,CA,no,N,1,,203447,4604,DIV
2,,SING,N,H,no,N,2,,203447,4604,DIV
3,,SING,N,H2,no,N,3,,203447,4604,DIV
4,,SING,CA,CB1,no,N,4,,203447,4604,DIV
5,,SING,CA,CB2,no,N,5,,203447,4604,DIV
6,,SING,CA,C,no,N,6,,203447,4604,DIV
7,,SING,CB1,CG1,no,N,7,,203447,4604,DIV
8,,SING,CB1,HB11,no,N,8,,203447,4604,DIV
9,,SING,CB1,HB12,no,N,9,,203447,4604,DIV
10,,SING,CG1,HG11,no,N,10,,203447,4604,DIV
11,,SING,CG1,HG12,no,N,11,,203447,4604,DIV
12,,SING,CG1,HG13,no,N,12,,203447,4604,DIV
13,,SING,CB2,HB21,no,N,13,,203447,4604,DIV
14,,SING,CB2,HB22,no,N,14,,203447,4604,DIV
15,,SING,CB2,HB23,no,N,15,,203447,4604,DIV
16,,DOUB,C,O,no,N,16,,203447,4604,DIV
17,,SING,C,OXT,no,N,17,,203447,4604,DIV
18,,SING,OXT,HXT,no,N,18,,203447,4604,DIV
1,,DOUB,C,O,no,N,1,,203448,4604,ACE
2,,SING,C,CH3,no,N,2,,203448,4604,ACE
3,,SING,C,H,no,N,3,,203448,4604,ACE
4,,SING,CH3,H1,no,N,4,,203448,4604,ACE
5,,SING,CH3,H2,no,N,5,,203448,4604,ACE
6,,SING,CH3,H3,no,N,6,,203448,4604,ACE
1,,SING,N,CA,no,N,1,,203449,4604,TPL
2,,SING,N,H,no,N,2,,203449,4604,TPL
3,,SING,N,H2,no,N,3,,203449,4604,TPL
4,,SING,CA,CB1,no,N,4,,203449,4604,TPL
5,,SING,CA,C,no,N,5,,203449,4604,TPL
6,,SING,CA,HA,no,N,6,,203449,4604,TPL
7,,SING,CB1,CG,no,N,7,,203449,4604,TPL
8,,SING,CB1,HB1,no,N,8,,203449,4604,TPL
9,,SING,CB1,HB2,no,N,9,,203449,4604,TPL
10,,DOUB,CG,CD1,yes,N,10,,203449,4604,TPL
11,,SING,CG,CD2,yes,N,11,,203449,4604,TPL
12,,SING,CD1,NE1,yes,N,12,,203449,4604,TPL
13,,SING,CD1,HD1,no,N,13,,203449,4604,TPL
14,,SING,CD2,CE3,yes,N,14,,203449,4604,TPL
15,,DOUB,CD2,CE2,yes,N,15,,203449,4604,TPL
16,,DOUB,CE3,CZ3,yes,N,16,,203449,4604,TPL
17,,SING,CE3,HE3,no,N,17,,203449,4604,TPL
18,,SING,CE2,NE1,yes,N,18,,203449,4604,TPL
19,,SING,CE2,CZ2,yes,N,19,,203449,4604,TPL
20,,SING,NE1,HE1,no,N,20,,203449,4604,TPL
21,,SING,CZ3,CH2,yes,N,21,,203449,4604,TPL
22,,SING,CZ3,HZ3,no,N,22,,203449,4604,TPL
23,,DOUB,CZ2,CH2,yes,N,23,,203449,4604,TPL
24,,SING,CZ2,HZ2,no,N,24,,203449,4604,TPL
25,,SING,CH2,HH2,no,N,25,,203449,4604,TPL
26,,SING,C,OXT,no,N,26,,203449,4604,TPL
27,,SING,C,HC1,no,N,27,,203449,4604,TPL
28,,SING,C,HC2,no,N,28,,203449,4604,TPL
29,,SING,OXT,HXT,no,N,29,,203449,4604,TPL
1,,SING,N,HN1,no,N,1,,203499,461,NH2
2,,SING,N,HN2,no,N,2,,203499,461,NH2
1,,SING,N,CA,no,N,1,,203598,4617,FKI
2,,SING,N,H2,no,N,2,,203598,4617,FKI
3,,SING,N,H1,no,N,3,,203598,4617,FKI
4,,SING,CA,C,no,N,4,,203598,4617,FKI
5,,SING,CA,CB,no,N,5,,203598,4617,FKI
6,,SING,CA,HA,no,N,6,,203598,4617,FKI
7,,DOUB,C,O,no,N,7,,203598,4617,FKI
8,,SING,C,CD,no,N,8,,203598,4617,FKI
9,,SING,CB,CG,no,N,9,,203598,4617,FKI
10,,SING,CB,HB2,no,N,10,,203598,4617,FKI
11,,SING,CB,HB1,no,N,11,,203598,4617,FKI
12,,SING,CG,F1,no,N,12,,203598,4617,FKI
13,,SING,CG,F2,no,N,13,,203598,4617,FKI
14,,SING,CG,HG,no,N,14,,203598,4617,FKI
15,,SING,CD,OE1,no,N,15,,203598,4617,FKI
16,,DOUB,CD,OE2,no,N,16,,203598,4617,FKI
17,,SING,OE1,HE1,no,N,17,,203598,4617,FKI
1,,SING,N,HN1,no,N,1,,203648,462,NH2
2,,SING,N,HN2,no,N,2,,203648,462,NH2
1,,SING,N,HN1,no,N,1,,203736,463,NH2
2,,SING,N,HN2,no,N,2,,203736,463,NH2
1,,SING,C1,C2,no,N,1,,203751,4630,NAG
2,,SING,C1,O1,no,N,2,,203751,4630,NAG
3,,SING,C1,O5,no,N,3,,203751,4630,NAG
4,,SING,C1,H1,no,N,4,,203751,4630,NAG
5,,SING,C2,C3,no,N,5,,203751,4630,NAG
6,,SING,C2,N2,no,N,6,,203751,4630,NAG
7,,SING,C2,H2,no,N,7,,203751,4630,NAG
8,,SING,C3,C4,no,N,8,,203751,4630,NAG
9,,SING,C3,O3,no,N,9,,203751,4630,NAG
10,,SING,C3,H3,no,N,10,,203751,4630,NAG
11,,SING,C4,C5,no,N,11,,203751,4630,NAG
12,,SING,C4,O4,no,N,12,,203751,4630,NAG
13,,SING,C4,H4,no,N,13,,203751,4630,NAG
14,,SING,C5,C6,no,N,14,,203751,4630,NAG
15,,SING,C5,O5,no,N,15,,203751,4630,NAG
16,,SING,C5,H5,no,N,16,,203751,4630,NAG
17,,SING,C6,O6,no,N,17,,203751,4630,NAG
18,,SING,C6,H61,no,N,18,,203751,4630,NAG
19,,SING,C6,H62,no,N,19,,203751,4630,NAG
20,,SING,C7,C8,no,N,20,,203751,4630,NAG
21,,SING,C7,N2,no,N,21,,203751,4630,NAG
22,,DOUB,C7,O7,no,N,22,,203751,4630,NAG
23,,SING,C8,H81,no,N,23,,203751,4630,NAG
24,,SING,C8,H82,no,N,24,,203751,4630,NAG
25,,SING,C8,H83,no,N,25,,203751,4630,NAG
26,,SING,N2,HN2,no,N,26,,203751,4630,NAG
27,,SING,O1,HO1,no,N,27,,203751,4630,NAG
28,,SING,O3,HO3,no,N,28,,203751,4630,NAG
29,,SING,O4,HO4,no,N,29,,203751,4630,NAG
30,,SING,O6,HO6,no,N,30,,203751,4630,NAG
1,,SING,N,HN1,no,N,1,,203920,464,NH2
2,,SING,N,HN2,no,N,2,,203920,464,NH2
1,,SING,N,HN1,no,N,1,,203934,4640,NH2
2,,SING,N,HN2,no,N,2,,203934,4640,NH2
1,,DOUB,P,OP1,no,N,1,,204040,4646,2AR
2,,SING,P,OP2,no,N,2,,204040,4646,2AR
3,,SING,P,OP3,no,N,3,,204040,4646,2AR
4,,SING,P,O5',no,N,4,,204040,4646,2AR
5,,SING,OP2,HOP2,no,N,5,,204040,4646,2AR
6,,SING,OP3,HOP3,no,N,6,,204040,4646,2AR
7,,SING,O5',C5',no,N,7,,204040,4646,2AR
8,,SING,C5',C4',no,N,8,,204040,4646,2AR
9,,SING,C5',H5',no,N,9,,204040,4646,2AR
10,,SING,C5',H5'',no,N,10,,204040,4646,2AR
11,,SING,C4',CX',no,N,11,,204040,4646,2AR
12,,SING,C4',C3',no,N,12,,204040,4646,2AR
13,,SING,C4',H4',no,N,13,,204040,4646,2AR
14,,SING,CX',C1',no,N,14,,204040,4646,2AR
15,,SING,CX',HX'1,no,N,15,,204040,4646,2AR
16,,SING,CX',HX'2,no,N,16,,204040,4646,2AR
17,,SING,C1',N9,no,N,17,,204040,4646,2AR
18,,SING,C1',C2',no,N,18,,204040,4646,2AR
19,,SING,C1',H1',no,N,19,,204040,4646,2AR
20,,SING,N9,C4,yes,N,20,,204040,4646,2AR
21,,SING,N9,C8,yes,N,21,,204040,4646,2AR
22,,SING,C4,N3,yes,N,22,,204040,4646,2AR
23,,DOUB,C4,C5,yes,N,23,,204040,4646,2AR
24,,DOUB,N3,C2,yes,N,24,,204040,4646,2AR
25,,SING,C2,N1,yes,N,25,,204040,4646,2AR
26,,SING,C2,H2,no,N,26,,204040,4646,2AR
27,,DOUB,N1,C6,yes,N,27,,204040,4646,2AR
28,,SING,C6,N6,no,N,28,,204040,4646,2AR
29,,SING,C6,C5,yes,N,29,,204040,4646,2AR
30,,SING,N6,H61,no,N,30,,204040,4646,2AR
31,,SING,N6,H62,no,N,31,,204040,4646,2AR
32,,SING,C5,N7,yes,N,32,,204040,4646,2AR
33,,DOUB,N7,C8,yes,N,33,,204040,4646,2AR
34,,SING,C8,H8,no,N,34,,204040,4646,2AR
35,,SING,C2',C3',no,N,35,,204040,4646,2AR
36,,SING,C2',H2'',no,N,36,,204040,4646,2AR
37,,SING,C2',H2',no,N,37,,204040,4646,2AR
38,,SING,C3',O3',no,N,38,,204040,4646,2AR
39,,SING,C3',H3',no,N,39,,204040,4646,2AR
40,,SING,O3',HO3',no,N,40,,204040,4646,2AR
1,,SING,OP3,P,no,N,1,,204041,4646,8OG
2,,SING,OP3,HOP3,no,N,2,,204041,4646,8OG
3,,DOUB,P,OP1,no,N,3,,204041,4646,8OG
4,,SING,P,OP2,no,N,4,,204041,4646,8OG
5,,SING,P,O5',no,N,5,,204041,4646,8OG
6,,SING,OP2,HOP2,no,N,6,,204041,4646,8OG
7,,SING,O5',C5',no,N,7,,204041,4646,8OG
8,,SING,C5',C4',no,N,8,,204041,4646,8OG
9,,SING,C5',H5',no,N,9,,204041,4646,8OG
10,,SING,C5',H5'',no,N,10,,204041,4646,8OG
11,,SING,C4',O4',no,N,11,,204041,4646,8OG
12,,SING,C4',C3',no,N,12,,204041,4646,8OG
13,,SING,C4',H4',no,N,13,,204041,4646,8OG
14,,SING,O4',C1',no,N,14,,204041,4646,8OG
15,,SING,C3',O3',no,N,15,,204041,4646,8OG
16,,SING,C3',C2',no,N,16,,204041,4646,8OG
17,,SING,C3',H3',no,N,17,,204041,4646,8OG
18,,SING,O3',HO3',no,N,18,,204041,4646,8OG
19,,SING,C2',C1',no,N,19,,204041,4646,8OG
20,,SING,C2',H2',no,N,20,,204041,4646,8OG
21,,SING,C2',H2'',no,N,21,,204041,4646,8OG
22,,SING,C1',N9,no,N,22,,204041,4646,8OG
23,,SING,C1',H1',no,N,23,,204041,4646,8OG
24,,SING,N9,C8,no,N,24,,204041,4646,8OG
25,,SING,N9,C4,no,N,25,,204041,4646,8OG
26,,SING,C8,N7,no,N,26,,204041,4646,8OG
27,,DOUB,C8,O8,no,N,27,,204041,4646,8OG
28,,SING,N7,C5,no,N,28,,204041,4646,8OG
29,,SING,N7,H7,no,N,29,,204041,4646,8OG
30,,SING,C5,C6,no,N,30,,204041,4646,8OG
31,,DOUB,C5,C4,no,N,31,,204041,4646,8OG
32,,DOUB,C6,O6,no,N,32,,204041,4646,8OG
33,,SING,C6,N1,no,N,33,,204041,4646,8OG
34,,SING,N1,C2,no,N,34,,204041,4646,8OG
35,,SING,N1,H1,no,N,35,,204041,4646,8OG
36,,SING,C2,N2,no,N,36,,204041,4646,8OG
37,,DOUB,C2,N3,no,N,37,,204041,4646,8OG
38,,SING,N2,H21,no,N,38,,204041,4646,8OG
39,,SING,N2,H22,no,N,39,,204041,4646,8OG
40,,SING,N3,C4,no,N,40,,204041,4646,8OG
1,,DOUB,C1,C2,yes,N,1,,204063,4647,BAP
2,,SING,C1,C1A,yes,N,2,,204063,4647,BAP
3,,SING,C1,H1,no,N,3,,204063,4647,BAP
4,,SING,C2,C3,yes,N,4,,204063,4647,BAP
5,,SING,C2,H2,no,N,5,,204063,4647,BAP
6,,DOUB,C3,C3A,yes,N,6,,204063,4647,BAP
7,,SING,C3,H3,no,N,7,,204063,4647,BAP
8,,SING,C3A,C4,yes,N,8,,204063,4647,BAP
9,,SING,C3A,C3B,yes,N,9,,204063,4647,BAP
10,,DOUB,C4,C5,yes,N,10,,204063,4647,BAP
11,,SING,C4,H4,no,N,11,,204063,4647,BAP
12,,SING,C5,C5A,yes,N,12,,204063,4647,BAP
13,,SING,C5,H5,no,N,13,,204063,4647,BAP
14,,DOUB,C5A,C6,yes,N,14,,204063,4647,BAP
15,,SING,C5A,C5B,yes,N,15,,204063,4647,BAP
16,,SING,C6,C7,yes,N,16,,204063,4647,BAP
17,,SING,C6,C4',no,N,17,,204063,4647,BAP
18,,DOUB,C7,C8,yes,N,18,,204063,4647,BAP
19,,SING,C7,C1',no,N,19,,204063,4647,BAP
20,,SING,C8,C8A,yes,N,20,,204063,4647,BAP
21,,SING,C8,H8,no,N,21,,204063,4647,BAP
22,,DOUB,C8A,C9,yes,N,22,,204063,4647,BAP
23,,SING,C8A,C5B,yes,N,23,,204063,4647,BAP
24,,SING,C9,C10,yes,N,24,,204063,4647,BAP
25,,SING,C9,H9,no,N,25,,204063,4647,BAP
26,,DOUB,C10,C1A,yes,N,26,,204063,4647,BAP
27,,SING,C10,H10,no,N,27,,204063,4647,BAP
28,,SING,C1A,C3B,yes,N,28,,204063,4647,BAP
29,,DOUB,C3B,C5B,yes,N,29,,204063,4647,BAP
30,,SING,C1',O1',no,N,30,,204063,4647,BAP
31,,SING,C1',C2',no,N,31,,204063,4647,BAP
32,,SING,C1',H1',no,N,32,,204063,4647,BAP
33,,SING,O1',HO1,no,N,33,,204063,4647,BAP
34,,SING,C2',O2',no,N,34,,204063,4647,BAP
35,,SING,C2',C3',no,N,35,,204063,4647,BAP
36,,SING,C2',H2',no,N,36,,204063,4647,BAP
37,,SING,O2',HO2,no,N,37,,204063,4647,BAP
38,,SING,C3',O3',no,N,38,,204063,4647,BAP
39,,SING,C3',C4',no,N,39,,204063,4647,BAP
40,,SING,C3',H3',no,N,40,,204063,4647,BAP
41,,SING,O3',HO3,no,N,41,,204063,4647,BAP
42,,SING,C4',H4'1,no,N,42,,204063,4647,BAP
43,,SING,C4',H4'2,no,N,43,,204063,4647,BAP
1,,SING,N,HN1,no,N,1,,204120,465,NH2
2,,SING,N,HN2,no,N,2,,204120,465,NH2
1,,SING,N,HN1,no,N,1,,204239,466,NH2
2,,SING,N,HN2,no,N,2,,204239,466,NH2
1,,SING,C1,N2,no,N,1,,204306,4666,SNR
2,,SING,C1,N5,no,N,2,,204306,4666,SNR
3,,DOUB,C1,O11,no,N,3,,204306,4666,SNR
4,,SING,N2,C3,no,N,4,,204306,4666,SNR
5,,SING,N2,HN2,no,N,5,,204306,4666,SNR
6,,SING,C3,C4,no,N,6,,204306,4666,SNR
7,,SING,C3,C8,no,N,7,,204306,4666,SNR
8,,SING,C3,H3,no,N,8,,204306,4666,SNR
9,,SING,C4,N5,no,N,9,,204306,4666,SNR
10,,SING,C4,C6,no,N,10,,204306,4666,SNR
11,,SING,C4,H4,no,N,11,,204306,4666,SNR
12,,SING,N5,HN5,no,N,12,,204306,4666,SNR
13,,SING,C6,S7,no,N,13,,204306,4666,SNR
14,,SING,C6,C12,no,N,14,,204306,4666,SNR
15,,SING,C6,H6,no,N,15,,204306,4666,SNR
16,,SING,S7,C8,no,N,16,,204306,4666,SNR
17,,SING,C8,H81,no,N,17,,204306,4666,SNR
18,,SING,C8,H82,no,N,18,,204306,4666,SNR
19,,SING,C12,C13,no,N,19,,204306,4666,SNR
20,,SING,C12,H11,no,N,20,,204306,4666,SNR
21,,SING,C12,H21,no,N,21,,204306,4666,SNR
22,,SING,C13,C14,no,N,22,,204306,4666,SNR
23,,SING,C13,H12,no,N,23,,204306,4666,SNR
24,,SING,C13,H22,no,N,24,,204306,4666,SNR
25,,SING,C14,C15,no,N,25,,204306,4666,SNR
26,,SING,C14,H13,no,N,26,,204306,4666,SNR
27,,SING,C14,H23,no,N,27,,204306,4666,SNR
28,,SING,C15,O16,no,N,28,,204306,4666,SNR
29,,DOUB,C15,O17,no,N,29,,204306,4666,SNR
30,,SING,O16,H16,no,N,30,,204306,4666,SNR
1,,SING,N,HN1,no,N,1,,204363,467,NH2
2,,SING,N,HN2,no,N,2,,204363,467,NH2
1,,SING,C,O,no,N,1,,204414,4673,GCH
2,,SING,C,C1,no,N,2,,204414,4673,GCH
3,,SING,C,C5,no,N,3,,204414,4673,GCH
4,,SING,C,H12,no,N,4,,204414,4673,GCH
5,,SING,O,H1,no,N,5,,204414,4673,GCH
6,,SING,C1,C2,no,N,6,,204414,4673,GCH
7,,SING,C1,H10,no,N,7,,204414,4673,GCH
8,,SING,C1,H11,no,N,8,,204414,4673,GCH
9,,SING,C2,C3,no,N,9,,204414,4673,GCH
10,,SING,C2,C7,no,N,10,,204414,4673,GCH
11,,SING,C2,H9,no,N,11,,204414,4673,GCH
12,,SING,C3,C4,no,N,12,,204414,4673,GCH
13,,SING,C3,C6,no,N,13,,204414,4673,GCH
14,,SING,C3,C10,no,N,14,,204414,4673,GCH
15,,SING,C4,C5,no,N,15,,204414,4673,GCH
16,,SING,C4,H4,no,N,16,,204414,4673,GCH
17,,SING,C4,H5,no,N,17,,204414,4673,GCH
18,,SING,C5,H2,no,N,18,,204414,4673,GCH
19,,SING,C5,H3,no,N,19,,204414,4673,GCH
20,,SING,C6,H6,no,N,20,,204414,4673,GCH
21,,SING,C6,H7,no,N,21,,204414,4673,GCH
22,,SING,C6,H8,no,N,22,,204414,4673,GCH
23,,SING,C7,C8,no,N,23,,204414,4673,GCH
24,,SING,C7,H17,no,N,24,,204414,4673,GCH
25,,SING,C7,H18,no,N,25,,204414,4673,GCH
26,,SING,C8,O1,no,N,26,,204414,4673,GCH
27,,SING,C8,C9,no,N,27,,204414,4673,GCH
28,,SING,C8,H16,no,N,28,,204414,4673,GCH
29,,SING,O1,H13,no,N,29,,204414,4673,GCH
30,,SING,C9,C10,no,N,30,,204414,4673,GCH
31,,SING,C9,C14,no,N,31,,204414,4673,GCH
32,,SING,C9,H15,no,N,32,,204414,4673,GCH
33,,SING,C10,C11,no,N,33,,204414,4673,GCH
34,,SING,C10,H14,no,N,34,,204414,4673,GCH
35,,SING,C11,C12,no,N,35,,204414,4673,GCH
36,,SING,C11,H41,no,N,36,,204414,4673,GCH
37,,SING,C11,H42,no,N,37,,204414,4673,GCH
38,,SING,C12,C13,no,N,38,,204414,4673,GCH
39,,SING,C12,O3,no,N,39,,204414,4673,GCH
40,,SING,C12,H40,no,N,40,,204414,4673,GCH
41,,SING,C13,C14,no,N,41,,204414,4673,GCH
42,,SING,C13,C17,no,N,42,,204414,4673,GCH
43,,SING,C13,C23,no,N,43,,204414,4673,GCH
44,,SING,C14,C15,no,N,44,,204414,4673,GCH
45,,SING,C14,H35,no,N,45,,204414,4673,GCH
46,,SING,C15,C16,no,N,46,,204414,4673,GCH
47,,SING,C15,H33,no,N,47,,204414,4673,GCH
48,,SING,C15,H34,no,N,48,,204414,4673,GCH
49,,SING,C16,C17,no,N,49,,204414,4673,GCH
50,,SING,C16,H31,no,N,50,,204414,4673,GCH
51,,SING,C16,H32,no,N,51,,204414,4673,GCH
52,,SING,C17,C18,no,N,52,,204414,4673,GCH
53,,SING,C17,H30,no,N,53,,204414,4673,GCH
54,,SING,C18,C19,no,N,54,,204414,4673,GCH
55,,SING,C18,C20,no,N,55,,204414,4673,GCH
56,,SING,C18,H29,no,N,56,,204414,4673,GCH
57,,SING,C19,H19,no,N,57,,204414,4673,GCH
58,,SING,C19,H20,no,N,58,,204414,4673,GCH
59,,SING,C19,H21,no,N,59,,204414,4673,GCH
60,,SING,C20,C21,no,N,60,,204414,4673,GCH
61,,SING,C20,H27,no,N,61,,204414,4673,GCH
62,,SING,C20,H28,no,N,62,,204414,4673,GCH
63,,SING,C21,C22,no,N,63,,204414,4673,GCH
64,,SING,C21,H25,no,N,64,,204414,4673,GCH
65,,SING,C21,H26,no,N,65,,204414,4673,GCH
66,,SING,C22,N,no,N,66,,204414,4673,GCH
67,,DOUB,C22,O2,no,N,67,,204414,4673,GCH
68,,SING,N,CA,no,N,68,,204414,4673,GCH
69,,SING,N,H24,no,N,69,,204414,4673,GCH
70,,SING,CA,C24,no,N,70,,204414,4673,GCH
71,,SING,CA,H22,no,N,71,,204414,4673,GCH
72,,SING,CA,H23,no,N,72,,204414,4673,GCH
73,,SING,C23,H36,no,N,73,,204414,4673,GCH
74,,SING,C23,H37,no,N,74,,204414,4673,GCH
75,,SING,C23,H38,no,N,75,,204414,4673,GCH
76,,SING,O3,H39,no,N,76,,204414,4673,GCH
77,,SING,C24,O4,no,N,77,,204414,4673,GCH
78,,DOUB,C24,O5,no,N,78,,204414,4673,GCH
79,,SING,O4,H43,no,N,79,,204414,4673,GCH
1,,DOUB,C1,C2,yes,N,1,,204513,4679,WAY
2,,SING,C1,C6,yes,N,2,,204513,4679,WAY
3,,SING,C1,N20,no,N,3,,204513,4679,WAY
4,,SING,C2,CF2,yes,N,4,,204513,4679,WAY
5,,SING,C2,C10,no,N,5,,204513,4679,WAY
6,,DOUB,CF2,CH,yes,N,6,,204513,4679,WAY
7,,SING,CF2,HF2,no,N,7,,204513,4679,WAY
8,,SING,CH,CF1,yes,N,8,,204513,4679,WAY
9,,SING,CH,HH,no,N,9,,204513,4679,WAY
10,,DOUB,CF1,C6,yes,N,10,,204513,4679,WAY
11,,SING,CF1,HF1,no,N,11,,204513,4679,WAY
12,,SING,C6,CE,no,N,12,,204513,4679,WAY
13,,DOUB,C10,O11,no,N,13,,204513,4679,WAY
14,,SING,C10,N12,no,N,14,,204513,4679,WAY
15,,SING,N12,O13,no,N,15,,204513,4679,WAY
16,,SING,N12,H14,no,N,16,,204513,4679,WAY
17,,SING,O13,H15,no,N,17,,204513,4679,WAY
18,,SING,CE,HE1,no,N,18,,204513,4679,WAY
19,,SING,CE,HE2,no,N,19,,204513,4679,WAY
20,,SING,CE,HE3,no,N,20,,204513,4679,WAY
21,,SING,N20,S21,no,N,21,,204513,4679,WAY
22,,SING,N20,CD,no,N,22,,204513,4679,WAY
23,,SING,S21,C35,no,N,23,,204513,4679,WAY
24,,DOUB,S21,O50,no,N,24,,204513,4679,WAY
25,,DOUB,S21,O51,no,N,25,,204513,4679,WAY
26,,SING,CD,C27,no,N,26,,204513,4679,WAY
27,,SING,CD,HD1,no,N,27,,204513,4679,WAY
28,,SING,CD,HD2,no,N,28,,204513,4679,WAY
29,,DOUB,CK,CM,yes,N,29,,204513,4679,WAY
30,,SING,CK,CI,yes,N,30,,204513,4679,WAY
31,,SING,CK,HK,no,N,31,,204513,4679,WAY
32,,SING,CM,N25,yes,N,32,,204513,4679,WAY
33,,SING,CM,HL,no,N,33,,204513,4679,WAY
34,,DOUB,N25,CJ,yes,N,34,,204513,4679,WAY
35,,SING,CJ,C27,yes,N,35,,204513,4679,WAY
36,,SING,CJ,HJ,no,N,36,,204513,4679,WAY
37,,DOUB,C27,CI,yes,N,37,,204513,4679,WAY
38,,SING,CI,HI,no,N,38,,204513,4679,WAY
39,,DOUB,C35,CC1,yes,N,39,,204513,4679,WAY
40,,SING,C35,CC2,yes,N,40,,204513,4679,WAY
41,,SING,CC1,CB1,yes,N,41,,204513,4679,WAY
42,,SING,CC1,HC1,no,N,42,,204513,4679,WAY
43,,DOUB,CB1,C38,yes,N,43,,204513,4679,WAY
44,,SING,CB1,HB1,no,N,44,,204513,4679,WAY
45,,SING,C38,CB2,yes,N,45,,204513,4679,WAY
46,,SING,C38,O45,no,N,46,,204513,4679,WAY
47,,DOUB,CB2,CC2,yes,N,47,,204513,4679,WAY
48,,SING,CB2,HB2,no,N,48,,204513,4679,WAY
49,,SING,CC2,HC2,no,N,49,,204513,4679,WAY
50,,SING,O45,CA,no,N,50,,204513,4679,WAY
51,,SING,CA,HA1,no,N,51,,204513,4679,WAY
52,,SING,CA,HA2,no,N,52,,204513,4679,WAY
53,,SING,CA,HA3,no,N,53,,204513,4679,WAY
1,,SING,N,HN1,no,N,1,,204528,468,NH2
2,,SING,N,HN2,no,N,2,,204528,468,NH2
1,,SING,C1,C2,no,N,1,,204580,4682,RTL
2,,SING,C1,C6,no,N,2,,204580,4682,RTL
3,,SING,C1,C16,no,N,3,,204580,4682,RTL
4,,SING,C1,C17,no,N,4,,204580,4682,RTL
5,,SING,C2,C3,no,N,5,,204580,4682,RTL
6,,SING,C2,H21,no,N,6,,204580,4682,RTL
7,,SING,C2,H22,no,N,7,,204580,4682,RTL
8,,SING,C3,C4,no,N,8,,204580,4682,RTL
9,,SING,C3,H31,no,N,9,,204580,4682,RTL
10,,SING,C3,H32,no,N,10,,204580,4682,RTL
11,,SING,C4,C5,no,N,11,,204580,4682,RTL
12,,SING,C4,H41,no,N,12,,204580,4682,RTL
13,,SING,C4,H42,no,N,13,,204580,4682,RTL
14,,DOUB,C5,C6,no,N,14,,204580,4682,RTL
15,,SING,C5,C18,no,N,15,,204580,4682,RTL
16,,SING,C6,C7,no,N,16,,204580,4682,RTL
17,,DOUB,C7,C8,no,E,17,,204580,4682,RTL
18,,SING,C7,H7,no,N,18,,204580,4682,RTL
19,,SING,C8,C9,no,N,19,,204580,4682,RTL
20,,SING,C8,H8,no,N,20,,204580,4682,RTL
21,,DOUB,C9,C10,no,E,21,,204580,4682,RTL
22,,SING,C9,C19,no,N,22,,204580,4682,RTL
23,,SING,C10,C11,no,N,23,,204580,4682,RTL
24,,SING,C10,H10,no,N,24,,204580,4682,RTL
25,,DOUB,C11,C12,no,E,25,,204580,4682,RTL
26,,SING,C11,H11,no,N,26,,204580,4682,RTL
27,,SING,C12,C13,no,N,27,,204580,4682,RTL
28,,SING,C12,H12,no,N,28,,204580,4682,RTL
29,,DOUB,C13,C14,no,E,29,,204580,4682,RTL
30,,SING,C13,C20,no,N,30,,204580,4682,RTL
31,,SING,C14,C15,no,N,31,,204580,4682,RTL
32,,SING,C14,H14,no,N,32,,204580,4682,RTL
33,,SING,C15,O1,no,N,33,,204580,4682,RTL
34,,SING,C15,H151,no,N,34,,204580,4682,RTL
35,,SING,C15,H152,no,N,35,,204580,4682,RTL
36,,SING,O1,HO1,no,N,36,,204580,4682,RTL
37,,SING,C16,H161,no,N,37,,204580,4682,RTL
38,,SING,C16,H162,no,N,38,,204580,4682,RTL
39,,SING,C16,H163,no,N,39,,204580,4682,RTL
40,,SING,C17,H171,no,N,40,,204580,4682,RTL
41,,SING,C17,H172,no,N,41,,204580,4682,RTL
42,,SING,C17,H173,no,N,42,,204580,4682,RTL
43,,SING,C18,H181,no,N,43,,204580,4682,RTL
44,,SING,C18,H182,no,N,44,,204580,4682,RTL
45,,SING,C18,H183,no,N,45,,204580,4682,RTL
46,,SING,C19,H191,no,N,46,,204580,4682,RTL
47,,SING,C19,H192,no,N,47,,204580,4682,RTL
48,,SING,C19,H193,no,N,48,,204580,4682,RTL
49,,SING,C20,H201,no,N,49,,204580,4682,RTL
50,,SING,C20,H202,no,N,50,,204580,4682,RTL
51,,SING,C20,H203,no,N,51,,204580,4682,RTL
1,,SING,N,HN1,no,N,1,,204731,469,NH2
2,,SING,N,HN2,no,N,2,,204731,469,NH2
1,,DOUB,P,OP1,no,N,1,,204745,4692,5MC
2,,SING,P,OP2,no,N,2,,204745,4692,5MC
3,,SING,P,OP3,no,N,3,,204745,4692,5MC
4,,SING,P,O5',no,N,4,,204745,4692,5MC
5,,SING,OP2,HOP2,no,N,5,,204745,4692,5MC
6,,SING,OP3,HOP3,no,N,6,,204745,4692,5MC
7,,SING,O5',C5',no,N,7,,204745,4692,5MC
8,,SING,C5',C4',no,N,8,,204745,4692,5MC
9,,SING,C5',H5',no,N,9,,204745,4692,5MC
10,,SING,C5',H5'',no,N,10,,204745,4692,5MC
11,,SING,C4',O4',no,N,11,,204745,4692,5MC
12,,SING,C4',C3',no,N,12,,204745,4692,5MC
13,,SING,C4',H4',no,N,13,,204745,4692,5MC
14,,SING,O4',C1',no,N,14,,204745,4692,5MC
15,,SING,C3',O3',no,N,15,,204745,4692,5MC
16,,SING,C3',C2',no,N,16,,204745,4692,5MC
17,,SING,C3',H3',no,N,17,,204745,4692,5MC
18,,SING,O3',HO3',no,N,18,,204745,4692,5MC
19,,SING,C2',O2',no,N,19,,204745,4692,5MC
20,,SING,C2',C1',no,N,20,,204745,4692,5MC
21,,SING,C2',H2',no,N,21,,204745,4692,5MC
22,,SING,O2',HO2',no,N,22,,204745,4692,5MC
23,,SING,C1',N1,no,N,23,,204745,4692,5MC
24,,SING,C1',H1',no,N,24,,204745,4692,5MC
25,,SING,N1,C2,no,N,25,,204745,4692,5MC
26,,SING,N1,C6,no,N,26,,204745,4692,5MC
27,,DOUB,C2,O2,no,N,27,,204745,4692,5MC
28,,SING,C2,N3,no,N,28,,204745,4692,5MC
29,,DOUB,N3,C4,no,N,29,,204745,4692,5MC
30,,SING,C4,N4,no,N,30,,204745,4692,5MC
31,,SING,C4,C5,no,N,31,,204745,4692,5MC
32,,SING,N4,HN41,no,N,32,,204745,4692,5MC
33,,SING,N4,HN42,no,N,33,,204745,4692,5MC
34,,DOUB,C5,C6,no,N,34,,204745,4692,5MC
35,,SING,C5,CM5,no,N,35,,204745,4692,5MC
36,,SING,C6,H6,no,N,36,,204745,4692,5MC
37,,SING,CM5,HM51,no,N,37,,204745,4692,5MC
38,,SING,CM5,HM52,no,N,38,,204745,4692,5MC
39,,SING,CM5,HM53,no,N,39,,204745,4692,5MC
1,,SING,OP3,P,no,N,1,,204746,4692,DU
2,,SING,OP3,HOP3,no,N,2,,204746,4692,DU
3,,DOUB,P,OP1,no,N,3,,204746,4692,DU
4,,SING,P,OP2,no,N,4,,204746,4692,DU
5,,SING,P,O5',no,N,5,,204746,4692,DU
6,,SING,OP2,HOP2,no,N,6,,204746,4692,DU
7,,SING,O5',C5',no,N,7,,204746,4692,DU
8,,SING,C5',C4',no,N,8,,204746,4692,DU
9,,SING,C5',H5',no,N,9,,204746,4692,DU
10,,SING,C5',H5'',no,N,10,,204746,4692,DU
11,,SING,C4',O4',no,N,11,,204746,4692,DU
12,,SING,C4',C3',no,N,12,,204746,4692,DU
13,,SING,C4',H4',no,N,13,,204746,4692,DU
14,,SING,O4',C1',no,N,14,,204746,4692,DU
15,,SING,C3',O3',no,N,15,,204746,4692,DU
16,,SING,C3',C2',no,N,16,,204746,4692,DU
17,,SING,C3',H3',no,N,17,,204746,4692,DU
18,,SING,O3',HO3',no,N,18,,204746,4692,DU
19,,SING,C2',C1',no,N,19,,204746,4692,DU
20,,SING,C2',H2',no,N,20,,204746,4692,DU
21,,SING,C2',H2'',no,N,21,,204746,4692,DU
22,,SING,C1',N1,no,N,22,,204746,4692,DU
23,,SING,C1',H1',no,N,23,,204746,4692,DU
24,,SING,N1,C2,no,N,24,,204746,4692,DU
25,,SING,N1,C6,no,N,25,,204746,4692,DU
26,,DOUB,C2,O2,no,N,26,,204746,4692,DU
27,,SING,C2,N3,no,N,27,,204746,4692,DU
28,,SING,N3,C4,no,N,28,,204746,4692,DU
29,,SING,N3,H3,no,N,29,,204746,4692,DU
30,,DOUB,C4,O4,no,N,30,,204746,4692,DU
31,,SING,C4,C5,no,N,31,,204746,4692,DU
32,,DOUB,C5,C6,no,N,32,,204746,4692,DU
33,,SING,C5,H5,no,N,33,,204746,4692,DU
34,,SING,C6,H6,no,N,34,,204746,4692,DU
1,,SING,OP3,P,no,N,1,,204747,4692,CH
2,,SING,OP3,HOP3,no,N,2,,204747,4692,CH
3,,DOUB,P,OP1,no,N,3,,204747,4692,CH
4,,SING,P,OP2,no,N,4,,204747,4692,CH
5,,SING,P,O5',no,N,5,,204747,4692,CH
6,,SING,OP2,HOP2,no,N,6,,204747,4692,CH
7,,SING,O5',C5',no,N,7,,204747,4692,CH
8,,SING,C5',C4',no,N,8,,204747,4692,CH
9,,SING,C5',H5',no,N,9,,204747,4692,CH
10,,SING,C5',H5'',no,N,10,,204747,4692,CH
11,,SING,C4',O4',no,N,11,,204747,4692,CH
12,,SING,C4',C3',no,N,12,,204747,4692,CH
13,,SING,C4',H4',no,N,13,,204747,4692,CH
14,,SING,O4',C1',no,N,14,,204747,4692,CH
15,,SING,C3',O3',no,N,15,,204747,4692,CH
16,,SING,C3',C2',no,N,16,,204747,4692,CH
17,,SING,C3',H3',no,N,17,,204747,4692,CH
18,,SING,O3',HO3',no,N,18,,204747,4692,CH
19,,SING,C2',O2',no,N,19,,204747,4692,CH
20,,SING,C2',C1',no,N,20,,204747,4692,CH
21,,SING,C2',H2',no,N,21,,204747,4692,CH
22,,SING,O2',HO2',no,N,22,,204747,4692,CH
23,,SING,C1',N1,no,N,23,,204747,4692,CH
24,,SING,C1',H1',no,N,24,,204747,4692,CH
25,,SING,N1,C2,no,N,25,,204747,4692,CH
26,,DOUB,N1,C6,no,N,26,,204747,4692,CH
27,,DOUB,C2,O2,no,N,27,,204747,4692,CH
28,,SING,C2,N3,no,N,28,,204747,4692,CH
29,,SING,N3,C4,no,N,29,,204747,4692,CH
30,,SING,N3,HN3,no,N,30,,204747,4692,CH
31,,SING,C4,N4,no,N,31,,204747,4692,CH
32,,DOUB,C4,C5,no,N,32,,204747,4692,CH
33,,SING,N4,H41,no,N,33,,204747,4692,CH
34,,SING,N4,H42,no,N,34,,204747,4692,CH
35,,SING,C5,C6,no,N,35,,204747,4692,CH
36,,SING,C5,H5,no,N,36,,204747,4692,CH
37,,SING,C6,H6,no,N,37,,204747,4692,CH
1,,SING,FE,NA,no,N,1,,204783,4695,HEA
2,,SING,FE,NB,no,N,2,,204783,4695,HEA
3,,SING,FE,NC,no,N,3,,204783,4695,HEA
4,,SING,FE,ND,no,N,4,,204783,4695,HEA
5,,DOUB,CHA,C1A,no,N,5,,204783,4695,HEA
6,,SING,CHA,C4D,no,N,6,,204783,4695,HEA
7,,SING,CHA,HHA,no,N,7,,204783,4695,HEA
8,,DOUB,CHB,C4A,no,N,8,,204783,4695,HEA
9,,SING,CHB,C1B,no,N,9,,204783,4695,HEA
10,,SING,CHB,HHB,no,N,10,,204783,4695,HEA
11,,DOUB,CHC,C4B,no,N,11,,204783,4695,HEA
12,,SING,CHC,C1C,no,N,12,,204783,4695,HEA
13,,SING,CHC,HHC,no,N,13,,204783,4695,HEA
14,,SING,CHD,C4C,no,N,14,,204783,4695,HEA
15,,DOUB,CHD,C1D,no,N,15,,204783,4695,HEA
16,,SING,CHD,HHD,no,N,16,,204783,4695,HEA
17,,SING,NA,C1A,yes,N,17,,204783,4695,HEA
18,,SING,NA,C4A,yes,N,18,,204783,4695,HEA
19,,SING,C1A,C2A,yes,N,19,,204783,4695,HEA
20,,DOUB,C2A,C3A,yes,N,20,,204783,4695,HEA
21,,SING,C2A,CAA,no,N,21,,204783,4695,HEA
22,,SING,C3A,C4A,yes,N,22,,204783,4695,HEA
23,,SING,C3A,CMA,no,N,23,,204783,4695,HEA
24,,DOUB,CMA,OMA,no,N,24,,204783,4695,HEA
25,,SING,CMA,HMA,no,N,25,,204783,4695,HEA
26,,SING,CAA,CBA,no,N,26,,204783,4695,HEA
27,,SING,CAA,HAA1,no,N,27,,204783,4695,HEA
28,,SING,CAA,HAA2,no,N,28,,204783,4695,HEA
29,,SING,CBA,CGA,no,N,29,,204783,4695,HEA
30,,SING,CBA,HBA1,no,N,30,,204783,4695,HEA
31,,SING,CBA,HBA2,no,N,31,,204783,4695,HEA
32,,DOUB,CGA,O1A,no,N,32,,204783,4695,HEA
33,,SING,CGA,O2A,no,N,33,,204783,4695,HEA
34,,SING,O2A,H2A,no,N,34,,204783,4695,HEA
35,,DOUB,NB,C1B,no,N,35,,204783,4695,HEA
36,,SING,NB,C4B,no,N,36,,204783,4695,HEA
37,,SING,C1B,C2B,no,N,37,,204783,4695,HEA
38,,DOUB,C2B,C3B,no,N,38,,204783,4695,HEA
39,,SING,C2B,CMB,no,N,39,,204783,4695,HEA
40,,SING,C3B,C4B,no,N,40,,204783,4695,HEA
41,,SING,C3B,C11,no,N,41,,204783,4695,HEA
42,,SING,CMB,HMB1,no,N,42,,204783,4695,HEA
43,,SING,CMB,HMB2,no,N,43,,204783,4695,HEA
44,,SING,CMB,HMB3,no,N,44,,204783,4695,HEA
45,,SING,NC,C1C,yes,N,45,,204783,4695,HEA
46,,SING,NC,C4C,yes,N,46,,204783,4695,HEA
47,,DOUB,C1C,C2C,yes,N,47,,204783,4695,HEA
48,,SING,C2C,C3C,yes,N,48,,204783,4695,HEA
49,,SING,C2C,CMC,no,N,49,,204783,4695,HEA
50,,DOUB,C3C,C4C,yes,N,50,,204783,4695,HEA
51,,SING,C3C,CAC,no,N,51,,204783,4695,HEA
52,,SING,CMC,HMC1,no,N,52,,204783,4695,HEA
53,,SING,CMC,HMC2,no,N,53,,204783,4695,HEA
54,,SING,CMC,HMC3,no,N,54,,204783,4695,HEA
55,,DOUB,CAC,CBC,no,N,55,,204783,4695,HEA
56,,SING,CAC,HAC,no,N,56,,204783,4695,HEA
57,,SING,CBC,HBC1,no,N,57,,204783,4695,HEA
58,,SING,CBC,HBC2,no,N,58,,204783,4695,HEA
59,,SING,ND,C1D,no,N,59,,204783,4695,HEA
60,,DOUB,ND,C4D,no,N,60,,204783,4695,HEA
61,,SING,C1D,C2D,no,N,61,,204783,4695,HEA
62,,DOUB,C2D,C3D,no,N,62,,204783,4695,HEA
63,,SING,C2D,CMD,no,N,63,,204783,4695,HEA
64,,SING,C3D,C4D,no,N,64,,204783,4695,HEA
65,,SING,C3D,CAD,no,N,65,,204783,4695,HEA
66,,SING,CMD,HMD1,no,N,66,,204783,4695,HEA
67,,SING,CMD,HMD2,no,N,67,,204783,4695,HEA
68,,SING,CMD,HMD3,no,N,68,,204783,4695,HEA
69,,SING,CAD,CBD,no,N,69,,204783,4695,HEA
70,,SING,CAD,HAD1,no,N,70,,204783,4695,HEA
71,,SING,CAD,HAD2,no,N,71,,204783,4695,HEA
72,,SING,CBD,CGD,no,N,72,,204783,4695,HEA
73,,SING,CBD,HBD1,no,N,73,,204783,4695,HEA
74,,SING,CBD,HBD2,no,N,74,,204783,4695,HEA
75,,DOUB,CGD,O1D,no,N,75,,204783,4695,HEA
76,,SING,CGD,O2D,no,N,76,,204783,4695,HEA
77,,SING,O2D,H2D,no,N,77,,204783,4695,HEA
78,,SING,C11,O11,no,N,78,,204783,4695,HEA
79,,SING,C11,C12,no,N,79,,204783,4695,HEA
80,,SING,C11,H11,no,N,80,,204783,4695,HEA
81,,SING,O11,HO1,no,N,81,,204783,4695,HEA
82,,SING,C12,C13,no,N,82,,204783,4695,HEA
83,,SING,C12,H121,no,N,83,,204783,4695,HEA
84,,SING,C12,H122,no,N,84,,204783,4695,HEA
85,,SING,C13,C14,no,N,85,,204783,4695,HEA
86,,SING,C13,H131,no,N,86,,204783,4695,HEA
87,,SING,C13,H132,no,N,87,,204783,4695,HEA
88,,DOUB,C14,C15,no,E,88,,204783,4695,HEA
89,,SING,C14,H14,no,N,89,,204783,4695,HEA
90,,SING,C15,C16,no,N,90,,204783,4695,HEA
91,,SING,C15,C26,no,N,91,,204783,4695,HEA
92,,SING,C16,C17,no,N,92,,204783,4695,HEA
93,,SING,C16,H161,no,N,93,,204783,4695,HEA
94,,SING,C16,H162,no,N,94,,204783,4695,HEA
95,,SING,C17,C18,no,N,95,,204783,4695,HEA
96,,SING,C17,H171,no,N,96,,204783,4695,HEA
97,,SING,C17,H172,no,N,97,,204783,4695,HEA
98,,DOUB,C18,C19,no,E,98,,204783,4695,HEA
99,,SING,C18,H18,no,N,99,,204783,4695,HEA
100,,SING,C19,C20,no,N,100,,204783,4695,HEA
101,,SING,C19,C27,no,N,101,,204783,4695,HEA
102,,SING,C20,C21,no,N,102,,204783,4695,HEA
103,,SING,C20,H201,no,N,103,,204783,4695,HEA
104,,SING,C20,H202,no,N,104,,204783,4695,HEA
105,,SING,C21,C22,no,N,105,,204783,4695,HEA
106,,SING,C21,H211,no,N,106,,204783,4695,HEA
107,,SING,C21,H212,no,N,107,,204783,4695,HEA
108,,DOUB,C22,C23,no,N,108,,204783,4695,HEA
109,,SING,C22,H22,no,N,109,,204783,4695,HEA
110,,SING,C23,C24,no,N,110,,204783,4695,HEA
111,,SING,C23,C25,no,N,111,,204783,4695,HEA
112,,SING,C24,H241,no,N,112,,204783,4695,HEA
113,,SING,C24,H242,no,N,113,,204783,4695,HEA
114,,SING,C24,H243,no,N,114,,204783,4695,HEA
115,,SING,C25,H251,no,N,115,,204783,4695,HEA
116,,SING,C25,H252,no,N,116,,204783,4695,HEA
117,,SING,C25,H253,no,N,117,,204783,4695,HEA
118,,SING,C26,H261,no,N,118,,204783,4695,HEA
119,,SING,C26,H262,no,N,119,,204783,4695,HEA
120,,SING,C26,H263,no,N,120,,204783,4695,HEA
121,,SING,C27,H271,no,N,121,,204783,4695,HEA
122,,SING,C27,H272,no,N,122,,204783,4695,HEA
123,,SING,C27,H273,no,N,123,,204783,4695,HEA
1,,SING,N,HN1,no,N,1,,204863,470,NH2
2,,SING,N,HN2,no,N,2,,204863,470,NH2
1,,DOUB,PG,O1G,no,N,1,,204878,4700,GNP
2,,SING,PG,O2G,no,N,2,,204878,4700,GNP
3,,SING,PG,O3G,no,N,3,,204878,4700,GNP
4,,SING,PG,N3B,no,N,4,,204878,4700,GNP
5,,SING,O2G,HOG2,no,N,5,,204878,4700,GNP
6,,SING,O3G,HOG3,no,N,6,,204878,4700,GNP
7,,SING,N3B,PB,no,N,7,,204878,4700,GNP
8,,SING,N3B,HNB3,no,N,8,,204878,4700,GNP
9,,DOUB,PB,O1B,no,N,9,,204878,4700,GNP
10,,SING,PB,O2B,no,N,10,,204878,4700,GNP
11,,SING,PB,O3A,no,N,11,,204878,4700,GNP
12,,SING,O2B,HOB2,no,N,12,,204878,4700,GNP
13,,SING,O3A,PA,no,N,13,,204878,4700,GNP
14,,DOUB,PA,O1A,no,N,14,,204878,4700,GNP
15,,SING,PA,O2A,no,N,15,,204878,4700,GNP
16,,SING,PA,O5',no,N,16,,204878,4700,GNP
17,,SING,O2A,HOA2,no,N,17,,204878,4700,GNP
18,,SING,O5',C5',no,N,18,,204878,4700,GNP
19,,SING,C5',C4',no,N,19,,204878,4700,GNP
20,,SING,C5',H5'2,no,N,20,,204878,4700,GNP
21,,SING,C5',H5'1,no,N,21,,204878,4700,GNP
22,,SING,C4',O4',no,N,22,,204878,4700,GNP
23,,SING,C4',C3',no,N,23,,204878,4700,GNP
24,,SING,C4',H4',no,N,24,,204878,4700,GNP
25,,SING,O4',C1',no,N,25,,204878,4700,GNP
26,,SING,C3',O3',no,N,26,,204878,4700,GNP
27,,SING,C3',C2',no,N,27,,204878,4700,GNP
28,,SING,C3',H3',no,N,28,,204878,4700,GNP
29,,SING,O3',HO3',no,N,29,,204878,4700,GNP
30,,SING,C2',O2',no,N,30,,204878,4700,GNP
31,,SING,C2',C1',no,N,31,,204878,4700,GNP
32,,SING,C2',H2',no,N,32,,204878,4700,GNP
33,,SING,O2',HO2',no,N,33,,204878,4700,GNP
34,,SING,C1',N9,no,N,34,,204878,4700,GNP
35,,SING,C1',H1',no,N,35,,204878,4700,GNP
36,,SING,N9,C8,yes,N,36,,204878,4700,GNP
37,,SING,N9,C4,yes,N,37,,204878,4700,GNP
38,,DOUB,C8,N7,yes,N,38,,204878,4700,GNP
39,,SING,C8,H8,no,N,39,,204878,4700,GNP
40,,SING,N7,C5,yes,N,40,,204878,4700,GNP
41,,SING,C5,C6,yes,N,41,,204878,4700,GNP
42,,DOUB,C5,C4,yes,N,42,,204878,4700,GNP
43,,DOUB,C6,O6,no,N,43,,204878,4700,GNP
44,,SING,C6,N1,yes,N,44,,204878,4700,GNP
45,,SING,N1,C2,yes,N,45,,204878,4700,GNP
46,,SING,N1,HN1,no,N,46,,204878,4700,GNP
47,,SING,C2,N2,no,N,47,,204878,4700,GNP
48,,DOUB,C2,N3,yes,N,48,,204878,4700,GNP
49,,SING,N2,HN21,no,N,49,,204878,4700,GNP
50,,SING,N2,HN22,no,N,50,,204878,4700,GNP
51,,SING,N3,C4,yes,N,51,,204878,4700,GNP
1,,DOUB,C,O,no,N,1,,204922,4702,ACE
2,,SING,C,CH3,no,N,2,,204922,4702,ACE
3,,SING,C,H,no,N,3,,204922,4702,ACE
4,,SING,CH3,H1,no,N,4,,204922,4702,ACE
5,,SING,CH3,H2,no,N,5,,204922,4702,ACE
6,,SING,CH3,H3,no,N,6,,204922,4702,ACE
1,,SING,N,HN1,no,N,1,,204923,4702,NH2
2,,SING,N,HN2,no,N,2,,204923,4702,NH2
1,,SING,N,HN1,no,N,1,,205087,471,NH2
2,,SING,N,HN2,no,N,2,,205087,471,NH2
1,,SING,C1,C2,no,N,1,,205150,4712,SCR
2,,SING,C1,O1,no,N,2,,205150,4712,SCR
3,,SING,C1,O5,no,N,3,,205150,4712,SCR
4,,SING,C1,H1,no,N,4,,205150,4712,SCR
5,,SING,C2,C3,no,N,5,,205150,4712,SCR
6,,SING,C2,O2,no,N,6,,205150,4712,SCR
7,,SING,C2,H2,no,N,7,,205150,4712,SCR
8,,SING,C3,C4,no,N,8,,205150,4712,SCR
9,,SING,C3,O3,no,N,9,,205150,4712,SCR
10,,SING,C3,H3,no,N,10,,205150,4712,SCR
11,,SING,C4,C5,no,N,11,,205150,4712,SCR
12,,SING,C4,O4,no,N,12,,205150,4712,SCR
13,,SING,C4,H4,no,N,13,,205150,4712,SCR
14,,SING,C5,C6,no,N,14,,205150,4712,SCR
15,,SING,C5,O5,no,N,15,,205150,4712,SCR
16,,SING,C5,H5,no,N,16,,205150,4712,SCR
17,,SING,C6,O6,no,N,17,,205150,4712,SCR
18,,SING,C6,H61,no,N,18,,205150,4712,SCR
19,,SING,C6,H62,no,N,19,,205150,4712,SCR
20,,SING,C11,C12,no,N,20,,205150,4712,SCR
21,,SING,C11,O81,no,N,21,,205150,4712,SCR
22,,SING,C11,H111,no,N,22,,205150,4712,SCR
23,,SING,C11,H112,no,N,23,,205150,4712,SCR
24,,SING,C12,C13,no,N,24,,205150,4712,SCR
25,,SING,C12,O1,no,N,25,,205150,4712,SCR
26,,SING,C12,O10,no,N,26,,205150,4712,SCR
27,,SING,C13,C14,no,N,27,,205150,4712,SCR
28,,SING,C13,O91,no,N,28,,205150,4712,SCR
29,,SING,C13,H13,no,N,29,,205150,4712,SCR
30,,SING,C14,C15,no,N,30,,205150,4712,SCR
31,,SING,C14,O71,no,N,31,,205150,4712,SCR
32,,SING,C14,H14,no,N,32,,205150,4712,SCR
33,,SING,C15,C16,no,N,33,,205150,4712,SCR
34,,SING,C15,O10,no,N,34,,205150,4712,SCR
35,,SING,C15,H15,no,N,35,,205150,4712,SCR
36,,SING,C16,O51,no,N,36,,205150,4712,SCR
37,,SING,C16,H161,no,N,37,,205150,4712,SCR
38,,SING,C16,H162,no,N,38,,205150,4712,SCR
39,,SING,O2,S2,no,N,39,,205150,4712,SCR
40,,DOUB,O22,S2,no,N,40,,205150,4712,SCR
41,,DOUB,O23,S2,no,N,41,,205150,4712,SCR
42,,SING,O24,S2,no,N,42,,205150,4712,SCR
43,,SING,O24,H24,no,N,43,,205150,4712,SCR
44,,SING,O3,S3,no,N,44,,205150,4712,SCR
45,,DOUB,O32,S3,no,N,45,,205150,4712,SCR
46,,DOUB,O33,S3,no,N,46,,205150,4712,SCR
47,,SING,O34,S3,no,N,47,,205150,4712,SCR
48,,SING,O34,H34,no,N,48,,205150,4712,SCR
49,,SING,O4,S4,no,N,49,,205150,4712,SCR
50,,DOUB,O42,S4,no,N,50,,205150,4712,SCR
51,,DOUB,O43,S4,no,N,51,,205150,4712,SCR
52,,SING,O44,S4,no,N,52,,205150,4712,SCR
53,,SING,O44,H44,no,N,53,,205150,4712,SCR
54,,SING,O6,S6,no,N,54,,205150,4712,SCR
55,,DOUB,O62,S6,no,N,55,,205150,4712,SCR
56,,DOUB,O63,S6,no,N,56,,205150,4712,SCR
57,,SING,O64,S6,no,N,57,,205150,4712,SCR
58,,SING,O64,H64,no,N,58,,205150,4712,SCR
59,,SING,O51,S14,no,N,59,,205150,4712,SCR
60,,DOUB,O52,S14,no,N,60,,205150,4712,SCR
61,,DOUB,O53,S14,no,N,61,,205150,4712,SCR
62,,SING,O54,S14,no,N,62,,205150,4712,SCR
63,,SING,O54,H54,no,N,63,,205150,4712,SCR
64,,SING,O71,S13,no,N,64,,205150,4712,SCR
65,,DOUB,O72,S13,no,N,65,,205150,4712,SCR
66,,DOUB,O73,S13,no,N,66,,205150,4712,SCR
67,,SING,O74,S13,no,N,67,,205150,4712,SCR
68,,SING,O74,H74,no,N,68,,205150,4712,SCR
69,,SING,O81,S11,no,N,69,,205150,4712,SCR
70,,DOUB,O82,S11,no,N,70,,205150,4712,SCR
71,,DOUB,O83,S11,no,N,71,,205150,4712,SCR
72,,SING,O84,S11,no,N,72,,205150,4712,SCR
73,,SING,O84,H84,no,N,73,,205150,4712,SCR
74,,SING,O91,S12,no,N,74,,205150,4712,SCR
75,,DOUB,O92,S12,no,N,75,,205150,4712,SCR
76,,DOUB,O93,S12,no,N,76,,205150,4712,SCR
77,,SING,O94,S12,no,N,77,,205150,4712,SCR
78,,SING,O94,H94,no,N,78,,205150,4712,SCR
1,,SING,N,HN1,no,N,1,,205303,472,NH2
2,,SING,N,HN2,no,N,2,,205303,472,NH2
1,,SING,O12,C8,no,N,1,,205355,4722,SKM
2,,SING,O12,H12,no,N,2,,205355,4722,SKM
3,,SING,C8,C6,no,N,3,,205355,4722,SKM
4,,SING,C8,C9,no,N,4,,205355,4722,SKM
5,,SING,C8,H8,no,N,5,,205355,4722,SKM
6,,SING,C6,O7,no,N,6,,205355,4722,SKM
7,,SING,C6,C5,no,N,7,,205355,4722,SKM
8,,SING,C6,H6,no,N,8,,205355,4722,SKM
9,,SING,O7,HO7,no,N,9,,205355,4722,SKM
10,,SING,C5,C4,no,N,10,,205355,4722,SKM
11,,SING,C5,H51,no,N,11,,205355,4722,SKM
12,,SING,C5,H52,no,N,12,,205355,4722,SKM
13,,SING,C4,C1,no,N,13,,205355,4722,SKM
14,,DOUB,C4,C10,no,N,14,,205355,4722,SKM
15,,SING,C1,O2,no,N,15,,205355,4722,SKM
16,,DOUB,C1,O3,no,N,16,,205355,4722,SKM
17,,SING,O2,HO2,no,N,17,,205355,4722,SKM
18,,SING,C10,C9,no,N,18,,205355,4722,SKM
19,,SING,C10,H10,no,N,19,,205355,4722,SKM
20,,SING,C9,O11,no,N,20,,205355,4722,SKM
21,,SING,C9,H9,no,N,21,,205355,4722,SKM
22,,SING,O11,H11,no,N,22,,205355,4722,SKM
1,,SING,N,HN1,no,N,1,,205530,473,NH2
2,,SING,N,HN2,no,N,2,,205530,473,NH2
1,,SING,N,HN1,no,N,1,,205739,474,NH2
2,,SING,N,HN2,no,N,2,,205739,474,NH2
1,,SING,FE,NA,no,N,1,,205845,4743,HEC
2,,SING,FE,NB,no,N,2,,205845,4743,HEC
3,,SING,FE,NC,no,N,3,,205845,4743,HEC
4,,SING,FE,ND,no,N,4,,205845,4743,HEC
5,,DOUB,CHA,C1A,no,N,5,,205845,4743,HEC
6,,SING,CHA,C4D,no,N,6,,205845,4743,HEC
7,,SING,CHA,HHA,no,N,7,,205845,4743,HEC
8,,DOUB,CHB,C4A,no,N,8,,205845,4743,HEC
9,,SING,CHB,C1B,no,N,9,,205845,4743,HEC
10,,SING,CHB,HHB,no,N,10,,205845,4743,HEC
11,,DOUB,CHC,C4B,no,N,11,,205845,4743,HEC
12,,SING,CHC,C1C,no,N,12,,205845,4743,HEC
13,,SING,CHC,HHC,no,N,13,,205845,4743,HEC
14,,DOUB,CHD,C4C,no,N,14,,205845,4743,HEC
15,,SING,CHD,C1D,no,N,15,,205845,4743,HEC
16,,SING,CHD,HHD,no,N,16,,205845,4743,HEC
17,,SING,NA,C1A,yes,N,17,,205845,4743,HEC
18,,SING,NA,C4A,yes,N,18,,205845,4743,HEC
19,,SING,C1A,C2A,yes,N,19,,205845,4743,HEC
20,,DOUB,C2A,C3A,yes,N,20,,205845,4743,HEC
21,,SING,C2A,CAA,no,N,21,,205845,4743,HEC
22,,SING,C3A,C4A,yes,N,22,,205845,4743,HEC
23,,SING,C3A,CMA,no,N,23,,205845,4743,HEC
24,,SING,CMA,HMA1,no,N,24,,205845,4743,HEC
25,,SING,CMA,HMA2,no,N,25,,205845,4743,HEC
26,,SING,CMA,HMA3,no,N,26,,205845,4743,HEC
27,,SING,CAA,CBA,no,N,27,,205845,4743,HEC
28,,SING,CAA,HAA1,no,N,28,,205845,4743,HEC
29,,SING,CAA,HAA2,no,N,29,,205845,4743,HEC
30,,SING,CBA,CGA,no,N,30,,205845,4743,HEC
31,,SING,CBA,HBA1,no,N,31,,205845,4743,HEC
32,,SING,CBA,HBA2,no,N,32,,205845,4743,HEC
33,,DOUB,CGA,O1A,no,N,33,,205845,4743,HEC
34,,SING,CGA,O2A,no,N,34,,205845,4743,HEC
35,,SING,O2A,H2A,no,N,35,,205845,4743,HEC
36,,SING,NB,C1B,yes,N,36,,205845,4743,HEC
37,,SING,NB,C4B,yes,N,37,,205845,4743,HEC
38,,DOUB,C1B,C2B,yes,N,38,,205845,4743,HEC
39,,SING,C2B,C3B,yes,N,39,,205845,4743,HEC
40,,SING,C2B,CMB,no,N,40,,205845,4743,HEC
41,,SING,C3B,C4B,yes,N,41,,205845,4743,HEC
42,,DOUB,C3B,CAB,no,E,42,,205845,4743,HEC
43,,SING,CMB,HMB1,no,N,43,,205845,4743,HEC
44,,SING,CMB,HMB2,no,N,44,,205845,4743,HEC
45,,SING,CMB,HMB3,no,N,45,,205845,4743,HEC
46,,SING,CAB,CBB,no,N,46,,205845,4743,HEC
47,,SING,CAB,HAB,no,N,47,,205845,4743,HEC
48,,SING,CBB,HBB1,no,N,48,,205845,4743,HEC
49,,SING,CBB,HBB2,no,N,49,,205845,4743,HEC
50,,SING,CBB,HBB3,no,N,50,,205845,4743,HEC
51,,SING,NC,C1C,yes,N,51,,205845,4743,HEC
52,,SING,NC,C4C,yes,N,52,,205845,4743,HEC
53,,DOUB,C1C,C2C,yes,N,53,,205845,4743,HEC
54,,SING,C2C,C3C,yes,N,54,,205845,4743,HEC
55,,SING,C2C,CMC,no,N,55,,205845,4743,HEC
56,,SING,C3C,C4C,yes,N,56,,205845,4743,HEC
57,,DOUB,C3C,CAC,no,E,57,,205845,4743,HEC
58,,SING,CMC,HMC1,no,N,58,,205845,4743,HEC
59,,SING,CMC,HMC2,no,N,59,,205845,4743,HEC
60,,SING,CMC,HMC3,no,N,60,,205845,4743,HEC
61,,SING,CAC,CBC,no,N,61,,205845,4743,HEC
62,,SING,CAC,HAC,no,N,62,,205845,4743,HEC
63,,SING,CBC,HBC1,no,N,63,,205845,4743,HEC
64,,SING,CBC,HBC2,no,N,64,,205845,4743,HEC
65,,SING,CBC,HBC3,no,N,65,,205845,4743,HEC
66,,SING,ND,C1D,yes,N,66,,205845,4743,HEC
67,,SING,ND,C4D,yes,N,67,,205845,4743,HEC
68,,DOUB,C1D,C2D,yes,N,68,,205845,4743,HEC
69,,SING,C2D,C3D,yes,N,69,,205845,4743,HEC
70,,SING,C2D,CMD,no,N,70,,205845,4743,HEC
71,,DOUB,C3D,C4D,yes,N,71,,205845,4743,HEC
72,,SING,C3D,CAD,no,N,72,,205845,4743,HEC
73,,SING,CMD,HMD1,no,N,73,,205845,4743,HEC
74,,SING,CMD,HMD2,no,N,74,,205845,4743,HEC
75,,SING,CMD,HMD3,no,N,75,,205845,4743,HEC
76,,SING,CAD,CBD,no,N,76,,205845,4743,HEC
77,,SING,CAD,HAD1,no,N,77,,205845,4743,HEC
78,,SING,CAD,HAD2,no,N,78,,205845,4743,HEC
79,,SING,CBD,CGD,no,N,79,,205845,4743,HEC
80,,SING,CBD,HBD1,no,N,80,,205845,4743,HEC
81,,SING,CBD,HBD2,no,N,81,,205845,4743,HEC
82,,DOUB,CGD,O1D,no,N,82,,205845,4743,HEC
83,,SING,CGD,O2D,no,N,83,,205845,4743,HEC
84,,SING,O2D,H2D,no,N,84,,205845,4743,HEC
1,,SING,FE,NA,no,N,1,,205874,4744,HEC
2,,SING,FE,NB,no,N,2,,205874,4744,HEC
3,,SING,FE,NC,no,N,3,,205874,4744,HEC
4,,SING,FE,ND,no,N,4,,205874,4744,HEC
5,,DOUB,CHA,C1A,no,N,5,,205874,4744,HEC
6,,SING,CHA,C4D,no,N,6,,205874,4744,HEC
7,,SING,CHA,HHA,no,N,7,,205874,4744,HEC
8,,DOUB,CHB,C4A,no,N,8,,205874,4744,HEC
9,,SING,CHB,C1B,no,N,9,,205874,4744,HEC
10,,SING,CHB,HHB,no,N,10,,205874,4744,HEC
11,,DOUB,CHC,C4B,no,N,11,,205874,4744,HEC
12,,SING,CHC,C1C,no,N,12,,205874,4744,HEC
13,,SING,CHC,HHC,no,N,13,,205874,4744,HEC
14,,DOUB,CHD,C4C,no,N,14,,205874,4744,HEC
15,,SING,CHD,C1D,no,N,15,,205874,4744,HEC
16,,SING,CHD,HHD,no,N,16,,205874,4744,HEC
17,,SING,NA,C1A,yes,N,17,,205874,4744,HEC
18,,SING,NA,C4A,yes,N,18,,205874,4744,HEC
19,,SING,C1A,C2A,yes,N,19,,205874,4744,HEC
20,,DOUB,C2A,C3A,yes,N,20,,205874,4744,HEC
21,,SING,C2A,CAA,no,N,21,,205874,4744,HEC
22,,SING,C3A,C4A,yes,N,22,,205874,4744,HEC
23,,SING,C3A,CMA,no,N,23,,205874,4744,HEC
24,,SING,CMA,HMA1,no,N,24,,205874,4744,HEC
25,,SING,CMA,HMA2,no,N,25,,205874,4744,HEC
26,,SING,CMA,HMA3,no,N,26,,205874,4744,HEC
27,,SING,CAA,CBA,no,N,27,,205874,4744,HEC
28,,SING,CAA,HAA1,no,N,28,,205874,4744,HEC
29,,SING,CAA,HAA2,no,N,29,,205874,4744,HEC
30,,SING,CBA,CGA,no,N,30,,205874,4744,HEC
31,,SING,CBA,HBA1,no,N,31,,205874,4744,HEC
32,,SING,CBA,HBA2,no,N,32,,205874,4744,HEC
33,,DOUB,CGA,O1A,no,N,33,,205874,4744,HEC
34,,SING,CGA,O2A,no,N,34,,205874,4744,HEC
35,,SING,O2A,H2A,no,N,35,,205874,4744,HEC
36,,SING,NB,C1B,yes,N,36,,205874,4744,HEC
37,,SING,NB,C4B,yes,N,37,,205874,4744,HEC
38,,DOUB,C1B,C2B,yes,N,38,,205874,4744,HEC
39,,SING,C2B,C3B,yes,N,39,,205874,4744,HEC
40,,SING,C2B,CMB,no,N,40,,205874,4744,HEC
41,,SING,C3B,C4B,yes,N,41,,205874,4744,HEC
42,,DOUB,C3B,CAB,no,E,42,,205874,4744,HEC
43,,SING,CMB,HMB1,no,N,43,,205874,4744,HEC
44,,SING,CMB,HMB2,no,N,44,,205874,4744,HEC
45,,SING,CMB,HMB3,no,N,45,,205874,4744,HEC
46,,SING,CAB,CBB,no,N,46,,205874,4744,HEC
47,,SING,CAB,HAB,no,N,47,,205874,4744,HEC
48,,SING,CBB,HBB1,no,N,48,,205874,4744,HEC
49,,SING,CBB,HBB2,no,N,49,,205874,4744,HEC
50,,SING,CBB,HBB3,no,N,50,,205874,4744,HEC
51,,SING,NC,C1C,yes,N,51,,205874,4744,HEC
52,,SING,NC,C4C,yes,N,52,,205874,4744,HEC
53,,DOUB,C1C,C2C,yes,N,53,,205874,4744,HEC
54,,SING,C2C,C3C,yes,N,54,,205874,4744,HEC
55,,SING,C2C,CMC,no,N,55,,205874,4744,HEC
56,,SING,C3C,C4C,yes,N,56,,205874,4744,HEC
57,,DOUB,C3C,CAC,no,E,57,,205874,4744,HEC
58,,SING,CMC,HMC1,no,N,58,,205874,4744,HEC
59,,SING,CMC,HMC2,no,N,59,,205874,4744,HEC
60,,SING,CMC,HMC3,no,N,60,,205874,4744,HEC
61,,SING,CAC,CBC,no,N,61,,205874,4744,HEC
62,,SING,CAC,HAC,no,N,62,,205874,4744,HEC
63,,SING,CBC,HBC1,no,N,63,,205874,4744,HEC
64,,SING,CBC,HBC2,no,N,64,,205874,4744,HEC
65,,SING,CBC,HBC3,no,N,65,,205874,4744,HEC
66,,SING,ND,C1D,yes,N,66,,205874,4744,HEC
67,,SING,ND,C4D,yes,N,67,,205874,4744,HEC
68,,DOUB,C1D,C2D,yes,N,68,,205874,4744,HEC
69,,SING,C2D,C3D,yes,N,69,,205874,4744,HEC
70,,SING,C2D,CMD,no,N,70,,205874,4744,HEC
71,,DOUB,C3D,C4D,yes,N,71,,205874,4744,HEC
72,,SING,C3D,CAD,no,N,72,,205874,4744,HEC
73,,SING,CMD,HMD1,no,N,73,,205874,4744,HEC
74,,SING,CMD,HMD2,no,N,74,,205874,4744,HEC
75,,SING,CMD,HMD3,no,N,75,,205874,4744,HEC
76,,SING,CAD,CBD,no,N,76,,205874,4744,HEC
77,,SING,CAD,HAD1,no,N,77,,205874,4744,HEC
78,,SING,CAD,HAD2,no,N,78,,205874,4744,HEC
79,,SING,CBD,CGD,no,N,79,,205874,4744,HEC
80,,SING,CBD,HBD1,no,N,80,,205874,4744,HEC
81,,SING,CBD,HBD2,no,N,81,,205874,4744,HEC
82,,DOUB,CGD,O1D,no,N,82,,205874,4744,HEC
83,,SING,CGD,O2D,no,N,83,,205874,4744,HEC
84,,SING,O2D,H2D,no,N,84,,205874,4744,HEC
1,,SING,O1,C1,no,N,1,,205912,4746,1AR
2,,SING,O1,HO1,no,N,2,,205912,4746,1AR
3,,SING,C1,C2,no,N,3,,205912,4746,1AR
4,,SING,C1,O5,no,N,4,,205912,4746,1AR
5,,SING,C1,H1,no,N,5,,205912,4746,1AR
6,,SING,C2,C3,no,N,6,,205912,4746,1AR
7,,SING,C2,H21,no,N,7,,205912,4746,1AR
8,,SING,C2,H22,no,N,8,,205912,4746,1AR
9,,SING,C3,O3,no,N,9,,205912,4746,1AR
10,,SING,C3,CC3,no,N,10,,205912,4746,1AR
11,,SING,C3,C4,no,N,11,,205912,4746,1AR
12,,SING,O3,HO3,no,N,12,,205912,4746,1AR
13,,SING,CC3,HM31,no,N,13,,205912,4746,1AR
14,,SING,CC3,HM32,no,N,14,,205912,4746,1AR
15,,SING,CC3,HM33,no,N,15,,205912,4746,1AR
16,,SING,C4,O4,no,N,16,,205912,4746,1AR
17,,SING,C4,C5,no,N,17,,205912,4746,1AR
18,,SING,C4,H4,no,N,18,,205912,4746,1AR
19,,SING,O4,CO4,no,N,19,,205912,4746,1AR
20,,SING,CME,CO4,no,N,20,,205912,4746,1AR
21,,SING,CME,HM41,no,N,21,,205912,4746,1AR
22,,SING,CME,HM42,no,N,22,,205912,4746,1AR
23,,SING,CME,HM43,no,N,23,,205912,4746,1AR
24,,DOUB,CO4,OC4,no,N,24,,205912,4746,1AR
25,,SING,C5,O5,no,N,25,,205912,4746,1AR
26,,SING,C5,C6,no,N,26,,205912,4746,1AR
27,,SING,C5,H5,no,N,27,,205912,4746,1AR
28,,SING,C6,H61,no,N,28,,205912,4746,1AR
29,,SING,C6,H62,no,N,29,,205912,4746,1AR
30,,SING,C6,H63,no,N,30,,205912,4746,1AR
1,,SING,O1,C1,no,N,1,,205913,4746,1GL
2,,SING,O1,HO1,no,N,2,,205913,4746,1GL
3,,SING,C1,C2,no,N,3,,205913,4746,1GL
4,,SING,C1,O5,no,N,4,,205913,4746,1GL
5,,SING,C1,H1,no,N,5,,205913,4746,1GL
6,,SING,C2,C3,no,N,6,,205913,4746,1GL
7,,SING,C2,H21,no,N,7,,205913,4746,1GL
8,,SING,C2,H22,no,N,8,,205913,4746,1GL
9,,SING,C3,O3,no,N,9,,205913,4746,1GL
10,,SING,C3,C4,no,N,10,,205913,4746,1GL
11,,SING,C3,H3,no,N,11,,205913,4746,1GL
12,,SING,O3,HO3,no,N,12,,205913,4746,1GL
13,,SING,C4,O4,no,N,13,,205913,4746,1GL
14,,SING,C4,C5,no,N,14,,205913,4746,1GL
15,,SING,C4,H4,no,N,15,,205913,4746,1GL
16,,SING,O4,CME,no,N,16,,205913,4746,1GL
17,,SING,CME,HM41,no,N,17,,205913,4746,1GL
18,,SING,CME,HM42,no,N,18,,205913,4746,1GL
19,,SING,CME,HM43,no,N,19,,205913,4746,1GL
20,,SING,C5,O5,no,N,20,,205913,4746,1GL
21,,SING,C5,C6,no,N,21,,205913,4746,1GL
22,,SING,C5,H5,no,N,22,,205913,4746,1GL
23,,SING,C6,H61,no,N,23,,205913,4746,1GL
24,,SING,C6,H62,no,N,24,,205913,4746,1GL
25,,SING,C6,H63,no,N,25,,205913,4746,1GL
1,,SING,O1,C1,no,N,1,,205914,4746,2GL
2,,SING,O1,HO1,no,N,2,,205914,4746,2GL
3,,SING,C1,C2,no,N,3,,205914,4746,2GL
4,,SING,C1,O5,no,N,4,,205914,4746,2GL
5,,SING,C1,H1,no,N,5,,205914,4746,2GL
6,,SING,C2,C3,no,N,6,,205914,4746,2GL
7,,SING,C2,H21,no,N,7,,205914,4746,2GL
8,,SING,C2,H22,no,N,8,,205914,4746,2GL
9,,SING,C3,O3,no,N,9,,205914,4746,2GL
10,,SING,C3,C4,no,N,10,,205914,4746,2GL
11,,SING,C3,H3,no,N,11,,205914,4746,2GL
12,,SING,O3,HO3,no,N,12,,205914,4746,2GL
13,,SING,C4,O4,no,N,13,,205914,4746,2GL
14,,SING,C4,C5,no,N,14,,205914,4746,2GL
15,,SING,C4,H4,no,N,15,,205914,4746,2GL
16,,SING,O4,CO4,no,N,16,,205914,4746,2GL
17,,SING,CME,CO4,no,N,17,,205914,4746,2GL
18,,SING,CME,HM41,no,N,18,,205914,4746,2GL
19,,SING,CME,HM42,no,N,19,,205914,4746,2GL
20,,SING,CME,HM43,no,N,20,,205914,4746,2GL
21,,DOUB,CO4,OC4,no,N,21,,205914,4746,2GL
22,,SING,C5,O5,no,N,22,,205914,4746,2GL
23,,SING,C5,C6,no,N,23,,205914,4746,2GL
24,,SING,C5,H5,no,N,24,,205914,4746,2GL
25,,SING,C6,H61,no,N,25,,205914,4746,2GL
26,,SING,C6,H62,no,N,26,,205914,4746,2GL
27,,SING,C6,H63,no,N,27,,205914,4746,2GL
1,,SING,C1,C2,no,N,1,,205915,4746,DDA
2,,SING,C1,O5,no,N,2,,205915,4746,DDA
3,,SING,C1,O1,no,N,3,,205915,4746,DDA
4,,SING,C1,H1,no,N,4,,205915,4746,DDA
5,,SING,C2,C3,no,N,5,,205915,4746,DDA
6,,SING,C2,H21,no,N,6,,205915,4746,DDA
7,,SING,C2,H22,no,N,7,,205915,4746,DDA
8,,SING,C3,C4,no,N,8,,205915,4746,DDA
9,,SING,C3,O3,no,N,9,,205915,4746,DDA
10,,SING,C3,H3,no,N,10,,205915,4746,DDA
11,,SING,C4,C5,no,N,11,,205915,4746,DDA
12,,SING,C4,O4,no,N,12,,205915,4746,DDA
13,,SING,C4,H4,no,N,13,,205915,4746,DDA
14,,SING,C5,C6,no,N,14,,205915,4746,DDA
15,,SING,C5,O5,no,N,15,,205915,4746,DDA
16,,SING,C5,H5,no,N,16,,205915,4746,DDA
17,,SING,C6,H61,no,N,17,,205915,4746,DDA
18,,SING,C6,H62,no,N,18,,205915,4746,DDA
19,,SING,C6,H63,no,N,19,,205915,4746,DDA
20,,SING,O1,HO1,no,N,20,,205915,4746,DDA
21,,SING,O3,HO3,no,N,21,,205915,4746,DDA
22,,SING,O4,HO4,no,N,22,,205915,4746,DDA
1,,DOUB,C1,O1,no,N,1,,205916,4746,DXB
2,,SING,C1,C9A,no,N,2,,205916,4746,DXB
3,,SING,C1,C2,no,N,3,,205916,4746,DXB
4,,DOUB,C9A,C4A,yes,N,4,,205916,4746,DXB
5,,SING,C9A,C9,yes,N,5,,205916,4746,DXB
6,,SING,C2,C3,no,N,6,,205916,4746,DXB
7,,SING,C2,H21,no,N,7,,205916,4746,DXB
8,,SING,C2,H22,no,N,8,,205916,4746,DXB
9,,SING,C3,C4,no,N,9,,205916,4746,DXB
10,,SING,C3,C1S,no,N,10,,205916,4746,DXB
11,,SING,C3,H3,no,N,11,,205916,4746,DXB
12,,SING,C4,C4A,no,N,12,,205916,4746,DXB
13,,SING,C4,H4A,no,N,13,,205916,4746,DXB
14,,SING,C4,H4E,no,N,14,,205916,4746,DXB
15,,SING,C4A,C10,yes,N,15,,205916,4746,DXB
16,,DOUB,C10,C5A,yes,N,16,,205916,4746,DXB
17,,SING,C10,H10,no,N,17,,205916,4746,DXB
18,,SING,C5A,C5,yes,N,18,,205916,4746,DXB
19,,SING,C5A,C8A,yes,N,19,,205916,4746,DXB
20,,DOUB,C5,C6,yes,N,20,,205916,4746,DXB
21,,SING,C5,H5,no,N,21,,205916,4746,DXB
22,,SING,C6,C7,yes,N,22,,205916,4746,DXB
23,,SING,C6,H6,no,N,23,,205916,4746,DXB
24,,SING,C7,CC7,no,N,24,,205916,4746,DXB
25,,DOUB,C7,C8,yes,N,25,,205916,4746,DXB
26,,SING,CC7,HM71,no,N,26,,205916,4746,DXB
27,,SING,CC7,HM72,no,N,27,,205916,4746,DXB
28,,SING,CC7,HM73,no,N,28,,205916,4746,DXB
29,,SING,C8,O8,no,N,29,,205916,4746,DXB
30,,SING,C8,C8A,yes,N,30,,205916,4746,DXB
31,,SING,O8,HO8,no,N,31,,205916,4746,DXB
32,,DOUB,C8A,C9,yes,N,32,,205916,4746,DXB
33,,SING,C9,O9,no,N,33,,205916,4746,DXB
34,,SING,O9,HO9,no,N,34,,205916,4746,DXB
35,,SING,CME,O1S,no,N,35,,205916,4746,DXB
36,,SING,CME,HM11,no,N,36,,205916,4746,DXB
37,,SING,CME,HM12,no,N,37,,205916,4746,DXB
38,,SING,CME,HM13,no,N,38,,205916,4746,DXB
39,,SING,C1S,O1S,no,N,39,,205916,4746,DXB
40,,SING,C1S,C2S,no,N,40,,205916,4746,DXB
41,,SING,C1S,HS1,no,N,41,,205916,4746,DXB
42,,DOUB,C2S,O2S,no,N,42,,205916,4746,DXB
43,,SING,C2S,C3S,no,N,43,,205916,4746,DXB
44,,SING,C3S,O3S,no,N,44,,205916,4746,DXB
45,,SING,C3S,C4S,no,N,45,,205916,4746,DXB
46,,SING,C3S,HS3,no,N,46,,205916,4746,DXB
47,,SING,O3S,HO3,no,N,47,,205916,4746,DXB
48,,SING,C4S,O4S,no,N,48,,205916,4746,DXB
49,,SING,C4S,C5S,no,N,49,,205916,4746,DXB
50,,SING,C4S,HS4,no,N,50,,205916,4746,DXB
51,,SING,O4S,HO4,no,N,51,,205916,4746,DXB
52,,SING,C5S,HM51,no,N,52,,205916,4746,DXB
53,,SING,C5S,HM52,no,N,53,,205916,4746,DXB
54,,SING,C5S,HM53,no,N,54,,205916,4746,DXB
1,,DOUB,C,O,no,N,1,,205959,4747,ACE
2,,SING,C,CH3,no,N,2,,205959,4747,ACE
3,,SING,C,H,no,N,3,,205959,4747,ACE
4,,SING,CH3,H1,no,N,4,,205959,4747,ACE
5,,SING,CH3,H2,no,N,5,,205959,4747,ACE
6,,SING,CH3,H3,no,N,6,,205959,4747,ACE
1,,SING,N,HN1,no,N,1,,205960,4747,NH2
2,,SING,N,HN2,no,N,2,,205960,4747,NH2
1,,SING,N,HN1,no,N,1,,206048,475,NH2
2,,SING,N,HN2,no,N,2,,206048,475,NH2
1,,SING,O1,C1,no,N,1,,206135,4753,1AR
2,,SING,O1,HO1,no,N,2,,206135,4753,1AR
3,,SING,C1,C2,no,N,3,,206135,4753,1AR
4,,SING,C1,O5,no,N,4,,206135,4753,1AR
5,,SING,C1,H1,no,N,5,,206135,4753,1AR
6,,SING,C2,C3,no,N,6,,206135,4753,1AR
7,,SING,C2,H21,no,N,7,,206135,4753,1AR
8,,SING,C2,H22,no,N,8,,206135,4753,1AR
9,,SING,C3,O3,no,N,9,,206135,4753,1AR
10,,SING,C3,CC3,no,N,10,,206135,4753,1AR
11,,SING,C3,C4,no,N,11,,206135,4753,1AR
12,,SING,O3,HO3,no,N,12,,206135,4753,1AR
13,,SING,CC3,HM31,no,N,13,,206135,4753,1AR
14,,SING,CC3,HM32,no,N,14,,206135,4753,1AR
15,,SING,CC3,HM33,no,N,15,,206135,4753,1AR
16,,SING,C4,O4,no,N,16,,206135,4753,1AR
17,,SING,C4,C5,no,N,17,,206135,4753,1AR
18,,SING,C4,H4,no,N,18,,206135,4753,1AR
19,,SING,O4,CO4,no,N,19,,206135,4753,1AR
20,,SING,CME,CO4,no,N,20,,206135,4753,1AR
21,,SING,CME,HM41,no,N,21,,206135,4753,1AR
22,,SING,CME,HM42,no,N,22,,206135,4753,1AR
23,,SING,CME,HM43,no,N,23,,206135,4753,1AR
24,,DOUB,CO4,OC4,no,N,24,,206135,4753,1AR
25,,SING,C5,O5,no,N,25,,206135,4753,1AR
26,,SING,C5,C6,no,N,26,,206135,4753,1AR
27,,SING,C5,H5,no,N,27,,206135,4753,1AR
28,,SING,C6,H61,no,N,28,,206135,4753,1AR
29,,SING,C6,H62,no,N,29,,206135,4753,1AR
30,,SING,C6,H63,no,N,30,,206135,4753,1AR
1,,SING,O1,C1,no,N,1,,206136,4753,1GL
2,,SING,O1,HO1,no,N,2,,206136,4753,1GL
3,,SING,C1,C2,no,N,3,,206136,4753,1GL
4,,SING,C1,O5,no,N,4,,206136,4753,1GL
5,,SING,C1,H1,no,N,5,,206136,4753,1GL
6,,SING,C2,C3,no,N,6,,206136,4753,1GL
7,,SING,C2,H21,no,N,7,,206136,4753,1GL
8,,SING,C2,H22,no,N,8,,206136,4753,1GL
9,,SING,C3,O3,no,N,9,,206136,4753,1GL
10,,SING,C3,C4,no,N,10,,206136,4753,1GL
11,,SING,C3,H3,no,N,11,,206136,4753,1GL
12,,SING,O3,HO3,no,N,12,,206136,4753,1GL
13,,SING,C4,O4,no,N,13,,206136,4753,1GL
14,,SING,C4,C5,no,N,14,,206136,4753,1GL
15,,SING,C4,H4,no,N,15,,206136,4753,1GL
16,,SING,O4,CME,no,N,16,,206136,4753,1GL
17,,SING,CME,HM41,no,N,17,,206136,4753,1GL
18,,SING,CME,HM42,no,N,18,,206136,4753,1GL
19,,SING,CME,HM43,no,N,19,,206136,4753,1GL
20,,SING,C5,O5,no,N,20,,206136,4753,1GL
21,,SING,C5,C6,no,N,21,,206136,4753,1GL
22,,SING,C5,H5,no,N,22,,206136,4753,1GL
23,,SING,C6,H61,no,N,23,,206136,4753,1GL
24,,SING,C6,H62,no,N,24,,206136,4753,1GL
25,,SING,C6,H63,no,N,25,,206136,4753,1GL
1,,SING,O1,C1,no,N,1,,206137,4753,2GL
2,,SING,O1,HO1,no,N,2,,206137,4753,2GL
3,,SING,C1,C2,no,N,3,,206137,4753,2GL
4,,SING,C1,O5,no,N,4,,206137,4753,2GL
5,,SING,C1,H1,no,N,5,,206137,4753,2GL
6,,SING,C2,C3,no,N,6,,206137,4753,2GL
7,,SING,C2,H21,no,N,7,,206137,4753,2GL
8,,SING,C2,H22,no,N,8,,206137,4753,2GL
9,,SING,C3,O3,no,N,9,,206137,4753,2GL
10,,SING,C3,C4,no,N,10,,206137,4753,2GL
11,,SING,C3,H3,no,N,11,,206137,4753,2GL
12,,SING,O3,HO3,no,N,12,,206137,4753,2GL
13,,SING,C4,O4,no,N,13,,206137,4753,2GL
14,,SING,C4,C5,no,N,14,,206137,4753,2GL
15,,SING,C4,H4,no,N,15,,206137,4753,2GL
16,,SING,O4,CO4,no,N,16,,206137,4753,2GL
17,,SING,CME,CO4,no,N,17,,206137,4753,2GL
18,,SING,CME,HM41,no,N,18,,206137,4753,2GL
19,,SING,CME,HM42,no,N,19,,206137,4753,2GL
20,,SING,CME,HM43,no,N,20,,206137,4753,2GL
21,,DOUB,CO4,OC4,no,N,21,,206137,4753,2GL
22,,SING,C5,O5,no,N,22,,206137,4753,2GL
23,,SING,C5,C6,no,N,23,,206137,4753,2GL
24,,SING,C5,H5,no,N,24,,206137,4753,2GL
25,,SING,C6,H61,no,N,25,,206137,4753,2GL
26,,SING,C6,H62,no,N,26,,206137,4753,2GL
27,,SING,C6,H63,no,N,27,,206137,4753,2GL
1,,SING,C1,C2,no,N,1,,206138,4753,DDA
2,,SING,C1,O5,no,N,2,,206138,4753,DDA
3,,SING,C1,O1,no,N,3,,206138,4753,DDA
4,,SING,C1,H1,no,N,4,,206138,4753,DDA
5,,SING,C2,C3,no,N,5,,206138,4753,DDA
6,,SING,C2,H21,no,N,6,,206138,4753,DDA
7,,SING,C2,H22,no,N,7,,206138,4753,DDA
8,,SING,C3,C4,no,N,8,,206138,4753,DDA
9,,SING,C3,O3,no,N,9,,206138,4753,DDA
10,,SING,C3,H3,no,N,10,,206138,4753,DDA
11,,SING,C4,C5,no,N,11,,206138,4753,DDA
12,,SING,C4,O4,no,N,12,,206138,4753,DDA
13,,SING,C4,H4,no,N,13,,206138,4753,DDA
14,,SING,C5,C6,no,N,14,,206138,4753,DDA
15,,SING,C5,O5,no,N,15,,206138,4753,DDA
16,,SING,C5,H5,no,N,16,,206138,4753,DDA
17,,SING,C6,H61,no,N,17,,206138,4753,DDA
18,,SING,C6,H62,no,N,18,,206138,4753,DDA
19,,SING,C6,H63,no,N,19,,206138,4753,DDA
20,,SING,O1,HO1,no,N,20,,206138,4753,DDA
21,,SING,O3,HO3,no,N,21,,206138,4753,DDA
22,,SING,O4,HO4,no,N,22,,206138,4753,DDA
1,,DOUB,C1,O1,no,N,1,,206139,4753,DXB
2,,SING,C1,C9A,no,N,2,,206139,4753,DXB
3,,SING,C1,C2,no,N,3,,206139,4753,DXB
4,,DOUB,C9A,C4A,yes,N,4,,206139,4753,DXB
5,,SING,C9A,C9,yes,N,5,,206139,4753,DXB
6,,SING,C2,C3,no,N,6,,206139,4753,DXB
7,,SING,C2,H21,no,N,7,,206139,4753,DXB
8,,SING,C2,H22,no,N,8,,206139,4753,DXB
9,,SING,C3,C4,no,N,9,,206139,4753,DXB
10,,SING,C3,C1S,no,N,10,,206139,4753,DXB
11,,SING,C3,H3,no,N,11,,206139,4753,DXB
12,,SING,C4,C4A,no,N,12,,206139,4753,DXB
13,,SING,C4,H4A,no,N,13,,206139,4753,DXB
14,,SING,C4,H4E,no,N,14,,206139,4753,DXB
15,,SING,C4A,C10,yes,N,15,,206139,4753,DXB
16,,DOUB,C10,C5A,yes,N,16,,206139,4753,DXB
17,,SING,C10,H10,no,N,17,,206139,4753,DXB
18,,SING,C5A,C5,yes,N,18,,206139,4753,DXB
19,,SING,C5A,C8A,yes,N,19,,206139,4753,DXB
20,,DOUB,C5,C6,yes,N,20,,206139,4753,DXB
21,,SING,C5,H5,no,N,21,,206139,4753,DXB
22,,SING,C6,C7,yes,N,22,,206139,4753,DXB
23,,SING,C6,H6,no,N,23,,206139,4753,DXB
24,,SING,C7,CC7,no,N,24,,206139,4753,DXB
25,,DOUB,C7,C8,yes,N,25,,206139,4753,DXB
26,,SING,CC7,HM71,no,N,26,,206139,4753,DXB
27,,SING,CC7,HM72,no,N,27,,206139,4753,DXB
28,,SING,CC7,HM73,no,N,28,,206139,4753,DXB
29,,SING,C8,O8,no,N,29,,206139,4753,DXB
30,,SING,C8,C8A,yes,N,30,,206139,4753,DXB
31,,SING,O8,HO8,no,N,31,,206139,4753,DXB
32,,DOUB,C8A,C9,yes,N,32,,206139,4753,DXB
33,,SING,C9,O9,no,N,33,,206139,4753,DXB
34,,SING,O9,HO9,no,N,34,,206139,4753,DXB
35,,SING,CME,O1S,no,N,35,,206139,4753,DXB
36,,SING,CME,HM11,no,N,36,,206139,4753,DXB
37,,SING,CME,HM12,no,N,37,,206139,4753,DXB
38,,SING,CME,HM13,no,N,38,,206139,4753,DXB
39,,SING,C1S,O1S,no,N,39,,206139,4753,DXB
40,,SING,C1S,C2S,no,N,40,,206139,4753,DXB
41,,SING,C1S,HS1,no,N,41,,206139,4753,DXB
42,,DOUB,C2S,O2S,no,N,42,,206139,4753,DXB
43,,SING,C2S,C3S,no,N,43,,206139,4753,DXB
44,,SING,C3S,O3S,no,N,44,,206139,4753,DXB
45,,SING,C3S,C4S,no,N,45,,206139,4753,DXB
46,,SING,C3S,HS3,no,N,46,,206139,4753,DXB
47,,SING,O3S,HO3,no,N,47,,206139,4753,DXB
48,,SING,C4S,O4S,no,N,48,,206139,4753,DXB
49,,SING,C4S,C5S,no,N,49,,206139,4753,DXB
50,,SING,C4S,HS4,no,N,50,,206139,4753,DXB
51,,SING,O4S,HO4,no,N,51,,206139,4753,DXB
52,,SING,C5S,HM51,no,N,52,,206139,4753,DXB
53,,SING,C5S,HM52,no,N,53,,206139,4753,DXB
54,,SING,C5S,HM53,no,N,54,,206139,4753,DXB
1,,SING,CHA,C1A,yes,N,1,,206245,4759,HEM
2,,DOUB,CHA,C4D,yes,N,2,,206245,4759,HEM
3,,SING,CHA,HHA,no,N,3,,206245,4759,HEM
4,,SING,CHB,C4A,yes,N,4,,206245,4759,HEM
5,,DOUB,CHB,C1B,yes,N,5,,206245,4759,HEM
6,,SING,CHB,HHB,no,N,6,,206245,4759,HEM
7,,SING,CHC,C4B,yes,N,7,,206245,4759,HEM
8,,DOUB,CHC,C1C,yes,N,8,,206245,4759,HEM
9,,SING,CHC,HHC,no,N,9,,206245,4759,HEM
10,,DOUB,CHD,C4C,yes,N,10,,206245,4759,HEM
11,,SING,CHD,C1D,yes,N,11,,206245,4759,HEM
12,,SING,CHD,HHD,no,N,12,,206245,4759,HEM
13,,DOUB,C1A,C2A,yes,N,13,,206245,4759,HEM
14,,SING,C1A,NA,yes,N,14,,206245,4759,HEM
15,,SING,C2A,C3A,yes,N,15,,206245,4759,HEM
16,,SING,C2A,CAA,no,N,16,,206245,4759,HEM
17,,DOUB,C3A,C4A,yes,N,17,,206245,4759,HEM
18,,SING,C3A,CMA,no,N,18,,206245,4759,HEM
19,,SING,C4A,NA,yes,N,19,,206245,4759,HEM
20,,SING,CMA,HMA,no,N,20,,206245,4759,HEM
21,,SING,CMA,HMAA,no,N,21,,206245,4759,HEM
22,,SING,CMA,HMAB,no,N,22,,206245,4759,HEM
23,,SING,CAA,CBA,no,N,23,,206245,4759,HEM
24,,SING,CAA,HAA,no,N,24,,206245,4759,HEM
25,,SING,CAA,HAAA,no,N,25,,206245,4759,HEM
26,,SING,CBA,CGA,no,N,26,,206245,4759,HEM
27,,SING,CBA,HBA,no,N,27,,206245,4759,HEM
28,,SING,CBA,HBAA,no,N,28,,206245,4759,HEM
29,,DOUB,CGA,O1A,no,N,29,,206245,4759,HEM
30,,SING,CGA,O2A,no,N,30,,206245,4759,HEM
31,,SING,C1B,C2B,no,N,31,,206245,4759,HEM
32,,SING,C1B,NB,yes,N,32,,206245,4759,HEM
33,,DOUB,C2B,C3B,yes,N,33,,206245,4759,HEM
34,,SING,C2B,CMB,yes,N,34,,206245,4759,HEM
35,,SING,C3B,C4B,no,N,35,,206245,4759,HEM
36,,SING,C3B,CAB,yes,N,36,,206245,4759,HEM
37,,DOUB,C4B,NB,no,N,37,,206245,4759,HEM
38,,SING,CMB,HMB,yes,N,38,,206245,4759,HEM
39,,SING,CMB,HMBA,no,N,39,,206245,4759,HEM
40,,SING,CMB,HMBB,no,N,40,,206245,4759,HEM
41,,DOUB,CAB,CBB,no,N,41,,206245,4759,HEM
42,,SING,CAB,HAB,no,N,42,,206245,4759,HEM
43,,SING,CBB,HBB,no,N,43,,206245,4759,HEM
44,,SING,CBB,HBBA,no,N,44,,206245,4759,HEM
45,,SING,C1C,C2C,no,N,45,,206245,4759,HEM
46,,SING,C1C,NC,yes,N,46,,206245,4759,HEM
47,,DOUB,C2C,C3C,yes,N,47,,206245,4759,HEM
48,,SING,C2C,CMC,yes,N,48,,206245,4759,HEM
49,,SING,C3C,C4C,no,N,49,,206245,4759,HEM
50,,SING,C3C,CAC,yes,N,50,,206245,4759,HEM
51,,SING,C4C,NC,no,N,51,,206245,4759,HEM
52,,SING,CMC,HMC,yes,N,52,,206245,4759,HEM
53,,SING,CMC,HMCA,no,N,53,,206245,4759,HEM
54,,SING,CMC,HMCB,no,N,54,,206245,4759,HEM
55,,DOUB,CAC,CBC,no,N,55,,206245,4759,HEM
56,,SING,CAC,HAC,no,N,56,,206245,4759,HEM
57,,SING,CBC,HBC,no,N,57,,206245,4759,HEM
58,,SING,CBC,HBCA,no,N,58,,206245,4759,HEM
59,,SING,C1D,C2D,no,N,59,,206245,4759,HEM
60,,DOUB,C1D,ND,yes,N,60,,206245,4759,HEM
61,,DOUB,C2D,C3D,yes,N,61,,206245,4759,HEM
62,,SING,C2D,CMD,yes,N,62,,206245,4759,HEM
63,,SING,C3D,C4D,no,N,63,,206245,4759,HEM
64,,SING,C3D,CAD,yes,N,64,,206245,4759,HEM
65,,SING,C4D,ND,no,N,65,,206245,4759,HEM
66,,SING,CMD,HMD,yes,N,66,,206245,4759,HEM
67,,SING,CMD,HMDA,no,N,67,,206245,4759,HEM
68,,SING,CMD,HMDB,no,N,68,,206245,4759,HEM
69,,SING,CAD,CBD,no,N,69,,206245,4759,HEM
70,,SING,CAD,HAD,no,N,70,,206245,4759,HEM
71,,SING,CAD,HADA,no,N,71,,206245,4759,HEM
72,,SING,CBD,CGD,no,N,72,,206245,4759,HEM
73,,SING,CBD,HBD,no,N,73,,206245,4759,HEM
74,,SING,CBD,HBDA,no,N,74,,206245,4759,HEM
75,,DOUB,CGD,O1D,no,N,75,,206245,4759,HEM
76,,SING,CGD,O2D,no,N,76,,206245,4759,HEM
77,,SING,O2A,H2A,no,N,77,,206245,4759,HEM
78,,SING,O2D,H2D,no,N,78,,206245,4759,HEM
79,,SING,FE,NA,no,N,79,,206245,4759,HEM
80,,SING,FE,NB,no,N,80,,206245,4759,HEM
81,,SING,FE,NC,no,N,81,,206245,4759,HEM
82,,SING,FE,ND,no,N,82,,206245,4759,HEM
1,,SING,FE,NA,no,N,1,,206300,4761,HEC
2,,SING,FE,NB,no,N,2,,206300,4761,HEC
3,,SING,FE,NC,no,N,3,,206300,4761,HEC
4,,SING,FE,ND,no,N,4,,206300,4761,HEC
5,,DOUB,CHA,C1A,no,N,5,,206300,4761,HEC
6,,SING,CHA,C4D,no,N,6,,206300,4761,HEC
7,,SING,CHA,HHA,no,N,7,,206300,4761,HEC
8,,DOUB,CHB,C4A,no,N,8,,206300,4761,HEC
9,,SING,CHB,C1B,no,N,9,,206300,4761,HEC
10,,SING,CHB,HHB,no,N,10,,206300,4761,HEC
11,,DOUB,CHC,C4B,no,N,11,,206300,4761,HEC
12,,SING,CHC,C1C,no,N,12,,206300,4761,HEC
13,,SING,CHC,HHC,no,N,13,,206300,4761,HEC
14,,DOUB,CHD,C4C,no,N,14,,206300,4761,HEC
15,,SING,CHD,C1D,no,N,15,,206300,4761,HEC
16,,SING,CHD,HHD,no,N,16,,206300,4761,HEC
17,,SING,NA,C1A,yes,N,17,,206300,4761,HEC
18,,SING,NA,C4A,yes,N,18,,206300,4761,HEC
19,,SING,C1A,C2A,yes,N,19,,206300,4761,HEC
20,,DOUB,C2A,C3A,yes,N,20,,206300,4761,HEC
21,,SING,C2A,CAA,no,N,21,,206300,4761,HEC
22,,SING,C3A,C4A,yes,N,22,,206300,4761,HEC
23,,SING,C3A,CMA,no,N,23,,206300,4761,HEC
24,,SING,CMA,HMA1,no,N,24,,206300,4761,HEC
25,,SING,CMA,HMA2,no,N,25,,206300,4761,HEC
26,,SING,CMA,HMA3,no,N,26,,206300,4761,HEC
27,,SING,CAA,CBA,no,N,27,,206300,4761,HEC
28,,SING,CAA,HAA1,no,N,28,,206300,4761,HEC
29,,SING,CAA,HAA2,no,N,29,,206300,4761,HEC
30,,SING,CBA,CGA,no,N,30,,206300,4761,HEC
31,,SING,CBA,HBA1,no,N,31,,206300,4761,HEC
32,,SING,CBA,HBA2,no,N,32,,206300,4761,HEC
33,,DOUB,CGA,O1A,no,N,33,,206300,4761,HEC
34,,SING,CGA,O2A,no,N,34,,206300,4761,HEC
35,,SING,O2A,H2A,no,N,35,,206300,4761,HEC
36,,SING,NB,C1B,yes,N,36,,206300,4761,HEC
37,,SING,NB,C4B,yes,N,37,,206300,4761,HEC
38,,DOUB,C1B,C2B,yes,N,38,,206300,4761,HEC
39,,SING,C2B,C3B,yes,N,39,,206300,4761,HEC
40,,SING,C2B,CMB,no,N,40,,206300,4761,HEC
41,,SING,C3B,C4B,yes,N,41,,206300,4761,HEC
42,,DOUB,C3B,CAB,no,E,42,,206300,4761,HEC
43,,SING,CMB,HMB1,no,N,43,,206300,4761,HEC
44,,SING,CMB,HMB2,no,N,44,,206300,4761,HEC
45,,SING,CMB,HMB3,no,N,45,,206300,4761,HEC
46,,SING,CAB,CBB,no,N,46,,206300,4761,HEC
47,,SING,CAB,HAB,no,N,47,,206300,4761,HEC
48,,SING,CBB,HBB1,no,N,48,,206300,4761,HEC
49,,SING,CBB,HBB2,no,N,49,,206300,4761,HEC
50,,SING,CBB,HBB3,no,N,50,,206300,4761,HEC
51,,SING,NC,C1C,yes,N,51,,206300,4761,HEC
52,,SING,NC,C4C,yes,N,52,,206300,4761,HEC
53,,DOUB,C1C,C2C,yes,N,53,,206300,4761,HEC
54,,SING,C2C,C3C,yes,N,54,,206300,4761,HEC
55,,SING,C2C,CMC,no,N,55,,206300,4761,HEC
56,,SING,C3C,C4C,yes,N,56,,206300,4761,HEC
57,,DOUB,C3C,CAC,no,E,57,,206300,4761,HEC
58,,SING,CMC,HMC1,no,N,58,,206300,4761,HEC
59,,SING,CMC,HMC2,no,N,59,,206300,4761,HEC
60,,SING,CMC,HMC3,no,N,60,,206300,4761,HEC
61,,SING,CAC,CBC,no,N,61,,206300,4761,HEC
62,,SING,CAC,HAC,no,N,62,,206300,4761,HEC
63,,SING,CBC,HBC1,no,N,63,,206300,4761,HEC
64,,SING,CBC,HBC2,no,N,64,,206300,4761,HEC
65,,SING,CBC,HBC3,no,N,65,,206300,4761,HEC
66,,SING,ND,C1D,yes,N,66,,206300,4761,HEC
67,,SING,ND,C4D,yes,N,67,,206300,4761,HEC
68,,DOUB,C1D,C2D,yes,N,68,,206300,4761,HEC
69,,SING,C2D,C3D,yes,N,69,,206300,4761,HEC
70,,SING,C2D,CMD,no,N,70,,206300,4761,HEC
71,,DOUB,C3D,C4D,yes,N,71,,206300,4761,HEC
72,,SING,C3D,CAD,no,N,72,,206300,4761,HEC
73,,SING,CMD,HMD1,no,N,73,,206300,4761,HEC
74,,SING,CMD,HMD2,no,N,74,,206300,4761,HEC
75,,SING,CMD,HMD3,no,N,75,,206300,4761,HEC
76,,SING,CAD,CBD,no,N,76,,206300,4761,HEC
77,,SING,CAD,HAD1,no,N,77,,206300,4761,HEC
78,,SING,CAD,HAD2,no,N,78,,206300,4761,HEC
79,,SING,CBD,CGD,no,N,79,,206300,4761,HEC
80,,SING,CBD,HBD1,no,N,80,,206300,4761,HEC
81,,SING,CBD,HBD2,no,N,81,,206300,4761,HEC
82,,DOUB,CGD,O1D,no,N,82,,206300,4761,HEC
83,,SING,CGD,O2D,no,N,83,,206300,4761,HEC
84,,SING,O2D,H2D,no,N,84,,206300,4761,HEC
1,,DOUB,PB,O1B,no,N,1,,206465,4770,GDP
2,,SING,PB,O2B,no,N,2,,206465,4770,GDP
3,,SING,PB,O3B,no,N,3,,206465,4770,GDP
4,,SING,PB,O3A,no,N,4,,206465,4770,GDP
5,,SING,O2B,HOB2,no,N,5,,206465,4770,GDP
6,,SING,O3B,HOB3,no,N,6,,206465,4770,GDP
7,,SING,O3A,PA,no,N,7,,206465,4770,GDP
8,,DOUB,PA,O1A,no,N,8,,206465,4770,GDP
9,,SING,PA,O2A,no,N,9,,206465,4770,GDP
10,,SING,PA,O5',no,N,10,,206465,4770,GDP
11,,SING,O2A,HOA2,no,N,11,,206465,4770,GDP
12,,SING,O5',C5',no,N,12,,206465,4770,GDP
13,,SING,C5',C4',no,N,13,,206465,4770,GDP
14,,SING,C5',H5',no,N,14,,206465,4770,GDP
15,,SING,C5',H5'',no,N,15,,206465,4770,GDP
16,,SING,C4',O4',no,N,16,,206465,4770,GDP
17,,SING,C4',C3',no,N,17,,206465,4770,GDP
18,,SING,C4',H4',no,N,18,,206465,4770,GDP
19,,SING,O4',C1',no,N,19,,206465,4770,GDP
20,,SING,C3',O3',no,N,20,,206465,4770,GDP
21,,SING,C3',C2',no,N,21,,206465,4770,GDP
22,,SING,C3',H3',no,N,22,,206465,4770,GDP
23,,SING,O3',HO3',no,N,23,,206465,4770,GDP
24,,SING,C2',O2',no,N,24,,206465,4770,GDP
25,,SING,C2',C1',no,N,25,,206465,4770,GDP
26,,SING,C2',H2',no,N,26,,206465,4770,GDP
27,,SING,O2',HO2',no,N,27,,206465,4770,GDP
28,,SING,C1',N9,no,N,28,,206465,4770,GDP
29,,SING,C1',H1',no,N,29,,206465,4770,GDP
30,,SING,N9,C8,yes,N,30,,206465,4770,GDP
31,,SING,N9,C4,yes,N,31,,206465,4770,GDP
32,,DOUB,C8,N7,yes,N,32,,206465,4770,GDP
33,,SING,C8,H8,no,N,33,,206465,4770,GDP
34,,SING,N7,C5,yes,N,34,,206465,4770,GDP
35,,SING,C5,C6,no,N,35,,206465,4770,GDP
36,,DOUB,C5,C4,yes,N,36,,206465,4770,GDP
37,,DOUB,C6,O6,no,N,37,,206465,4770,GDP
38,,SING,C6,N1,no,N,38,,206465,4770,GDP
39,,SING,N1,C2,no,N,39,,206465,4770,GDP
40,,SING,N1,HN1,no,N,40,,206465,4770,GDP
41,,SING,C2,N2,no,N,41,,206465,4770,GDP
42,,DOUB,C2,N3,no,N,42,,206465,4770,GDP
43,,SING,N2,HN21,no,N,43,,206465,4770,GDP
44,,SING,N2,HN22,no,N,44,,206465,4770,GDP
45,,SING,N3,C4,no,N,45,,206465,4770,GDP
1,,SING,FE,NA,no,N,1,,206590,4777,HEC
2,,SING,FE,NB,no,N,2,,206590,4777,HEC
3,,SING,FE,NC,no,N,3,,206590,4777,HEC
4,,SING,FE,ND,no,N,4,,206590,4777,HEC
5,,DOUB,CHA,C1A,no,N,5,,206590,4777,HEC
6,,SING,CHA,C4D,no,N,6,,206590,4777,HEC
7,,SING,CHA,HHA,no,N,7,,206590,4777,HEC
8,,DOUB,CHB,C4A,no,N,8,,206590,4777,HEC
9,,SING,CHB,C1B,no,N,9,,206590,4777,HEC
10,,SING,CHB,HHB,no,N,10,,206590,4777,HEC
11,,DOUB,CHC,C4B,no,N,11,,206590,4777,HEC
12,,SING,CHC,C1C,no,N,12,,206590,4777,HEC
13,,SING,CHC,HHC,no,N,13,,206590,4777,HEC
14,,DOUB,CHD,C4C,no,N,14,,206590,4777,HEC
15,,SING,CHD,C1D,no,N,15,,206590,4777,HEC
16,,SING,CHD,HHD,no,N,16,,206590,4777,HEC
17,,SING,NA,C1A,yes,N,17,,206590,4777,HEC
18,,SING,NA,C4A,yes,N,18,,206590,4777,HEC
19,,SING,C1A,C2A,yes,N,19,,206590,4777,HEC
20,,DOUB,C2A,C3A,yes,N,20,,206590,4777,HEC
21,,SING,C2A,CAA,no,N,21,,206590,4777,HEC
22,,SING,C3A,C4A,yes,N,22,,206590,4777,HEC
23,,SING,C3A,CMA,no,N,23,,206590,4777,HEC
24,,SING,CMA,HMA1,no,N,24,,206590,4777,HEC
25,,SING,CMA,HMA2,no,N,25,,206590,4777,HEC
26,,SING,CMA,HMA3,no,N,26,,206590,4777,HEC
27,,SING,CAA,CBA,no,N,27,,206590,4777,HEC
28,,SING,CAA,HAA1,no,N,28,,206590,4777,HEC
29,,SING,CAA,HAA2,no,N,29,,206590,4777,HEC
30,,SING,CBA,CGA,no,N,30,,206590,4777,HEC
31,,SING,CBA,HBA1,no,N,31,,206590,4777,HEC
32,,SING,CBA,HBA2,no,N,32,,206590,4777,HEC
33,,DOUB,CGA,O1A,no,N,33,,206590,4777,HEC
34,,SING,CGA,O2A,no,N,34,,206590,4777,HEC
35,,SING,O2A,H2A,no,N,35,,206590,4777,HEC
36,,SING,NB,C1B,yes,N,36,,206590,4777,HEC
37,,SING,NB,C4B,yes,N,37,,206590,4777,HEC
38,,DOUB,C1B,C2B,yes,N,38,,206590,4777,HEC
39,,SING,C2B,C3B,yes,N,39,,206590,4777,HEC
40,,SING,C2B,CMB,no,N,40,,206590,4777,HEC
41,,SING,C3B,C4B,yes,N,41,,206590,4777,HEC
42,,DOUB,C3B,CAB,no,E,42,,206590,4777,HEC
43,,SING,CMB,HMB1,no,N,43,,206590,4777,HEC
44,,SING,CMB,HMB2,no,N,44,,206590,4777,HEC
45,,SING,CMB,HMB3,no,N,45,,206590,4777,HEC
46,,SING,CAB,CBB,no,N,46,,206590,4777,HEC
47,,SING,CAB,HAB,no,N,47,,206590,4777,HEC
48,,SING,CBB,HBB1,no,N,48,,206590,4777,HEC
49,,SING,CBB,HBB2,no,N,49,,206590,4777,HEC
50,,SING,CBB,HBB3,no,N,50,,206590,4777,HEC
51,,SING,NC,C1C,yes,N,51,,206590,4777,HEC
52,,SING,NC,C4C,yes,N,52,,206590,4777,HEC
53,,DOUB,C1C,C2C,yes,N,53,,206590,4777,HEC
54,,SING,C2C,C3C,yes,N,54,,206590,4777,HEC
55,,SING,C2C,CMC,no,N,55,,206590,4777,HEC
56,,SING,C3C,C4C,yes,N,56,,206590,4777,HEC
57,,DOUB,C3C,CAC,no,E,57,,206590,4777,HEC
58,,SING,CMC,HMC1,no,N,58,,206590,4777,HEC
59,,SING,CMC,HMC2,no,N,59,,206590,4777,HEC
60,,SING,CMC,HMC3,no,N,60,,206590,4777,HEC
61,,SING,CAC,CBC,no,N,61,,206590,4777,HEC
62,,SING,CAC,HAC,no,N,62,,206590,4777,HEC
63,,SING,CBC,HBC1,no,N,63,,206590,4777,HEC
64,,SING,CBC,HBC2,no,N,64,,206590,4777,HEC
65,,SING,CBC,HBC3,no,N,65,,206590,4777,HEC
66,,SING,ND,C1D,yes,N,66,,206590,4777,HEC
67,,SING,ND,C4D,yes,N,67,,206590,4777,HEC
68,,DOUB,C1D,C2D,yes,N,68,,206590,4777,HEC
69,,SING,C2D,C3D,yes,N,69,,206590,4777,HEC
70,,SING,C2D,CMD,no,N,70,,206590,4777,HEC
71,,DOUB,C3D,C4D,yes,N,71,,206590,4777,HEC
72,,SING,C3D,CAD,no,N,72,,206590,4777,HEC
73,,SING,CMD,HMD1,no,N,73,,206590,4777,HEC
74,,SING,CMD,HMD2,no,N,74,,206590,4777,HEC
75,,SING,CMD,HMD3,no,N,75,,206590,4777,HEC
76,,SING,CAD,CBD,no,N,76,,206590,4777,HEC
77,,SING,CAD,HAD1,no,N,77,,206590,4777,HEC
78,,SING,CAD,HAD2,no,N,78,,206590,4777,HEC
79,,SING,CBD,CGD,no,N,79,,206590,4777,HEC
80,,SING,CBD,HBD1,no,N,80,,206590,4777,HEC
81,,SING,CBD,HBD2,no,N,81,,206590,4777,HEC
82,,DOUB,CGD,O1D,no,N,82,,206590,4777,HEC
83,,SING,CGD,O2D,no,N,83,,206590,4777,HEC
84,,SING,O2D,H2D,no,N,84,,206590,4777,HEC
1,,DOUB,PG,O1G,no,N,1,,206624,4778,GNP
2,,SING,PG,O2G,no,N,2,,206624,4778,GNP
3,,SING,PG,O3G,no,N,3,,206624,4778,GNP
4,,SING,PG,N3B,no,N,4,,206624,4778,GNP
5,,SING,O2G,HOG2,no,N,5,,206624,4778,GNP
6,,SING,O3G,HOG3,no,N,6,,206624,4778,GNP
7,,SING,N3B,PB,no,N,7,,206624,4778,GNP
8,,SING,N3B,HNB3,no,N,8,,206624,4778,GNP
9,,DOUB,PB,O1B,no,N,9,,206624,4778,GNP
10,,SING,PB,O2B,no,N,10,,206624,4778,GNP
11,,SING,PB,O3A,no,N,11,,206624,4778,GNP
12,,SING,O2B,HOB2,no,N,12,,206624,4778,GNP
13,,SING,O3A,PA,no,N,13,,206624,4778,GNP
14,,DOUB,PA,O1A,no,N,14,,206624,4778,GNP
15,,SING,PA,O2A,no,N,15,,206624,4778,GNP
16,,SING,PA,O5',no,N,16,,206624,4778,GNP
17,,SING,O2A,HOA2,no,N,17,,206624,4778,GNP
18,,SING,O5',C5',no,N,18,,206624,4778,GNP
19,,SING,C5',C4',no,N,19,,206624,4778,GNP
20,,SING,C5',H5'2,no,N,20,,206624,4778,GNP
21,,SING,C5',H5'1,no,N,21,,206624,4778,GNP
22,,SING,C4',O4',no,N,22,,206624,4778,GNP
23,,SING,C4',C3',no,N,23,,206624,4778,GNP
24,,SING,C4',H4',no,N,24,,206624,4778,GNP
25,,SING,O4',C1',no,N,25,,206624,4778,GNP
26,,SING,C3',O3',no,N,26,,206624,4778,GNP
27,,SING,C3',C2',no,N,27,,206624,4778,GNP
28,,SING,C3',H3',no,N,28,,206624,4778,GNP
29,,SING,O3',HO3',no,N,29,,206624,4778,GNP
30,,SING,C2',O2',no,N,30,,206624,4778,GNP
31,,SING,C2',C1',no,N,31,,206624,4778,GNP
32,,SING,C2',H2',no,N,32,,206624,4778,GNP
33,,SING,O2',HO2',no,N,33,,206624,4778,GNP
34,,SING,C1',N9,no,N,34,,206624,4778,GNP
35,,SING,C1',H1',no,N,35,,206624,4778,GNP
36,,SING,N9,C8,yes,N,36,,206624,4778,GNP
37,,SING,N9,C4,yes,N,37,,206624,4778,GNP
38,,DOUB,C8,N7,yes,N,38,,206624,4778,GNP
39,,SING,C8,H8,no,N,39,,206624,4778,GNP
40,,SING,N7,C5,yes,N,40,,206624,4778,GNP
41,,SING,C5,C6,yes,N,41,,206624,4778,GNP
42,,DOUB,C5,C4,yes,N,42,,206624,4778,GNP
43,,DOUB,C6,O6,no,N,43,,206624,4778,GNP
44,,SING,C6,N1,yes,N,44,,206624,4778,GNP
45,,SING,N1,C2,yes,N,45,,206624,4778,GNP
46,,SING,N1,HN1,no,N,46,,206624,4778,GNP
47,,SING,C2,N2,no,N,47,,206624,4778,GNP
48,,DOUB,C2,N3,yes,N,48,,206624,4778,GNP
49,,SING,N2,HN21,no,N,49,,206624,4778,GNP
50,,SING,N2,HN22,no,N,50,,206624,4778,GNP
51,,SING,N3,C4,yes,N,51,,206624,4778,GNP
1,,SING,NA,C1,no,N,1,,206792,4786,BLM
2,,SING,NA,HA2,no,N,2,,206792,4786,BLM
3,,SING,NA,HA1,no,N,3,,206792,4786,BLM
4,,SING,C2,C1,no,N,4,,206792,4786,BLM
5,,SING,C2,C3,no,N,5,,206792,4786,BLM
6,,SING,C2,NB,no,N,6,,206792,4786,BLM
7,,SING,C2,H2,no,N,7,,206792,4786,BLM
8,,DOUB,C1,O1,no,N,8,,206792,4786,BLM
9,,SING,NC,C3,no,N,9,,206792,4786,BLM
10,,SING,NC,C6,no,N,10,,206792,4786,BLM
11,,SING,NC,HNC,no,N,11,,206792,4786,BLM
12,,SING,C3,H3E,no,N,12,,206792,4786,BLM
13,,SING,C3,H3X,no,N,13,,206792,4786,BLM
14,,SING,NB,HB1,no,N,14,,206792,4786,BLM
15,,SING,NB,HB2,no,N,15,,206792,4786,BLM
16,,SING,ND,C4,no,N,16,,206792,4786,BLM
17,,SING,ND,HD2,no,N,17,,206792,4786,BLM
18,,SING,ND,HD1,no,N,18,,206792,4786,BLM
19,,SING,C5,C4,no,N,19,,206792,4786,BLM
20,,SING,C5,C6,no,N,20,,206792,4786,BLM
21,,SING,C5,H5E,no,N,21,,206792,4786,BLM
22,,SING,C5,H5X,no,N,22,,206792,4786,BLM
23,,DOUB,C4,O4,no,N,23,,206792,4786,BLM
24,,DOUB,C8,C9,yes,N,24,,206792,4786,BLM
25,,SING,C8,NE,yes,N,25,,206792,4786,BLM
26,,SING,C8,NF,no,N,26,,206792,4786,BLM
27,,SING,C9,C10,yes,N,27,,206792,4786,BLM
28,,SING,C9,CA,no,N,28,,206792,4786,BLM
29,,DOUB,C10,NG,yes,N,29,,206792,4786,BLM
30,,SING,C10,C12,no,N,30,,206792,4786,BLM
31,,SING,NG,C7,yes,N,31,,206792,4786,BLM
32,,DOUB,C7,NE,yes,N,32,,206792,4786,BLM
33,,SING,C7,C6,no,N,33,,206792,4786,BLM
34,,SING,C6,H6,no,N,34,,206792,4786,BLM
35,,SING,NF,HF2,no,N,35,,206792,4786,BLM
36,,SING,NF,HF1,no,N,36,,206792,4786,BLM
37,,SING,CA,HAA,no,N,37,,206792,4786,BLM
38,,SING,CA,HAB,no,N,38,,206792,4786,BLM
39,,SING,CA,HAC,no,N,39,,206792,4786,BLM
40,,DOUB,C12,O12,no,N,40,,206792,4786,BLM
41,,SING,C12,NH,no,N,41,,206792,4786,BLM
42,,SING,NH,C13,no,N,42,,206792,4786,BLM
43,,SING,NH,HNH,no,N,43,,206792,4786,BLM
44,,SING,C13,C30,no,N,44,,206792,4786,BLM
45,,SING,C13,C14,no,N,45,,206792,4786,BLM
46,,SING,C13,H13,no,N,46,,206792,4786,BLM
47,,DOUB,C30,O30,no,N,47,,206792,4786,BLM
48,,SING,C30,NK,no,N,48,,206792,4786,BLM
49,,SING,C14,C27,no,N,49,,206792,4786,BLM
50,,SING,C14,OH1,no,N,50,,206792,4786,BLM
51,,SING,C14,H14,no,N,51,,206792,4786,BLM
52,,SING,C27,NJ,yes,N,52,,206792,4786,BLM
53,,DOUB,C27,C28,yes,N,53,,206792,4786,BLM
54,,SING,OH1,C63,no,N,54,,206792,4786,BLM
55,,DOUB,NJ,C29,yes,N,55,,206792,4786,BLM
56,,SING,C28,NI,yes,N,56,,206792,4786,BLM
57,,SING,C28,H28,no,N,57,,206792,4786,BLM
58,,SING,C29,NI,yes,N,58,,206792,4786,BLM
59,,SING,C29,H29,no,N,59,,206792,4786,BLM
60,,SING,NI,HNI,no,N,60,,206792,4786,BLM
61,,SING,NK,C31,no,N,61,,206792,4786,BLM
62,,SING,NK,HNK,no,N,62,,206792,4786,BLM
63,,SING,C34,C36,no,N,63,,206792,4786,BLM
64,,SING,C34,C33,no,N,64,,206792,4786,BLM
65,,SING,C34,CC,no,N,65,,206792,4786,BLM
66,,SING,C34,H34,no,N,66,,206792,4786,BLM
67,,DOUB,C36,O36,no,N,67,,206792,4786,BLM
68,,SING,C36,NL,no,N,68,,206792,4786,BLM
69,,SING,OH2,C33,no,N,69,,206792,4786,BLM
70,,SING,OH2,HO2,no,N,70,,206792,4786,BLM
71,,SING,C31,CB,no,N,71,,206792,4786,BLM
72,,SING,C31,C33,no,N,72,,206792,4786,BLM
73,,SING,C31,H31,no,N,73,,206792,4786,BLM
74,,SING,CB,HBA,no,N,74,,206792,4786,BLM
75,,SING,CB,HBB,no,N,75,,206792,4786,BLM
76,,SING,CB,HBC,no,N,76,,206792,4786,BLM
77,,SING,C33,H33,no,N,77,,206792,4786,BLM
78,,SING,CC,HCB,no,N,78,,206792,4786,BLM
79,,SING,CC,HCC,no,N,79,,206792,4786,BLM
80,,SING,CC,HCA,no,N,80,,206792,4786,BLM
81,,SING,NL,C37,no,N,81,,206792,4786,BLM
82,,SING,NL,HNL,no,N,82,,206792,4786,BLM
83,,SING,C37,C40,no,N,83,,206792,4786,BLM
84,,SING,C37,C38,no,N,84,,206792,4786,BLM
85,,SING,C37,H37,no,N,85,,206792,4786,BLM
86,,DOUB,C40,O40,no,N,86,,206792,4786,BLM
87,,SING,C40,NM,no,N,87,,206792,4786,BLM
88,,SING,C38,OH3,no,N,88,,206792,4786,BLM
89,,SING,C38,CD,no,N,89,,206792,4786,BLM
90,,SING,C38,H38,no,N,90,,206792,4786,BLM
91,,SING,OH3,HO3,no,N,91,,206792,4786,BLM
92,,SING,CD,HDB,no,N,92,,206792,4786,BLM
93,,SING,CD,HDC,no,N,93,,206792,4786,BLM
94,,SING,CD,HDA,no,N,94,,206792,4786,BLM
95,,SING,NM,C41,no,N,95,,206792,4786,BLM
96,,SING,NM,HNM,no,N,96,,206792,4786,BLM
97,,SING,C42,C43,no,N,97,,206792,4786,BLM
98,,SING,C42,C41,no,N,98,,206792,4786,BLM
99,,SING,C42,H2E,no,N,99,,206792,4786,BLM
100,,SING,C42,H2X,no,N,100,,206792,4786,BLM
101,,DOUB,C49,O49,no,N,101,,206792,4786,BLM
102,,SING,C49,C48,no,N,102,,206792,4786,BLM
103,,SING,C49,NP,no,N,103,,206792,4786,BLM
104,,SING,C43,S43,yes,N,104,,206792,4786,BLM
105,,DOUB,C43,NN,yes,N,105,,206792,4786,BLM
106,,SING,C41,H1E,no,N,106,,206792,4786,BLM
107,,SING,C41,H1X,no,N,107,,206792,4786,BLM
108,,SING,S43,C44,yes,N,108,,206792,4786,BLM
109,,DOUB,C44,C45,yes,N,109,,206792,4786,BLM
110,,SING,C44,H44,no,N,110,,206792,4786,BLM
111,,SING,C45,NN,yes,N,111,,206792,4786,BLM
112,,SING,C45,C46,yes,N,112,,206792,4786,BLM
113,,DOUB,C47,C48,yes,N,113,,206792,4786,BLM
114,,SING,C47,S46,yes,N,114,,206792,4786,BLM
115,,SING,C47,H47,no,N,115,,206792,4786,BLM
116,,SING,C48,NO,yes,N,116,,206792,4786,BLM
117,,DOUB,NO,C46,yes,N,117,,206792,4786,BLM
118,,SING,C46,S46,yes,N,118,,206792,4786,BLM
119,,SING,NP,C50,no,N,119,,206792,4786,BLM
120,,SING,NP,HNP,no,N,120,,206792,4786,BLM
121,,SING,C50,C51,no,N,121,,206792,4786,BLM
122,,SING,C50,H501,no,N,122,,206792,4786,BLM
123,,SING,C50,H502,no,N,123,,206792,4786,BLM
124,,SING,C51,C52,no,N,124,,206792,4786,BLM
125,,SING,C51,H511,no,N,125,,206792,4786,BLM
126,,SING,C51,H512,no,N,126,,206792,4786,BLM
127,,SING,C52,S53,no,N,127,,206792,4786,BLM
128,,SING,C52,H521,no,N,128,,206792,4786,BLM
129,,SING,C52,H522,no,N,129,,206792,4786,BLM
130,,SING,S53,C55,no,N,130,,206792,4786,BLM
131,,SING,S53,C54,no,N,131,,206792,4786,BLM
132,,SING,S53,H53,no,N,132,,206792,4786,BLM
133,,SING,C55,H551,no,N,133,,206792,4786,BLM
134,,SING,C55,H552,no,N,134,,206792,4786,BLM
135,,SING,C55,H553,no,N,135,,206792,4786,BLM
136,,SING,C54,H541,no,N,136,,206792,4786,BLM
137,,SING,C54,H542,no,N,137,,206792,4786,BLM
138,,SING,C54,H543,no,N,138,,206792,4786,BLM
139,,SING,O59,C59,no,N,139,,206792,4786,BLM
140,,SING,O59,HO59,no,N,140,,206792,4786,BLM
141,,SING,O58,C58,no,N,141,,206792,4786,BLM
142,,SING,O58,HO58,no,N,142,,206792,4786,BLM
143,,SING,C61,O61,no,N,143,,206792,4786,BLM
144,,SING,C61,C60,no,N,144,,206792,4786,BLM
145,,SING,C61,H611,no,N,145,,206792,4786,BLM
146,,SING,C61,H612,no,N,146,,206792,4786,BLM
147,,SING,O61,HO61,no,N,147,,206792,4786,BLM
148,,SING,O56,C57,no,N,148,,206792,4786,BLM
149,,SING,O56,C64,no,N,149,,206792,4786,BLM
150,,SING,C60,O62,no,N,150,,206792,4786,BLM
151,,SING,C60,C59,no,N,151,,206792,4786,BLM
152,,SING,C60,H60,no,N,152,,206792,4786,BLM
153,,SING,O62,C63,no,N,153,,206792,4786,BLM
154,,SING,C63,C57,no,N,154,,206792,4786,BLM
155,,SING,C63,H63,no,N,155,,206792,4786,BLM
156,,SING,C57,C58,no,N,156,,206792,4786,BLM
157,,SING,C57,H57,no,N,157,,206792,4786,BLM
158,,SING,C58,C59,no,N,158,,206792,4786,BLM
159,,SING,C58,H58,no,N,159,,206792,4786,BLM
160,,SING,C59,H59,no,N,160,,206792,4786,BLM
161,,SING,C69,C68,no,N,161,,206792,4786,BLM
162,,SING,C69,C64,no,N,162,,206792,4786,BLM
163,,SING,C69,O69,no,N,163,,206792,4786,BLM
164,,SING,C69,H69,no,N,164,,206792,4786,BLM
165,,SING,C68,C67,no,N,165,,206792,4786,BLM
166,,SING,C68,O68,no,N,166,,206792,4786,BLM
167,,SING,C68,H68,no,N,167,,206792,4786,BLM
168,,SING,C67,C65,no,N,168,,206792,4786,BLM
169,,SING,C67,O67,no,N,169,,206792,4786,BLM
170,,SING,C67,H67,no,N,170,,206792,4786,BLM
171,,SING,C65,O64,no,N,171,,206792,4786,BLM
172,,SING,C65,C66,no,N,172,,206792,4786,BLM
173,,SING,C65,H65,no,N,173,,206792,4786,BLM
174,,SING,O64,C64,no,N,174,,206792,4786,BLM
175,,SING,C64,H64,no,N,175,,206792,4786,BLM
176,,SING,O68,C70,no,N,176,,206792,4786,BLM
177,,SING,O67,HO67,no,N,177,,206792,4786,BLM
178,,SING,O69,HO69,no,N,178,,206792,4786,BLM
179,,SING,NQ,C70,no,N,179,,206792,4786,BLM
180,,SING,NQ,HNQ1,no,N,180,,206792,4786,BLM
181,,SING,NQ,HNQ2,no,N,181,,206792,4786,BLM
182,,DOUB,C70,O70,no,N,182,,206792,4786,BLM
183,,SING,O66,C66,no,N,183,,206792,4786,BLM
184,,SING,O66,HO66,no,N,184,,206792,4786,BLM
185,,SING,C66,H661,no,N,185,,206792,4786,BLM
186,,SING,C66,H662,no,N,186,,206792,4786,BLM
1,,DOUB,C,O,no,N,1,,207119,4799,ACE
2,,SING,C,CH3,no,N,2,,207119,4799,ACE
3,,SING,C,H,no,N,3,,207119,4799,ACE
4,,SING,CH3,H1,no,N,4,,207119,4799,ACE
5,,SING,CH3,H2,no,N,5,,207119,4799,ACE
6,,SING,CH3,H3,no,N,6,,207119,4799,ACE
1,,SING,N,HN1,no,N,1,,207120,4799,NH2
2,,SING,N,HN2,no,N,2,,207120,4799,NH2
1,,SING,FE,NA,no,N,1,,207163,4800,HEC
2,,SING,FE,NB,no,N,2,,207163,4800,HEC
3,,SING,FE,NC,no,N,3,,207163,4800,HEC
4,,SING,FE,ND,no,N,4,,207163,4800,HEC
5,,DOUB,CHA,C1A,no,N,5,,207163,4800,HEC
6,,SING,CHA,C4D,no,N,6,,207163,4800,HEC
7,,SING,CHA,HHA,no,N,7,,207163,4800,HEC
8,,DOUB,CHB,C4A,no,N,8,,207163,4800,HEC
9,,SING,CHB,C1B,no,N,9,,207163,4800,HEC
10,,SING,CHB,HHB,no,N,10,,207163,4800,HEC
11,,DOUB,CHC,C4B,no,N,11,,207163,4800,HEC
12,,SING,CHC,C1C,no,N,12,,207163,4800,HEC
13,,SING,CHC,HHC,no,N,13,,207163,4800,HEC
14,,DOUB,CHD,C4C,no,N,14,,207163,4800,HEC
15,,SING,CHD,C1D,no,N,15,,207163,4800,HEC
16,,SING,CHD,HHD,no,N,16,,207163,4800,HEC
17,,SING,NA,C1A,yes,N,17,,207163,4800,HEC
18,,SING,NA,C4A,yes,N,18,,207163,4800,HEC
19,,SING,C1A,C2A,yes,N,19,,207163,4800,HEC
20,,DOUB,C2A,C3A,yes,N,20,,207163,4800,HEC
21,,SING,C2A,CAA,no,N,21,,207163,4800,HEC
22,,SING,C3A,C4A,yes,N,22,,207163,4800,HEC
23,,SING,C3A,CMA,no,N,23,,207163,4800,HEC
24,,SING,CMA,HMA1,no,N,24,,207163,4800,HEC
25,,SING,CMA,HMA2,no,N,25,,207163,4800,HEC
26,,SING,CMA,HMA3,no,N,26,,207163,4800,HEC
27,,SING,CAA,CBA,no,N,27,,207163,4800,HEC
28,,SING,CAA,HAA1,no,N,28,,207163,4800,HEC
29,,SING,CAA,HAA2,no,N,29,,207163,4800,HEC
30,,SING,CBA,CGA,no,N,30,,207163,4800,HEC
31,,SING,CBA,HBA1,no,N,31,,207163,4800,HEC
32,,SING,CBA,HBA2,no,N,32,,207163,4800,HEC
33,,DOUB,CGA,O1A,no,N,33,,207163,4800,HEC
34,,SING,CGA,O2A,no,N,34,,207163,4800,HEC
35,,SING,O2A,H2A,no,N,35,,207163,4800,HEC
36,,SING,NB,C1B,yes,N,36,,207163,4800,HEC
37,,SING,NB,C4B,yes,N,37,,207163,4800,HEC
38,,DOUB,C1B,C2B,yes,N,38,,207163,4800,HEC
39,,SING,C2B,C3B,yes,N,39,,207163,4800,HEC
40,,SING,C2B,CMB,no,N,40,,207163,4800,HEC
41,,SING,C3B,C4B,yes,N,41,,207163,4800,HEC
42,,DOUB,C3B,CAB,no,E,42,,207163,4800,HEC
43,,SING,CMB,HMB1,no,N,43,,207163,4800,HEC
44,,SING,CMB,HMB2,no,N,44,,207163,4800,HEC
45,,SING,CMB,HMB3,no,N,45,,207163,4800,HEC
46,,SING,CAB,CBB,no,N,46,,207163,4800,HEC
47,,SING,CAB,HAB,no,N,47,,207163,4800,HEC
48,,SING,CBB,HBB1,no,N,48,,207163,4800,HEC
49,,SING,CBB,HBB2,no,N,49,,207163,4800,HEC
50,,SING,CBB,HBB3,no,N,50,,207163,4800,HEC
51,,SING,NC,C1C,yes,N,51,,207163,4800,HEC
52,,SING,NC,C4C,yes,N,52,,207163,4800,HEC
53,,DOUB,C1C,C2C,yes,N,53,,207163,4800,HEC
54,,SING,C2C,C3C,yes,N,54,,207163,4800,HEC
55,,SING,C2C,CMC,no,N,55,,207163,4800,HEC
56,,SING,C3C,C4C,yes,N,56,,207163,4800,HEC
57,,DOUB,C3C,CAC,no,E,57,,207163,4800,HEC
58,,SING,CMC,HMC1,no,N,58,,207163,4800,HEC
59,,SING,CMC,HMC2,no,N,59,,207163,4800,HEC
60,,SING,CMC,HMC3,no,N,60,,207163,4800,HEC
61,,SING,CAC,CBC,no,N,61,,207163,4800,HEC
62,,SING,CAC,HAC,no,N,62,,207163,4800,HEC
63,,SING,CBC,HBC1,no,N,63,,207163,4800,HEC
64,,SING,CBC,HBC2,no,N,64,,207163,4800,HEC
65,,SING,CBC,HBC3,no,N,65,,207163,4800,HEC
66,,SING,ND,C1D,yes,N,66,,207163,4800,HEC
67,,SING,ND,C4D,yes,N,67,,207163,4800,HEC
68,,DOUB,C1D,C2D,yes,N,68,,207163,4800,HEC
69,,SING,C2D,C3D,yes,N,69,,207163,4800,HEC
70,,SING,C2D,CMD,no,N,70,,207163,4800,HEC
71,,DOUB,C3D,C4D,yes,N,71,,207163,4800,HEC
72,,SING,C3D,CAD,no,N,72,,207163,4800,HEC
73,,SING,CMD,HMD1,no,N,73,,207163,4800,HEC
74,,SING,CMD,HMD2,no,N,74,,207163,4800,HEC
75,,SING,CMD,HMD3,no,N,75,,207163,4800,HEC
76,,SING,CAD,CBD,no,N,76,,207163,4800,HEC
77,,SING,CAD,HAD1,no,N,77,,207163,4800,HEC
78,,SING,CAD,HAD2,no,N,78,,207163,4800,HEC
79,,SING,CBD,CGD,no,N,79,,207163,4800,HEC
80,,SING,CBD,HBD1,no,N,80,,207163,4800,HEC
81,,SING,CBD,HBD2,no,N,81,,207163,4800,HEC
82,,DOUB,CGD,O1D,no,N,82,,207163,4800,HEC
83,,SING,CGD,O2D,no,N,83,,207163,4800,HEC
84,,SING,O2D,H2D,no,N,84,,207163,4800,HEC
1,,SING,FE,NA,no,N,1,,207188,4801,HEC
2,,SING,FE,NB,no,N,2,,207188,4801,HEC
3,,SING,FE,NC,no,N,3,,207188,4801,HEC
4,,SING,FE,ND,no,N,4,,207188,4801,HEC
5,,DOUB,CHA,C1A,no,N,5,,207188,4801,HEC
6,,SING,CHA,C4D,no,N,6,,207188,4801,HEC
7,,SING,CHA,HHA,no,N,7,,207188,4801,HEC
8,,DOUB,CHB,C4A,no,N,8,,207188,4801,HEC
9,,SING,CHB,C1B,no,N,9,,207188,4801,HEC
10,,SING,CHB,HHB,no,N,10,,207188,4801,HEC
11,,DOUB,CHC,C4B,no,N,11,,207188,4801,HEC
12,,SING,CHC,C1C,no,N,12,,207188,4801,HEC
13,,SING,CHC,HHC,no,N,13,,207188,4801,HEC
14,,DOUB,CHD,C4C,no,N,14,,207188,4801,HEC
15,,SING,CHD,C1D,no,N,15,,207188,4801,HEC
16,,SING,CHD,HHD,no,N,16,,207188,4801,HEC
17,,SING,NA,C1A,yes,N,17,,207188,4801,HEC
18,,SING,NA,C4A,yes,N,18,,207188,4801,HEC
19,,SING,C1A,C2A,yes,N,19,,207188,4801,HEC
20,,DOUB,C2A,C3A,yes,N,20,,207188,4801,HEC
21,,SING,C2A,CAA,no,N,21,,207188,4801,HEC
22,,SING,C3A,C4A,yes,N,22,,207188,4801,HEC
23,,SING,C3A,CMA,no,N,23,,207188,4801,HEC
24,,SING,CMA,HMA1,no,N,24,,207188,4801,HEC
25,,SING,CMA,HMA2,no,N,25,,207188,4801,HEC
26,,SING,CMA,HMA3,no,N,26,,207188,4801,HEC
27,,SING,CAA,CBA,no,N,27,,207188,4801,HEC
28,,SING,CAA,HAA1,no,N,28,,207188,4801,HEC
29,,SING,CAA,HAA2,no,N,29,,207188,4801,HEC
30,,SING,CBA,CGA,no,N,30,,207188,4801,HEC
31,,SING,CBA,HBA1,no,N,31,,207188,4801,HEC
32,,SING,CBA,HBA2,no,N,32,,207188,4801,HEC
33,,DOUB,CGA,O1A,no,N,33,,207188,4801,HEC
34,,SING,CGA,O2A,no,N,34,,207188,4801,HEC
35,,SING,O2A,H2A,no,N,35,,207188,4801,HEC
36,,SING,NB,C1B,yes,N,36,,207188,4801,HEC
37,,SING,NB,C4B,yes,N,37,,207188,4801,HEC
38,,DOUB,C1B,C2B,yes,N,38,,207188,4801,HEC
39,,SING,C2B,C3B,yes,N,39,,207188,4801,HEC
40,,SING,C2B,CMB,no,N,40,,207188,4801,HEC
41,,SING,C3B,C4B,yes,N,41,,207188,4801,HEC
42,,DOUB,C3B,CAB,no,E,42,,207188,4801,HEC
43,,SING,CMB,HMB1,no,N,43,,207188,4801,HEC
44,,SING,CMB,HMB2,no,N,44,,207188,4801,HEC
45,,SING,CMB,HMB3,no,N,45,,207188,4801,HEC
46,,SING,CAB,CBB,no,N,46,,207188,4801,HEC
47,,SING,CAB,HAB,no,N,47,,207188,4801,HEC
48,,SING,CBB,HBB1,no,N,48,,207188,4801,HEC
49,,SING,CBB,HBB2,no,N,49,,207188,4801,HEC
50,,SING,CBB,HBB3,no,N,50,,207188,4801,HEC
51,,SING,NC,C1C,yes,N,51,,207188,4801,HEC
52,,SING,NC,C4C,yes,N,52,,207188,4801,HEC
53,,DOUB,C1C,C2C,yes,N,53,,207188,4801,HEC
54,,SING,C2C,C3C,yes,N,54,,207188,4801,HEC
55,,SING,C2C,CMC,no,N,55,,207188,4801,HEC
56,,SING,C3C,C4C,yes,N,56,,207188,4801,HEC
57,,DOUB,C3C,CAC,no,E,57,,207188,4801,HEC
58,,SING,CMC,HMC1,no,N,58,,207188,4801,HEC
59,,SING,CMC,HMC2,no,N,59,,207188,4801,HEC
60,,SING,CMC,HMC3,no,N,60,,207188,4801,HEC
61,,SING,CAC,CBC,no,N,61,,207188,4801,HEC
62,,SING,CAC,HAC,no,N,62,,207188,4801,HEC
63,,SING,CBC,HBC1,no,N,63,,207188,4801,HEC
64,,SING,CBC,HBC2,no,N,64,,207188,4801,HEC
65,,SING,CBC,HBC3,no,N,65,,207188,4801,HEC
66,,SING,ND,C1D,yes,N,66,,207188,4801,HEC
67,,SING,ND,C4D,yes,N,67,,207188,4801,HEC
68,,DOUB,C1D,C2D,yes,N,68,,207188,4801,HEC
69,,SING,C2D,C3D,yes,N,69,,207188,4801,HEC
70,,SING,C2D,CMD,no,N,70,,207188,4801,HEC
71,,DOUB,C3D,C4D,yes,N,71,,207188,4801,HEC
72,,SING,C3D,CAD,no,N,72,,207188,4801,HEC
73,,SING,CMD,HMD1,no,N,73,,207188,4801,HEC
74,,SING,CMD,HMD2,no,N,74,,207188,4801,HEC
75,,SING,CMD,HMD3,no,N,75,,207188,4801,HEC
76,,SING,CAD,CBD,no,N,76,,207188,4801,HEC
77,,SING,CAD,HAD1,no,N,77,,207188,4801,HEC
78,,SING,CAD,HAD2,no,N,78,,207188,4801,HEC
79,,SING,CBD,CGD,no,N,79,,207188,4801,HEC
80,,SING,CBD,HBD1,no,N,80,,207188,4801,HEC
81,,SING,CBD,HBD2,no,N,81,,207188,4801,HEC
82,,DOUB,CGD,O1D,no,N,82,,207188,4801,HEC
83,,SING,CGD,O2D,no,N,83,,207188,4801,HEC
84,,SING,O2D,H2D,no,N,84,,207188,4801,HEC
1,,SING,CHA,C1A,yes,N,1,,207236,4803,HEM
2,,DOUB,CHA,C4D,yes,N,2,,207236,4803,HEM
3,,SING,CHA,HHA,no,N,3,,207236,4803,HEM
4,,SING,CHB,C4A,yes,N,4,,207236,4803,HEM
5,,DOUB,CHB,C1B,yes,N,5,,207236,4803,HEM
6,,SING,CHB,HHB,no,N,6,,207236,4803,HEM
7,,SING,CHC,C4B,yes,N,7,,207236,4803,HEM
8,,DOUB,CHC,C1C,yes,N,8,,207236,4803,HEM
9,,SING,CHC,HHC,no,N,9,,207236,4803,HEM
10,,DOUB,CHD,C4C,yes,N,10,,207236,4803,HEM
11,,SING,CHD,C1D,yes,N,11,,207236,4803,HEM
12,,SING,CHD,HHD,no,N,12,,207236,4803,HEM
13,,DOUB,C1A,C2A,yes,N,13,,207236,4803,HEM
14,,SING,C1A,NA,yes,N,14,,207236,4803,HEM
15,,SING,C2A,C3A,yes,N,15,,207236,4803,HEM
16,,SING,C2A,CAA,no,N,16,,207236,4803,HEM
17,,DOUB,C3A,C4A,yes,N,17,,207236,4803,HEM
18,,SING,C3A,CMA,no,N,18,,207236,4803,HEM
19,,SING,C4A,NA,yes,N,19,,207236,4803,HEM
20,,SING,CMA,HMA,no,N,20,,207236,4803,HEM
21,,SING,CMA,HMAA,no,N,21,,207236,4803,HEM
22,,SING,CMA,HMAB,no,N,22,,207236,4803,HEM
23,,SING,CAA,CBA,no,N,23,,207236,4803,HEM
24,,SING,CAA,HAA,no,N,24,,207236,4803,HEM
25,,SING,CAA,HAAA,no,N,25,,207236,4803,HEM
26,,SING,CBA,CGA,no,N,26,,207236,4803,HEM
27,,SING,CBA,HBA,no,N,27,,207236,4803,HEM
28,,SING,CBA,HBAA,no,N,28,,207236,4803,HEM
29,,DOUB,CGA,O1A,no,N,29,,207236,4803,HEM
30,,SING,CGA,O2A,no,N,30,,207236,4803,HEM
31,,SING,C1B,C2B,no,N,31,,207236,4803,HEM
32,,SING,C1B,NB,yes,N,32,,207236,4803,HEM
33,,DOUB,C2B,C3B,yes,N,33,,207236,4803,HEM
34,,SING,C2B,CMB,yes,N,34,,207236,4803,HEM
35,,SING,C3B,C4B,no,N,35,,207236,4803,HEM
36,,SING,C3B,CAB,yes,N,36,,207236,4803,HEM
37,,DOUB,C4B,NB,no,N,37,,207236,4803,HEM
38,,SING,CMB,HMB,yes,N,38,,207236,4803,HEM
39,,SING,CMB,HMBA,no,N,39,,207236,4803,HEM
40,,SING,CMB,HMBB,no,N,40,,207236,4803,HEM
41,,DOUB,CAB,CBB,no,N,41,,207236,4803,HEM
42,,SING,CAB,HAB,no,N,42,,207236,4803,HEM
43,,SING,CBB,HBB,no,N,43,,207236,4803,HEM
44,,SING,CBB,HBBA,no,N,44,,207236,4803,HEM
45,,SING,C1C,C2C,no,N,45,,207236,4803,HEM
46,,SING,C1C,NC,yes,N,46,,207236,4803,HEM
47,,DOUB,C2C,C3C,yes,N,47,,207236,4803,HEM
48,,SING,C2C,CMC,yes,N,48,,207236,4803,HEM
49,,SING,C3C,C4C,no,N,49,,207236,4803,HEM
50,,SING,C3C,CAC,yes,N,50,,207236,4803,HEM
51,,SING,C4C,NC,no,N,51,,207236,4803,HEM
52,,SING,CMC,HMC,yes,N,52,,207236,4803,HEM
53,,SING,CMC,HMCA,no,N,53,,207236,4803,HEM
54,,SING,CMC,HMCB,no,N,54,,207236,4803,HEM
55,,DOUB,CAC,CBC,no,N,55,,207236,4803,HEM
56,,SING,CAC,HAC,no,N,56,,207236,4803,HEM
57,,SING,CBC,HBC,no,N,57,,207236,4803,HEM
58,,SING,CBC,HBCA,no,N,58,,207236,4803,HEM
59,,SING,C1D,C2D,no,N,59,,207236,4803,HEM
60,,DOUB,C1D,ND,yes,N,60,,207236,4803,HEM
61,,DOUB,C2D,C3D,yes,N,61,,207236,4803,HEM
62,,SING,C2D,CMD,yes,N,62,,207236,4803,HEM
63,,SING,C3D,C4D,no,N,63,,207236,4803,HEM
64,,SING,C3D,CAD,yes,N,64,,207236,4803,HEM
65,,SING,C4D,ND,no,N,65,,207236,4803,HEM
66,,SING,CMD,HMD,yes,N,66,,207236,4803,HEM
67,,SING,CMD,HMDA,no,N,67,,207236,4803,HEM
68,,SING,CMD,HMDB,no,N,68,,207236,4803,HEM
69,,SING,CAD,CBD,no,N,69,,207236,4803,HEM
70,,SING,CAD,HAD,no,N,70,,207236,4803,HEM
71,,SING,CAD,HADA,no,N,71,,207236,4803,HEM
72,,SING,CBD,CGD,no,N,72,,207236,4803,HEM
73,,SING,CBD,HBD,no,N,73,,207236,4803,HEM
74,,SING,CBD,HBDA,no,N,74,,207236,4803,HEM
75,,DOUB,CGD,O1D,no,N,75,,207236,4803,HEM
76,,SING,CGD,O2D,no,N,76,,207236,4803,HEM
77,,SING,O2A,H2A,no,N,77,,207236,4803,HEM
78,,SING,O2D,H2D,no,N,78,,207236,4803,HEM
79,,SING,FE,NA,no,N,79,,207236,4803,HEM
80,,SING,FE,NB,no,N,80,,207236,4803,HEM
81,,SING,FE,NC,no,N,81,,207236,4803,HEM
82,,SING,FE,ND,no,N,82,,207236,4803,HEM
1,,SING,FE,NA,,,,,207258,4804,HEM_red
2,,SING,FE,NB,,,,,207258,4804,HEM_red
3,,SING,FE,NC,,,,,207258,4804,HEM_red
4,,SING,FE,ND,,,,,207258,4804,HEM_red
5,,DOUB,CHA,C1A,,,,,207258,4804,HEM_red
6,,SING,CHA,C4D,,,,,207258,4804,HEM_red
7,,SING,CHA,HHA,,,,,207258,4804,HEM_red
8,,DOUB,CHB,C4A,,,,,207258,4804,HEM_red
9,,SING,CHB,C1B,,,,,207258,4804,HEM_red
10,,SING,CHB,HHB,,,,,207258,4804,HEM_red
11,,DOUB,CHC,C4B,,,,,207258,4804,HEM_red
12,,SING,CHC,C1C,,,,,207258,4804,HEM_red
13,,SING,CHC,HHC,,,,,207258,4804,HEM_red
14,,SING,CHD,C4C,,,,,207258,4804,HEM_red
15,,DOUB,CHD,C1D,,,,,207258,4804,HEM_red
16,,SING,CHD,HHD,,,,,207258,4804,HEM_red
17,,SING,NA,C1A,,,,,207258,4804,HEM_red
18,,SING,NA,C4A,,,,,207258,4804,HEM_red
19,,SING,C1A,C2A,,,,,207258,4804,HEM_red
20,,DOUB,C2A,C3A,,,,,207258,4804,HEM_red
21,,SING,C2A,CAA,,,,,207258,4804,HEM_red
22,,SING,C3A,C4A,,,,,207258,4804,HEM_red
23,,SING,C3A,CMA,,,,,207258,4804,HEM_red
24,,SING,CMA,1HMA,,,,,207258,4804,HEM_red
25,,SING,CMA,2HMA,,,,,207258,4804,HEM_red
26,,SING,CMA,3HMA,,,,,207258,4804,HEM_red
27,,SING,CAA,CBA,,,,,207258,4804,HEM_red
28,,SING,CAA,1HAA,,,,,207258,4804,HEM_red
29,,SING,CAA,2HAA,,,,,207258,4804,HEM_red
30,,SING,CBA,CGA,,,,,207258,4804,HEM_red
31,,SING,CBA,1HBA,,,,,207258,4804,HEM_red
32,,SING,CBA,2HBA,,,,,207258,4804,HEM_red
33,,DOUB,CGA,O1A,,,,,207258,4804,HEM_red
34,,SING,CGA,O2A,,,,,207258,4804,HEM_red
35,,SING,O2A,H2A,,,,,207258,4804,HEM_red
36,,DOUB,NB,C1B,,,,,207258,4804,HEM_red
37,,SING,NB,C4B,,,,,207258,4804,HEM_red
38,,SING,C1B,C2B,,,,,207258,4804,HEM_red
39,,DOUB,C2B,C3B,,,,,207258,4804,HEM_red
40,,SING,C2B,CMB,,,,,207258,4804,HEM_red
41,,SING,C3B,C4B,,,,,207258,4804,HEM_red
42,,SING,C3B,CAB,,,,,207258,4804,HEM_red
43,,SING,CMB,1HMB,,,,,207258,4804,HEM_red
44,,SING,CMB,2HMB,,,,,207258,4804,HEM_red
45,,SING,CMB,3HMB,,,,,207258,4804,HEM_red
46,,DOUB,CAB,CBB,,,,,207258,4804,HEM_red
47,,SING,CAB,HAB,,,,,207258,4804,HEM_red
48,,SING,CBB,1HBB,,,,,207258,4804,HEM_red
49,,SING,CBB,2HBB,,,,,207258,4804,HEM_red
50,,SING,NC,C1C,,,,,207258,4804,HEM_red
51,,SING,NC,C4C,,,,,207258,4804,HEM_red
52,,DOUB,C1C,C2C,,,,,207258,4804,HEM_red
53,,SING,C2C,C3C,,,,,207258,4804,HEM_red
54,,SING,C2C,CMC,,,,,207258,4804,HEM_red
55,,DOUB,C3C,C4C,,,,,207258,4804,HEM_red
56,,SING,C3C,CAC,,,,,207258,4804,HEM_red
57,,SING,CMC,1HMC,,,,,207258,4804,HEM_red
58,,SING,CMC,2HMC,,,,,207258,4804,HEM_red
59,,SING,CMC,3HMC,,,,,207258,4804,HEM_red
60,,DOUB,CAC,CBC,,,,,207258,4804,HEM_red
61,,SING,CAC,HAC,,,,,207258,4804,HEM_red
62,,SING,CBC,1HBC,,,,,207258,4804,HEM_red
63,,SING,CBC,2HBC,,,,,207258,4804,HEM_red
64,,SING,ND,C1D,,,,,207258,4804,HEM_red
65,,DOUB,ND,C4D,,,,,207258,4804,HEM_red
66,,SING,C1D,C2D,,,,,207258,4804,HEM_red
67,,DOUB,C2D,C3D,,,,,207258,4804,HEM_red
68,,SING,C2D,CMD,,,,,207258,4804,HEM_red
69,,SING,C3D,C4D,,,,,207258,4804,HEM_red
70,,SING,C3D,CAD,,,,,207258,4804,HEM_red
71,,SING,CMD,1HMD,,,,,207258,4804,HEM_red
72,,SING,CMD,2HMD,,,,,207258,4804,HEM_red
73,,SING,CMD,3HMD,,,,,207258,4804,HEM_red
74,,SING,CAD,CBD,,,,,207258,4804,HEM_red
75,,SING,CAD,1HAD,,,,,207258,4804,HEM_red
76,,SING,CAD,2HAD,,,,,207258,4804,HEM_red
77,,SING,CBD,CGD,,,,,207258,4804,HEM_red
78,,SING,CBD,1HBD,,,,,207258,4804,HEM_red
79,,SING,CBD,2HBD,,,,,207258,4804,HEM_red
80,,DOUB,CGD,O1D,,,,,207258,4804,HEM_red
81,,SING,CGD,O2D,,,,,207258,4804,HEM_red
82,,SING,O2D,H2D,,,,,207258,4804,HEM_red
1,,SING,CHA,C1A,yes,N,1,,207282,4805,HEM
2,,DOUB,CHA,C4D,yes,N,2,,207282,4805,HEM
3,,SING,CHA,HHA,no,N,3,,207282,4805,HEM
4,,SING,CHB,C4A,yes,N,4,,207282,4805,HEM
5,,DOUB,CHB,C1B,yes,N,5,,207282,4805,HEM
6,,SING,CHB,HHB,no,N,6,,207282,4805,HEM
7,,SING,CHC,C4B,yes,N,7,,207282,4805,HEM
8,,DOUB,CHC,C1C,yes,N,8,,207282,4805,HEM
9,,SING,CHC,HHC,no,N,9,,207282,4805,HEM
10,,DOUB,CHD,C4C,yes,N,10,,207282,4805,HEM
11,,SING,CHD,C1D,yes,N,11,,207282,4805,HEM
12,,SING,CHD,HHD,no,N,12,,207282,4805,HEM
13,,DOUB,C1A,C2A,yes,N,13,,207282,4805,HEM
14,,SING,C1A,NA,yes,N,14,,207282,4805,HEM
15,,SING,C2A,C3A,yes,N,15,,207282,4805,HEM
16,,SING,C2A,CAA,no,N,16,,207282,4805,HEM
17,,DOUB,C3A,C4A,yes,N,17,,207282,4805,HEM
18,,SING,C3A,CMA,no,N,18,,207282,4805,HEM
19,,SING,C4A,NA,yes,N,19,,207282,4805,HEM
20,,SING,CMA,HMA,no,N,20,,207282,4805,HEM
21,,SING,CMA,HMAA,no,N,21,,207282,4805,HEM
22,,SING,CMA,HMAB,no,N,22,,207282,4805,HEM
23,,SING,CAA,CBA,no,N,23,,207282,4805,HEM
24,,SING,CAA,HAA,no,N,24,,207282,4805,HEM
25,,SING,CAA,HAAA,no,N,25,,207282,4805,HEM
26,,SING,CBA,CGA,no,N,26,,207282,4805,HEM
27,,SING,CBA,HBA,no,N,27,,207282,4805,HEM
28,,SING,CBA,HBAA,no,N,28,,207282,4805,HEM
29,,DOUB,CGA,O1A,no,N,29,,207282,4805,HEM
30,,SING,CGA,O2A,no,N,30,,207282,4805,HEM
31,,SING,C1B,C2B,no,N,31,,207282,4805,HEM
32,,SING,C1B,NB,yes,N,32,,207282,4805,HEM
33,,DOUB,C2B,C3B,yes,N,33,,207282,4805,HEM
34,,SING,C2B,CMB,yes,N,34,,207282,4805,HEM
35,,SING,C3B,C4B,no,N,35,,207282,4805,HEM
36,,SING,C3B,CAB,yes,N,36,,207282,4805,HEM
37,,DOUB,C4B,NB,no,N,37,,207282,4805,HEM
38,,SING,CMB,HMB,yes,N,38,,207282,4805,HEM
39,,SING,CMB,HMBA,no,N,39,,207282,4805,HEM
40,,SING,CMB,HMBB,no,N,40,,207282,4805,HEM
41,,DOUB,CAB,CBB,no,N,41,,207282,4805,HEM
42,,SING,CAB,HAB,no,N,42,,207282,4805,HEM
43,,SING,CBB,HBB,no,N,43,,207282,4805,HEM
44,,SING,CBB,HBBA,no,N,44,,207282,4805,HEM
45,,SING,C1C,C2C,no,N,45,,207282,4805,HEM
46,,SING,C1C,NC,yes,N,46,,207282,4805,HEM
47,,DOUB,C2C,C3C,yes,N,47,,207282,4805,HEM
48,,SING,C2C,CMC,yes,N,48,,207282,4805,HEM
49,,SING,C3C,C4C,no,N,49,,207282,4805,HEM
50,,SING,C3C,CAC,yes,N,50,,207282,4805,HEM
51,,SING,C4C,NC,no,N,51,,207282,4805,HEM
52,,SING,CMC,HMC,yes,N,52,,207282,4805,HEM
53,,SING,CMC,HMCA,no,N,53,,207282,4805,HEM
54,,SING,CMC,HMCB,no,N,54,,207282,4805,HEM
55,,DOUB,CAC,CBC,no,N,55,,207282,4805,HEM
56,,SING,CAC,HAC,no,N,56,,207282,4805,HEM
57,,SING,CBC,HBC,no,N,57,,207282,4805,HEM
58,,SING,CBC,HBCA,no,N,58,,207282,4805,HEM
59,,SING,C1D,C2D,no,N,59,,207282,4805,HEM
60,,DOUB,C1D,ND,yes,N,60,,207282,4805,HEM
61,,DOUB,C2D,C3D,yes,N,61,,207282,4805,HEM
62,,SING,C2D,CMD,yes,N,62,,207282,4805,HEM
63,,SING,C3D,C4D,no,N,63,,207282,4805,HEM
64,,SING,C3D,CAD,yes,N,64,,207282,4805,HEM
65,,SING,C4D,ND,no,N,65,,207282,4805,HEM
66,,SING,CMD,HMD,yes,N,66,,207282,4805,HEM
67,,SING,CMD,HMDA,no,N,67,,207282,4805,HEM
68,,SING,CMD,HMDB,no,N,68,,207282,4805,HEM
69,,SING,CAD,CBD,no,N,69,,207282,4805,HEM
70,,SING,CAD,HAD,no,N,70,,207282,4805,HEM
71,,SING,CAD,HADA,no,N,71,,207282,4805,HEM
72,,SING,CBD,CGD,no,N,72,,207282,4805,HEM
73,,SING,CBD,HBD,no,N,73,,207282,4805,HEM
74,,SING,CBD,HBDA,no,N,74,,207282,4805,HEM
75,,DOUB,CGD,O1D,no,N,75,,207282,4805,HEM
76,,SING,CGD,O2D,no,N,76,,207282,4805,HEM
77,,SING,O2A,H2A,no,N,77,,207282,4805,HEM
78,,SING,O2D,H2D,no,N,78,,207282,4805,HEM
79,,SING,FE,NA,no,N,79,,207282,4805,HEM
80,,SING,FE,NB,no,N,80,,207282,4805,HEM
81,,SING,FE,NC,no,N,81,,207282,4805,HEM
82,,SING,FE,ND,no,N,82,,207282,4805,HEM
1,,SING,FE,NA,no,N,1,,207283,4805,HEC
2,,SING,FE,NB,no,N,2,,207283,4805,HEC
3,,SING,FE,NC,no,N,3,,207283,4805,HEC
4,,SING,FE,ND,no,N,4,,207283,4805,HEC
5,,DOUB,CHA,C1A,no,N,5,,207283,4805,HEC
6,,SING,CHA,C4D,no,N,6,,207283,4805,HEC
7,,SING,CHA,HHA,no,N,7,,207283,4805,HEC
8,,DOUB,CHB,C4A,no,N,8,,207283,4805,HEC
9,,SING,CHB,C1B,no,N,9,,207283,4805,HEC
10,,SING,CHB,HHB,no,N,10,,207283,4805,HEC
11,,DOUB,CHC,C4B,no,N,11,,207283,4805,HEC
12,,SING,CHC,C1C,no,N,12,,207283,4805,HEC
13,,SING,CHC,HHC,no,N,13,,207283,4805,HEC
14,,DOUB,CHD,C4C,no,N,14,,207283,4805,HEC
15,,SING,CHD,C1D,no,N,15,,207283,4805,HEC
16,,SING,CHD,HHD,no,N,16,,207283,4805,HEC
17,,SING,NA,C1A,yes,N,17,,207283,4805,HEC
18,,SING,NA,C4A,yes,N,18,,207283,4805,HEC
19,,SING,C1A,C2A,yes,N,19,,207283,4805,HEC
20,,DOUB,C2A,C3A,yes,N,20,,207283,4805,HEC
21,,SING,C2A,CAA,no,N,21,,207283,4805,HEC
22,,SING,C3A,C4A,yes,N,22,,207283,4805,HEC
23,,SING,C3A,CMA,no,N,23,,207283,4805,HEC
24,,SING,CMA,HMA1,no,N,24,,207283,4805,HEC
25,,SING,CMA,HMA2,no,N,25,,207283,4805,HEC
26,,SING,CMA,HMA3,no,N,26,,207283,4805,HEC
27,,SING,CAA,CBA,no,N,27,,207283,4805,HEC
28,,SING,CAA,HAA1,no,N,28,,207283,4805,HEC
29,,SING,CAA,HAA2,no,N,29,,207283,4805,HEC
30,,SING,CBA,CGA,no,N,30,,207283,4805,HEC
31,,SING,CBA,HBA1,no,N,31,,207283,4805,HEC
32,,SING,CBA,HBA2,no,N,32,,207283,4805,HEC
33,,DOUB,CGA,O1A,no,N,33,,207283,4805,HEC
34,,SING,CGA,O2A,no,N,34,,207283,4805,HEC
35,,SING,O2A,H2A,no,N,35,,207283,4805,HEC
36,,SING,NB,C1B,yes,N,36,,207283,4805,HEC
37,,SING,NB,C4B,yes,N,37,,207283,4805,HEC
38,,DOUB,C1B,C2B,yes,N,38,,207283,4805,HEC
39,,SING,C2B,C3B,yes,N,39,,207283,4805,HEC
40,,SING,C2B,CMB,no,N,40,,207283,4805,HEC
41,,SING,C3B,C4B,yes,N,41,,207283,4805,HEC
42,,DOUB,C3B,CAB,no,E,42,,207283,4805,HEC
43,,SING,CMB,HMB1,no,N,43,,207283,4805,HEC
44,,SING,CMB,HMB2,no,N,44,,207283,4805,HEC
45,,SING,CMB,HMB3,no,N,45,,207283,4805,HEC
46,,SING,CAB,CBB,no,N,46,,207283,4805,HEC
47,,SING,CAB,HAB,no,N,47,,207283,4805,HEC
48,,SING,CBB,HBB1,no,N,48,,207283,4805,HEC
49,,SING,CBB,HBB2,no,N,49,,207283,4805,HEC
50,,SING,CBB,HBB3,no,N,50,,207283,4805,HEC
51,,SING,NC,C1C,yes,N,51,,207283,4805,HEC
52,,SING,NC,C4C,yes,N,52,,207283,4805,HEC
53,,DOUB,C1C,C2C,yes,N,53,,207283,4805,HEC
54,,SING,C2C,C3C,yes,N,54,,207283,4805,HEC
55,,SING,C2C,CMC,no,N,55,,207283,4805,HEC
56,,SING,C3C,C4C,yes,N,56,,207283,4805,HEC
57,,DOUB,C3C,CAC,no,E,57,,207283,4805,HEC
58,,SING,CMC,HMC1,no,N,58,,207283,4805,HEC
59,,SING,CMC,HMC2,no,N,59,,207283,4805,HEC
60,,SING,CMC,HMC3,no,N,60,,207283,4805,HEC
61,,SING,CAC,CBC,no,N,61,,207283,4805,HEC
62,,SING,CAC,HAC,no,N,62,,207283,4805,HEC
63,,SING,CBC,HBC1,no,N,63,,207283,4805,HEC
64,,SING,CBC,HBC2,no,N,64,,207283,4805,HEC
65,,SING,CBC,HBC3,no,N,65,,207283,4805,HEC
66,,SING,ND,C1D,yes,N,66,,207283,4805,HEC
67,,SING,ND,C4D,yes,N,67,,207283,4805,HEC
68,,DOUB,C1D,C2D,yes,N,68,,207283,4805,HEC
69,,SING,C2D,C3D,yes,N,69,,207283,4805,HEC
70,,SING,C2D,CMD,no,N,70,,207283,4805,HEC
71,,DOUB,C3D,C4D,yes,N,71,,207283,4805,HEC
72,,SING,C3D,CAD,no,N,72,,207283,4805,HEC
73,,SING,CMD,HMD1,no,N,73,,207283,4805,HEC
74,,SING,CMD,HMD2,no,N,74,,207283,4805,HEC
75,,SING,CMD,HMD3,no,N,75,,207283,4805,HEC
76,,SING,CAD,CBD,no,N,76,,207283,4805,HEC
77,,SING,CAD,HAD1,no,N,77,,207283,4805,HEC
78,,SING,CAD,HAD2,no,N,78,,207283,4805,HEC
79,,SING,CBD,CGD,no,N,79,,207283,4805,HEC
80,,SING,CBD,HBD1,no,N,80,,207283,4805,HEC
81,,SING,CBD,HBD2,no,N,81,,207283,4805,HEC
82,,DOUB,CGD,O1D,no,N,82,,207283,4805,HEC
83,,SING,CGD,O2D,no,N,83,,207283,4805,HEC
84,,SING,O2D,H2D,no,N,84,,207283,4805,HEC
1,,SING,CHA,C1A,yes,N,1,,207305,4806,HEM
2,,DOUB,CHA,C4D,yes,N,2,,207305,4806,HEM
3,,SING,CHA,HHA,no,N,3,,207305,4806,HEM
4,,SING,CHB,C4A,yes,N,4,,207305,4806,HEM
5,,DOUB,CHB,C1B,yes,N,5,,207305,4806,HEM
6,,SING,CHB,HHB,no,N,6,,207305,4806,HEM
7,,SING,CHC,C4B,yes,N,7,,207305,4806,HEM
8,,DOUB,CHC,C1C,yes,N,8,,207305,4806,HEM
9,,SING,CHC,HHC,no,N,9,,207305,4806,HEM
10,,DOUB,CHD,C4C,yes,N,10,,207305,4806,HEM
11,,SING,CHD,C1D,yes,N,11,,207305,4806,HEM
12,,SING,CHD,HHD,no,N,12,,207305,4806,HEM
13,,DOUB,C1A,C2A,yes,N,13,,207305,4806,HEM
14,,SING,C1A,NA,yes,N,14,,207305,4806,HEM
15,,SING,C2A,C3A,yes,N,15,,207305,4806,HEM
16,,SING,C2A,CAA,no,N,16,,207305,4806,HEM
17,,DOUB,C3A,C4A,yes,N,17,,207305,4806,HEM
18,,SING,C3A,CMA,no,N,18,,207305,4806,HEM
19,,SING,C4A,NA,yes,N,19,,207305,4806,HEM
20,,SING,CMA,HMA,no,N,20,,207305,4806,HEM
21,,SING,CMA,HMAA,no,N,21,,207305,4806,HEM
22,,SING,CMA,HMAB,no,N,22,,207305,4806,HEM
23,,SING,CAA,CBA,no,N,23,,207305,4806,HEM
24,,SING,CAA,HAA,no,N,24,,207305,4806,HEM
25,,SING,CAA,HAAA,no,N,25,,207305,4806,HEM
26,,SING,CBA,CGA,no,N,26,,207305,4806,HEM
27,,SING,CBA,HBA,no,N,27,,207305,4806,HEM
28,,SING,CBA,HBAA,no,N,28,,207305,4806,HEM
29,,DOUB,CGA,O1A,no,N,29,,207305,4806,HEM
30,,SING,CGA,O2A,no,N,30,,207305,4806,HEM
31,,SING,C1B,C2B,no,N,31,,207305,4806,HEM
32,,SING,C1B,NB,yes,N,32,,207305,4806,HEM
33,,DOUB,C2B,C3B,yes,N,33,,207305,4806,HEM
34,,SING,C2B,CMB,yes,N,34,,207305,4806,HEM
35,,SING,C3B,C4B,no,N,35,,207305,4806,HEM
36,,SING,C3B,CAB,yes,N,36,,207305,4806,HEM
37,,DOUB,C4B,NB,no,N,37,,207305,4806,HEM
38,,SING,CMB,HMB,yes,N,38,,207305,4806,HEM
39,,SING,CMB,HMBA,no,N,39,,207305,4806,HEM
40,,SING,CMB,HMBB,no,N,40,,207305,4806,HEM
41,,DOUB,CAB,CBB,no,N,41,,207305,4806,HEM
42,,SING,CAB,HAB,no,N,42,,207305,4806,HEM
43,,SING,CBB,HBB,no,N,43,,207305,4806,HEM
44,,SING,CBB,HBBA,no,N,44,,207305,4806,HEM
45,,SING,C1C,C2C,no,N,45,,207305,4806,HEM
46,,SING,C1C,NC,yes,N,46,,207305,4806,HEM
47,,DOUB,C2C,C3C,yes,N,47,,207305,4806,HEM
48,,SING,C2C,CMC,yes,N,48,,207305,4806,HEM
49,,SING,C3C,C4C,no,N,49,,207305,4806,HEM
50,,SING,C3C,CAC,yes,N,50,,207305,4806,HEM
51,,SING,C4C,NC,no,N,51,,207305,4806,HEM
52,,SING,CMC,HMC,yes,N,52,,207305,4806,HEM
53,,SING,CMC,HMCA,no,N,53,,207305,4806,HEM
54,,SING,CMC,HMCB,no,N,54,,207305,4806,HEM
55,,DOUB,CAC,CBC,no,N,55,,207305,4806,HEM
56,,SING,CAC,HAC,no,N,56,,207305,4806,HEM
57,,SING,CBC,HBC,no,N,57,,207305,4806,HEM
58,,SING,CBC,HBCA,no,N,58,,207305,4806,HEM
59,,SING,C1D,C2D,no,N,59,,207305,4806,HEM
60,,DOUB,C1D,ND,yes,N,60,,207305,4806,HEM
61,,DOUB,C2D,C3D,yes,N,61,,207305,4806,HEM
62,,SING,C2D,CMD,yes,N,62,,207305,4806,HEM
63,,SING,C3D,C4D,no,N,63,,207305,4806,HEM
64,,SING,C3D,CAD,yes,N,64,,207305,4806,HEM
65,,SING,C4D,ND,no,N,65,,207305,4806,HEM
66,,SING,CMD,HMD,yes,N,66,,207305,4806,HEM
67,,SING,CMD,HMDA,no,N,67,,207305,4806,HEM
68,,SING,CMD,HMDB,no,N,68,,207305,4806,HEM
69,,SING,CAD,CBD,no,N,69,,207305,4806,HEM
70,,SING,CAD,HAD,no,N,70,,207305,4806,HEM
71,,SING,CAD,HADA,no,N,71,,207305,4806,HEM
72,,SING,CBD,CGD,no,N,72,,207305,4806,HEM
73,,SING,CBD,HBD,no,N,73,,207305,4806,HEM
74,,SING,CBD,HBDA,no,N,74,,207305,4806,HEM
75,,DOUB,CGD,O1D,no,N,75,,207305,4806,HEM
76,,SING,CGD,O2D,no,N,76,,207305,4806,HEM
77,,SING,O2A,H2A,no,N,77,,207305,4806,HEM
78,,SING,O2D,H2D,no,N,78,,207305,4806,HEM
79,,SING,FE,NA,no,N,79,,207305,4806,HEM
80,,SING,FE,NB,no,N,80,,207305,4806,HEM
81,,SING,FE,NC,no,N,81,,207305,4806,HEM
82,,SING,FE,ND,no,N,82,,207305,4806,HEM
1,,SING,CHA,C1A,yes,N,1,,207327,4807,HEM
2,,DOUB,CHA,C4D,yes,N,2,,207327,4807,HEM
3,,SING,CHA,HHA,no,N,3,,207327,4807,HEM
4,,SING,CHB,C4A,yes,N,4,,207327,4807,HEM
5,,DOUB,CHB,C1B,yes,N,5,,207327,4807,HEM
6,,SING,CHB,HHB,no,N,6,,207327,4807,HEM
7,,SING,CHC,C4B,yes,N,7,,207327,4807,HEM
8,,DOUB,CHC,C1C,yes,N,8,,207327,4807,HEM
9,,SING,CHC,HHC,no,N,9,,207327,4807,HEM
10,,DOUB,CHD,C4C,yes,N,10,,207327,4807,HEM
11,,SING,CHD,C1D,yes,N,11,,207327,4807,HEM
12,,SING,CHD,HHD,no,N,12,,207327,4807,HEM
13,,DOUB,C1A,C2A,yes,N,13,,207327,4807,HEM
14,,SING,C1A,NA,yes,N,14,,207327,4807,HEM
15,,SING,C2A,C3A,yes,N,15,,207327,4807,HEM
16,,SING,C2A,CAA,no,N,16,,207327,4807,HEM
17,,DOUB,C3A,C4A,yes,N,17,,207327,4807,HEM
18,,SING,C3A,CMA,no,N,18,,207327,4807,HEM
19,,SING,C4A,NA,yes,N,19,,207327,4807,HEM
20,,SING,CMA,HMA,no,N,20,,207327,4807,HEM
21,,SING,CMA,HMAA,no,N,21,,207327,4807,HEM
22,,SING,CMA,HMAB,no,N,22,,207327,4807,HEM
23,,SING,CAA,CBA,no,N,23,,207327,4807,HEM
24,,SING,CAA,HAA,no,N,24,,207327,4807,HEM
25,,SING,CAA,HAAA,no,N,25,,207327,4807,HEM
26,,SING,CBA,CGA,no,N,26,,207327,4807,HEM
27,,SING,CBA,HBA,no,N,27,,207327,4807,HEM
28,,SING,CBA,HBAA,no,N,28,,207327,4807,HEM
29,,DOUB,CGA,O1A,no,N,29,,207327,4807,HEM
30,,SING,CGA,O2A,no,N,30,,207327,4807,HEM
31,,SING,C1B,C2B,no,N,31,,207327,4807,HEM
32,,SING,C1B,NB,yes,N,32,,207327,4807,HEM
33,,DOUB,C2B,C3B,yes,N,33,,207327,4807,HEM
34,,SING,C2B,CMB,yes,N,34,,207327,4807,HEM
35,,SING,C3B,C4B,no,N,35,,207327,4807,HEM
36,,SING,C3B,CAB,yes,N,36,,207327,4807,HEM
37,,DOUB,C4B,NB,no,N,37,,207327,4807,HEM
38,,SING,CMB,HMB,yes,N,38,,207327,4807,HEM
39,,SING,CMB,HMBA,no,N,39,,207327,4807,HEM
40,,SING,CMB,HMBB,no,N,40,,207327,4807,HEM
41,,DOUB,CAB,CBB,no,N,41,,207327,4807,HEM
42,,SING,CAB,HAB,no,N,42,,207327,4807,HEM
43,,SING,CBB,HBB,no,N,43,,207327,4807,HEM
44,,SING,CBB,HBBA,no,N,44,,207327,4807,HEM
45,,SING,C1C,C2C,no,N,45,,207327,4807,HEM
46,,SING,C1C,NC,yes,N,46,,207327,4807,HEM
47,,DOUB,C2C,C3C,yes,N,47,,207327,4807,HEM
48,,SING,C2C,CMC,yes,N,48,,207327,4807,HEM
49,,SING,C3C,C4C,no,N,49,,207327,4807,HEM
50,,SING,C3C,CAC,yes,N,50,,207327,4807,HEM
51,,SING,C4C,NC,no,N,51,,207327,4807,HEM
52,,SING,CMC,HMC,yes,N,52,,207327,4807,HEM
53,,SING,CMC,HMCA,no,N,53,,207327,4807,HEM
54,,SING,CMC,HMCB,no,N,54,,207327,4807,HEM
55,,DOUB,CAC,CBC,no,N,55,,207327,4807,HEM
56,,SING,CAC,HAC,no,N,56,,207327,4807,HEM
57,,SING,CBC,HBC,no,N,57,,207327,4807,HEM
58,,SING,CBC,HBCA,no,N,58,,207327,4807,HEM
59,,SING,C1D,C2D,no,N,59,,207327,4807,HEM
60,,DOUB,C1D,ND,yes,N,60,,207327,4807,HEM
61,,DOUB,C2D,C3D,yes,N,61,,207327,4807,HEM
62,,SING,C2D,CMD,yes,N,62,,207327,4807,HEM
63,,SING,C3D,C4D,no,N,63,,207327,4807,HEM
64,,SING,C3D,CAD,yes,N,64,,207327,4807,HEM
65,,SING,C4D,ND,no,N,65,,207327,4807,HEM
66,,SING,CMD,HMD,yes,N,66,,207327,4807,HEM
67,,SING,CMD,HMDA,no,N,67,,207327,4807,HEM
68,,SING,CMD,HMDB,no,N,68,,207327,4807,HEM
69,,SING,CAD,CBD,no,N,69,,207327,4807,HEM
70,,SING,CAD,HAD,no,N,70,,207327,4807,HEM
71,,SING,CAD,HADA,no,N,71,,207327,4807,HEM
72,,SING,CBD,CGD,no,N,72,,207327,4807,HEM
73,,SING,CBD,HBD,no,N,73,,207327,4807,HEM
74,,SING,CBD,HBDA,no,N,74,,207327,4807,HEM
75,,DOUB,CGD,O1D,no,N,75,,207327,4807,HEM
76,,SING,CGD,O2D,no,N,76,,207327,4807,HEM
77,,SING,O2A,H2A,no,N,77,,207327,4807,HEM
78,,SING,O2D,H2D,no,N,78,,207327,4807,HEM
79,,SING,FE,NA,no,N,79,,207327,4807,HEM
80,,SING,FE,NB,no,N,80,,207327,4807,HEM
81,,SING,FE,NC,no,N,81,,207327,4807,HEM
82,,SING,FE,ND,no,N,82,,207327,4807,HEM
1,,SING,CHA,C1A,yes,N,1,,207351,4808,HEM
2,,DOUB,CHA,C4D,yes,N,2,,207351,4808,HEM
3,,SING,CHA,HHA,no,N,3,,207351,4808,HEM
4,,SING,CHB,C4A,yes,N,4,,207351,4808,HEM
5,,DOUB,CHB,C1B,yes,N,5,,207351,4808,HEM
6,,SING,CHB,HHB,no,N,6,,207351,4808,HEM
7,,SING,CHC,C4B,yes,N,7,,207351,4808,HEM
8,,DOUB,CHC,C1C,yes,N,8,,207351,4808,HEM
9,,SING,CHC,HHC,no,N,9,,207351,4808,HEM
10,,DOUB,CHD,C4C,yes,N,10,,207351,4808,HEM
11,,SING,CHD,C1D,yes,N,11,,207351,4808,HEM
12,,SING,CHD,HHD,no,N,12,,207351,4808,HEM
13,,DOUB,C1A,C2A,yes,N,13,,207351,4808,HEM
14,,SING,C1A,NA,yes,N,14,,207351,4808,HEM
15,,SING,C2A,C3A,yes,N,15,,207351,4808,HEM
16,,SING,C2A,CAA,no,N,16,,207351,4808,HEM
17,,DOUB,C3A,C4A,yes,N,17,,207351,4808,HEM
18,,SING,C3A,CMA,no,N,18,,207351,4808,HEM
19,,SING,C4A,NA,yes,N,19,,207351,4808,HEM
20,,SING,CMA,HMA,no,N,20,,207351,4808,HEM
21,,SING,CMA,HMAA,no,N,21,,207351,4808,HEM
22,,SING,CMA,HMAB,no,N,22,,207351,4808,HEM
23,,SING,CAA,CBA,no,N,23,,207351,4808,HEM
24,,SING,CAA,HAA,no,N,24,,207351,4808,HEM
25,,SING,CAA,HAAA,no,N,25,,207351,4808,HEM
26,,SING,CBA,CGA,no,N,26,,207351,4808,HEM
27,,SING,CBA,HBA,no,N,27,,207351,4808,HEM
28,,SING,CBA,HBAA,no,N,28,,207351,4808,HEM
29,,DOUB,CGA,O1A,no,N,29,,207351,4808,HEM
30,,SING,CGA,O2A,no,N,30,,207351,4808,HEM
31,,SING,C1B,C2B,no,N,31,,207351,4808,HEM
32,,SING,C1B,NB,yes,N,32,,207351,4808,HEM
33,,DOUB,C2B,C3B,yes,N,33,,207351,4808,HEM
34,,SING,C2B,CMB,yes,N,34,,207351,4808,HEM
35,,SING,C3B,C4B,no,N,35,,207351,4808,HEM
36,,SING,C3B,CAB,yes,N,36,,207351,4808,HEM
37,,DOUB,C4B,NB,no,N,37,,207351,4808,HEM
38,,SING,CMB,HMB,yes,N,38,,207351,4808,HEM
39,,SING,CMB,HMBA,no,N,39,,207351,4808,HEM
40,,SING,CMB,HMBB,no,N,40,,207351,4808,HEM
41,,DOUB,CAB,CBB,no,N,41,,207351,4808,HEM
42,,SING,CAB,HAB,no,N,42,,207351,4808,HEM
43,,SING,CBB,HBB,no,N,43,,207351,4808,HEM
44,,SING,CBB,HBBA,no,N,44,,207351,4808,HEM
45,,SING,C1C,C2C,no,N,45,,207351,4808,HEM
46,,SING,C1C,NC,yes,N,46,,207351,4808,HEM
47,,DOUB,C2C,C3C,yes,N,47,,207351,4808,HEM
48,,SING,C2C,CMC,yes,N,48,,207351,4808,HEM
49,,SING,C3C,C4C,no,N,49,,207351,4808,HEM
50,,SING,C3C,CAC,yes,N,50,,207351,4808,HEM
51,,SING,C4C,NC,no,N,51,,207351,4808,HEM
52,,SING,CMC,HMC,yes,N,52,,207351,4808,HEM
53,,SING,CMC,HMCA,no,N,53,,207351,4808,HEM
54,,SING,CMC,HMCB,no,N,54,,207351,4808,HEM
55,,DOUB,CAC,CBC,no,N,55,,207351,4808,HEM
56,,SING,CAC,HAC,no,N,56,,207351,4808,HEM
57,,SING,CBC,HBC,no,N,57,,207351,4808,HEM
58,,SING,CBC,HBCA,no,N,58,,207351,4808,HEM
59,,SING,C1D,C2D,no,N,59,,207351,4808,HEM
60,,DOUB,C1D,ND,yes,N,60,,207351,4808,HEM
61,,DOUB,C2D,C3D,yes,N,61,,207351,4808,HEM
62,,SING,C2D,CMD,yes,N,62,,207351,4808,HEM
63,,SING,C3D,C4D,no,N,63,,207351,4808,HEM
64,,SING,C3D,CAD,yes,N,64,,207351,4808,HEM
65,,SING,C4D,ND,no,N,65,,207351,4808,HEM
66,,SING,CMD,HMD,yes,N,66,,207351,4808,HEM
67,,SING,CMD,HMDA,no,N,67,,207351,4808,HEM
68,,SING,CMD,HMDB,no,N,68,,207351,4808,HEM
69,,SING,CAD,CBD,no,N,69,,207351,4808,HEM
70,,SING,CAD,HAD,no,N,70,,207351,4808,HEM
71,,SING,CAD,HADA,no,N,71,,207351,4808,HEM
72,,SING,CBD,CGD,no,N,72,,207351,4808,HEM
73,,SING,CBD,HBD,no,N,73,,207351,4808,HEM
74,,SING,CBD,HBDA,no,N,74,,207351,4808,HEM
75,,DOUB,CGD,O1D,no,N,75,,207351,4808,HEM
76,,SING,CGD,O2D,no,N,76,,207351,4808,HEM
77,,SING,O2A,H2A,no,N,77,,207351,4808,HEM
78,,SING,O2D,H2D,no,N,78,,207351,4808,HEM
79,,SING,FE,NA,no,N,79,,207351,4808,HEM
80,,SING,FE,NB,no,N,80,,207351,4808,HEM
81,,SING,FE,NC,no,N,81,,207351,4808,HEM
82,,SING,FE,ND,no,N,82,,207351,4808,HEM
1,,SING,FE,NA,no,N,1,,207352,4808,HEC
2,,SING,FE,NB,no,N,2,,207352,4808,HEC
3,,SING,FE,NC,no,N,3,,207352,4808,HEC
4,,SING,FE,ND,no,N,4,,207352,4808,HEC
5,,DOUB,CHA,C1A,no,N,5,,207352,4808,HEC
6,,SING,CHA,C4D,no,N,6,,207352,4808,HEC
7,,SING,CHA,HHA,no,N,7,,207352,4808,HEC
8,,DOUB,CHB,C4A,no,N,8,,207352,4808,HEC
9,,SING,CHB,C1B,no,N,9,,207352,4808,HEC
10,,SING,CHB,HHB,no,N,10,,207352,4808,HEC
11,,DOUB,CHC,C4B,no,N,11,,207352,4808,HEC
12,,SING,CHC,C1C,no,N,12,,207352,4808,HEC
13,,SING,CHC,HHC,no,N,13,,207352,4808,HEC
14,,DOUB,CHD,C4C,no,N,14,,207352,4808,HEC
15,,SING,CHD,C1D,no,N,15,,207352,4808,HEC
16,,SING,CHD,HHD,no,N,16,,207352,4808,HEC
17,,SING,NA,C1A,yes,N,17,,207352,4808,HEC
18,,SING,NA,C4A,yes,N,18,,207352,4808,HEC
19,,SING,C1A,C2A,yes,N,19,,207352,4808,HEC
20,,DOUB,C2A,C3A,yes,N,20,,207352,4808,HEC
21,,SING,C2A,CAA,no,N,21,,207352,4808,HEC
22,,SING,C3A,C4A,yes,N,22,,207352,4808,HEC
23,,SING,C3A,CMA,no,N,23,,207352,4808,HEC
24,,SING,CMA,HMA1,no,N,24,,207352,4808,HEC
25,,SING,CMA,HMA2,no,N,25,,207352,4808,HEC
26,,SING,CMA,HMA3,no,N,26,,207352,4808,HEC
27,,SING,CAA,CBA,no,N,27,,207352,4808,HEC
28,,SING,CAA,HAA1,no,N,28,,207352,4808,HEC
29,,SING,CAA,HAA2,no,N,29,,207352,4808,HEC
30,,SING,CBA,CGA,no,N,30,,207352,4808,HEC
31,,SING,CBA,HBA1,no,N,31,,207352,4808,HEC
32,,SING,CBA,HBA2,no,N,32,,207352,4808,HEC
33,,DOUB,CGA,O1A,no,N,33,,207352,4808,HEC
34,,SING,CGA,O2A,no,N,34,,207352,4808,HEC
35,,SING,O2A,H2A,no,N,35,,207352,4808,HEC
36,,SING,NB,C1B,yes,N,36,,207352,4808,HEC
37,,SING,NB,C4B,yes,N,37,,207352,4808,HEC
38,,DOUB,C1B,C2B,yes,N,38,,207352,4808,HEC
39,,SING,C2B,C3B,yes,N,39,,207352,4808,HEC
40,,SING,C2B,CMB,no,N,40,,207352,4808,HEC
41,,SING,C3B,C4B,yes,N,41,,207352,4808,HEC
42,,DOUB,C3B,CAB,no,E,42,,207352,4808,HEC
43,,SING,CMB,HMB1,no,N,43,,207352,4808,HEC
44,,SING,CMB,HMB2,no,N,44,,207352,4808,HEC
45,,SING,CMB,HMB3,no,N,45,,207352,4808,HEC
46,,SING,CAB,CBB,no,N,46,,207352,4808,HEC
47,,SING,CAB,HAB,no,N,47,,207352,4808,HEC
48,,SING,CBB,HBB1,no,N,48,,207352,4808,HEC
49,,SING,CBB,HBB2,no,N,49,,207352,4808,HEC
50,,SING,CBB,HBB3,no,N,50,,207352,4808,HEC
51,,SING,NC,C1C,yes,N,51,,207352,4808,HEC
52,,SING,NC,C4C,yes,N,52,,207352,4808,HEC
53,,DOUB,C1C,C2C,yes,N,53,,207352,4808,HEC
54,,SING,C2C,C3C,yes,N,54,,207352,4808,HEC
55,,SING,C2C,CMC,no,N,55,,207352,4808,HEC
56,,SING,C3C,C4C,yes,N,56,,207352,4808,HEC
57,,DOUB,C3C,CAC,no,E,57,,207352,4808,HEC
58,,SING,CMC,HMC1,no,N,58,,207352,4808,HEC
59,,SING,CMC,HMC2,no,N,59,,207352,4808,HEC
60,,SING,CMC,HMC3,no,N,60,,207352,4808,HEC
61,,SING,CAC,CBC,no,N,61,,207352,4808,HEC
62,,SING,CAC,HAC,no,N,62,,207352,4808,HEC
63,,SING,CBC,HBC1,no,N,63,,207352,4808,HEC
64,,SING,CBC,HBC2,no,N,64,,207352,4808,HEC
65,,SING,CBC,HBC3,no,N,65,,207352,4808,HEC
66,,SING,ND,C1D,yes,N,66,,207352,4808,HEC
67,,SING,ND,C4D,yes,N,67,,207352,4808,HEC
68,,DOUB,C1D,C2D,yes,N,68,,207352,4808,HEC
69,,SING,C2D,C3D,yes,N,69,,207352,4808,HEC
70,,SING,C2D,CMD,no,N,70,,207352,4808,HEC
71,,DOUB,C3D,C4D,yes,N,71,,207352,4808,HEC
72,,SING,C3D,CAD,no,N,72,,207352,4808,HEC
73,,SING,CMD,HMD1,no,N,73,,207352,4808,HEC
74,,SING,CMD,HMD2,no,N,74,,207352,4808,HEC
75,,SING,CMD,HMD3,no,N,75,,207352,4808,HEC
76,,SING,CAD,CBD,no,N,76,,207352,4808,HEC
77,,SING,CAD,HAD1,no,N,77,,207352,4808,HEC
78,,SING,CAD,HAD2,no,N,78,,207352,4808,HEC
79,,SING,CBD,CGD,no,N,79,,207352,4808,HEC
80,,SING,CBD,HBD1,no,N,80,,207352,4808,HEC
81,,SING,CBD,HBD2,no,N,81,,207352,4808,HEC
82,,DOUB,CGD,O1D,no,N,82,,207352,4808,HEC
83,,SING,CGD,O2D,no,N,83,,207352,4808,HEC
84,,SING,O2D,H2D,no,N,84,,207352,4808,HEC
1,,SING,CHA,C1A,yes,N,1,,207376,4809,HEM
2,,DOUB,CHA,C4D,yes,N,2,,207376,4809,HEM
3,,SING,CHA,HHA,no,N,3,,207376,4809,HEM
4,,SING,CHB,C4A,yes,N,4,,207376,4809,HEM
5,,DOUB,CHB,C1B,yes,N,5,,207376,4809,HEM
6,,SING,CHB,HHB,no,N,6,,207376,4809,HEM
7,,SING,CHC,C4B,yes,N,7,,207376,4809,HEM
8,,DOUB,CHC,C1C,yes,N,8,,207376,4809,HEM
9,,SING,CHC,HHC,no,N,9,,207376,4809,HEM
10,,DOUB,CHD,C4C,yes,N,10,,207376,4809,HEM
11,,SING,CHD,C1D,yes,N,11,,207376,4809,HEM
12,,SING,CHD,HHD,no,N,12,,207376,4809,HEM
13,,DOUB,C1A,C2A,yes,N,13,,207376,4809,HEM
14,,SING,C1A,NA,yes,N,14,,207376,4809,HEM
15,,SING,C2A,C3A,yes,N,15,,207376,4809,HEM
16,,SING,C2A,CAA,no,N,16,,207376,4809,HEM
17,,DOUB,C3A,C4A,yes,N,17,,207376,4809,HEM
18,,SING,C3A,CMA,no,N,18,,207376,4809,HEM
19,,SING,C4A,NA,yes,N,19,,207376,4809,HEM
20,,SING,CMA,HMA,no,N,20,,207376,4809,HEM
21,,SING,CMA,HMAA,no,N,21,,207376,4809,HEM
22,,SING,CMA,HMAB,no,N,22,,207376,4809,HEM
23,,SING,CAA,CBA,no,N,23,,207376,4809,HEM
24,,SING,CAA,HAA,no,N,24,,207376,4809,HEM
25,,SING,CAA,HAAA,no,N,25,,207376,4809,HEM
26,,SING,CBA,CGA,no,N,26,,207376,4809,HEM
27,,SING,CBA,HBA,no,N,27,,207376,4809,HEM
28,,SING,CBA,HBAA,no,N,28,,207376,4809,HEM
29,,DOUB,CGA,O1A,no,N,29,,207376,4809,HEM
30,,SING,CGA,O2A,no,N,30,,207376,4809,HEM
31,,SING,C1B,C2B,no,N,31,,207376,4809,HEM
32,,SING,C1B,NB,yes,N,32,,207376,4809,HEM
33,,DOUB,C2B,C3B,yes,N,33,,207376,4809,HEM
34,,SING,C2B,CMB,yes,N,34,,207376,4809,HEM
35,,SING,C3B,C4B,no,N,35,,207376,4809,HEM
36,,SING,C3B,CAB,yes,N,36,,207376,4809,HEM
37,,DOUB,C4B,NB,no,N,37,,207376,4809,HEM
38,,SING,CMB,HMB,yes,N,38,,207376,4809,HEM
39,,SING,CMB,HMBA,no,N,39,,207376,4809,HEM
40,,SING,CMB,HMBB,no,N,40,,207376,4809,HEM
41,,DOUB,CAB,CBB,no,N,41,,207376,4809,HEM
42,,SING,CAB,HAB,no,N,42,,207376,4809,HEM
43,,SING,CBB,HBB,no,N,43,,207376,4809,HEM
44,,SING,CBB,HBBA,no,N,44,,207376,4809,HEM
45,,SING,C1C,C2C,no,N,45,,207376,4809,HEM
46,,SING,C1C,NC,yes,N,46,,207376,4809,HEM
47,,DOUB,C2C,C3C,yes,N,47,,207376,4809,HEM
48,,SING,C2C,CMC,yes,N,48,,207376,4809,HEM
49,,SING,C3C,C4C,no,N,49,,207376,4809,HEM
50,,SING,C3C,CAC,yes,N,50,,207376,4809,HEM
51,,SING,C4C,NC,no,N,51,,207376,4809,HEM
52,,SING,CMC,HMC,yes,N,52,,207376,4809,HEM
53,,SING,CMC,HMCA,no,N,53,,207376,4809,HEM
54,,SING,CMC,HMCB,no,N,54,,207376,4809,HEM
55,,DOUB,CAC,CBC,no,N,55,,207376,4809,HEM
56,,SING,CAC,HAC,no,N,56,,207376,4809,HEM
57,,SING,CBC,HBC,no,N,57,,207376,4809,HEM
58,,SING,CBC,HBCA,no,N,58,,207376,4809,HEM
59,,SING,C1D,C2D,no,N,59,,207376,4809,HEM
60,,DOUB,C1D,ND,yes,N,60,,207376,4809,HEM
61,,DOUB,C2D,C3D,yes,N,61,,207376,4809,HEM
62,,SING,C2D,CMD,yes,N,62,,207376,4809,HEM
63,,SING,C3D,C4D,no,N,63,,207376,4809,HEM
64,,SING,C3D,CAD,yes,N,64,,207376,4809,HEM
65,,SING,C4D,ND,no,N,65,,207376,4809,HEM
66,,SING,CMD,HMD,yes,N,66,,207376,4809,HEM
67,,SING,CMD,HMDA,no,N,67,,207376,4809,HEM
68,,SING,CMD,HMDB,no,N,68,,207376,4809,HEM
69,,SING,CAD,CBD,no,N,69,,207376,4809,HEM
70,,SING,CAD,HAD,no,N,70,,207376,4809,HEM
71,,SING,CAD,HADA,no,N,71,,207376,4809,HEM
72,,SING,CBD,CGD,no,N,72,,207376,4809,HEM
73,,SING,CBD,HBD,no,N,73,,207376,4809,HEM
74,,SING,CBD,HBDA,no,N,74,,207376,4809,HEM
75,,DOUB,CGD,O1D,no,N,75,,207376,4809,HEM
76,,SING,CGD,O2D,no,N,76,,207376,4809,HEM
77,,SING,O2A,H2A,no,N,77,,207376,4809,HEM
78,,SING,O2D,H2D,no,N,78,,207376,4809,HEM
79,,SING,FE,NA,no,N,79,,207376,4809,HEM
80,,SING,FE,NB,no,N,80,,207376,4809,HEM
81,,SING,FE,NC,no,N,81,,207376,4809,HEM
82,,SING,FE,ND,no,N,82,,207376,4809,HEM
1,,SING,FE,NA,no,N,1,,207377,4809,HEC
2,,SING,FE,NB,no,N,2,,207377,4809,HEC
3,,SING,FE,NC,no,N,3,,207377,4809,HEC
4,,SING,FE,ND,no,N,4,,207377,4809,HEC
5,,DOUB,CHA,C1A,no,N,5,,207377,4809,HEC
6,,SING,CHA,C4D,no,N,6,,207377,4809,HEC
7,,SING,CHA,HHA,no,N,7,,207377,4809,HEC
8,,DOUB,CHB,C4A,no,N,8,,207377,4809,HEC
9,,SING,CHB,C1B,no,N,9,,207377,4809,HEC
10,,SING,CHB,HHB,no,N,10,,207377,4809,HEC
11,,DOUB,CHC,C4B,no,N,11,,207377,4809,HEC
12,,SING,CHC,C1C,no,N,12,,207377,4809,HEC
13,,SING,CHC,HHC,no,N,13,,207377,4809,HEC
14,,DOUB,CHD,C4C,no,N,14,,207377,4809,HEC
15,,SING,CHD,C1D,no,N,15,,207377,4809,HEC
16,,SING,CHD,HHD,no,N,16,,207377,4809,HEC
17,,SING,NA,C1A,yes,N,17,,207377,4809,HEC
18,,SING,NA,C4A,yes,N,18,,207377,4809,HEC
19,,SING,C1A,C2A,yes,N,19,,207377,4809,HEC
20,,DOUB,C2A,C3A,yes,N,20,,207377,4809,HEC
21,,SING,C2A,CAA,no,N,21,,207377,4809,HEC
22,,SING,C3A,C4A,yes,N,22,,207377,4809,HEC
23,,SING,C3A,CMA,no,N,23,,207377,4809,HEC
24,,SING,CMA,HMA1,no,N,24,,207377,4809,HEC
25,,SING,CMA,HMA2,no,N,25,,207377,4809,HEC
26,,SING,CMA,HMA3,no,N,26,,207377,4809,HEC
27,,SING,CAA,CBA,no,N,27,,207377,4809,HEC
28,,SING,CAA,HAA1,no,N,28,,207377,4809,HEC
29,,SING,CAA,HAA2,no,N,29,,207377,4809,HEC
30,,SING,CBA,CGA,no,N,30,,207377,4809,HEC
31,,SING,CBA,HBA1,no,N,31,,207377,4809,HEC
32,,SING,CBA,HBA2,no,N,32,,207377,4809,HEC
33,,DOUB,CGA,O1A,no,N,33,,207377,4809,HEC
34,,SING,CGA,O2A,no,N,34,,207377,4809,HEC
35,,SING,O2A,H2A,no,N,35,,207377,4809,HEC
36,,SING,NB,C1B,yes,N,36,,207377,4809,HEC
37,,SING,NB,C4B,yes,N,37,,207377,4809,HEC
38,,DOUB,C1B,C2B,yes,N,38,,207377,4809,HEC
39,,SING,C2B,C3B,yes,N,39,,207377,4809,HEC
40,,SING,C2B,CMB,no,N,40,,207377,4809,HEC
41,,SING,C3B,C4B,yes,N,41,,207377,4809,HEC
42,,DOUB,C3B,CAB,no,E,42,,207377,4809,HEC
43,,SING,CMB,HMB1,no,N,43,,207377,4809,HEC
44,,SING,CMB,HMB2,no,N,44,,207377,4809,HEC
45,,SING,CMB,HMB3,no,N,45,,207377,4809,HEC
46,,SING,CAB,CBB,no,N,46,,207377,4809,HEC
47,,SING,CAB,HAB,no,N,47,,207377,4809,HEC
48,,SING,CBB,HBB1,no,N,48,,207377,4809,HEC
49,,SING,CBB,HBB2,no,N,49,,207377,4809,HEC
50,,SING,CBB,HBB3,no,N,50,,207377,4809,HEC
51,,SING,NC,C1C,yes,N,51,,207377,4809,HEC
52,,SING,NC,C4C,yes,N,52,,207377,4809,HEC
53,,DOUB,C1C,C2C,yes,N,53,,207377,4809,HEC
54,,SING,C2C,C3C,yes,N,54,,207377,4809,HEC
55,,SING,C2C,CMC,no,N,55,,207377,4809,HEC
56,,SING,C3C,C4C,yes,N,56,,207377,4809,HEC
57,,DOUB,C3C,CAC,no,E,57,,207377,4809,HEC
58,,SING,CMC,HMC1,no,N,58,,207377,4809,HEC
59,,SING,CMC,HMC2,no,N,59,,207377,4809,HEC
60,,SING,CMC,HMC3,no,N,60,,207377,4809,HEC
61,,SING,CAC,CBC,no,N,61,,207377,4809,HEC
62,,SING,CAC,HAC,no,N,62,,207377,4809,HEC
63,,SING,CBC,HBC1,no,N,63,,207377,4809,HEC
64,,SING,CBC,HBC2,no,N,64,,207377,4809,HEC
65,,SING,CBC,HBC3,no,N,65,,207377,4809,HEC
66,,SING,ND,C1D,yes,N,66,,207377,4809,HEC
67,,SING,ND,C4D,yes,N,67,,207377,4809,HEC
68,,DOUB,C1D,C2D,yes,N,68,,207377,4809,HEC
69,,SING,C2D,C3D,yes,N,69,,207377,4809,HEC
70,,SING,C2D,CMD,no,N,70,,207377,4809,HEC
71,,DOUB,C3D,C4D,yes,N,71,,207377,4809,HEC
72,,SING,C3D,CAD,no,N,72,,207377,4809,HEC
73,,SING,CMD,HMD1,no,N,73,,207377,4809,HEC
74,,SING,CMD,HMD2,no,N,74,,207377,4809,HEC
75,,SING,CMD,HMD3,no,N,75,,207377,4809,HEC
76,,SING,CAD,CBD,no,N,76,,207377,4809,HEC
77,,SING,CAD,HAD1,no,N,77,,207377,4809,HEC
78,,SING,CAD,HAD2,no,N,78,,207377,4809,HEC
79,,SING,CBD,CGD,no,N,79,,207377,4809,HEC
80,,SING,CBD,HBD1,no,N,80,,207377,4809,HEC
81,,SING,CBD,HBD2,no,N,81,,207377,4809,HEC
82,,DOUB,CGD,O1D,no,N,82,,207377,4809,HEC
83,,SING,CGD,O2D,no,N,83,,207377,4809,HEC
84,,SING,O2D,H2D,no,N,84,,207377,4809,HEC
1,,SING,CHA,C1A,yes,N,1,,207414,4810,HEM
2,,DOUB,CHA,C4D,yes,N,2,,207414,4810,HEM
3,,SING,CHA,HHA,no,N,3,,207414,4810,HEM
4,,SING,CHB,C4A,yes,N,4,,207414,4810,HEM
5,,DOUB,CHB,C1B,yes,N,5,,207414,4810,HEM
6,,SING,CHB,HHB,no,N,6,,207414,4810,HEM
7,,SING,CHC,C4B,yes,N,7,,207414,4810,HEM
8,,DOUB,CHC,C1C,yes,N,8,,207414,4810,HEM
9,,SING,CHC,HHC,no,N,9,,207414,4810,HEM
10,,DOUB,CHD,C4C,yes,N,10,,207414,4810,HEM
11,,SING,CHD,C1D,yes,N,11,,207414,4810,HEM
12,,SING,CHD,HHD,no,N,12,,207414,4810,HEM
13,,DOUB,C1A,C2A,yes,N,13,,207414,4810,HEM
14,,SING,C1A,NA,yes,N,14,,207414,4810,HEM
15,,SING,C2A,C3A,yes,N,15,,207414,4810,HEM
16,,SING,C2A,CAA,no,N,16,,207414,4810,HEM
17,,DOUB,C3A,C4A,yes,N,17,,207414,4810,HEM
18,,SING,C3A,CMA,no,N,18,,207414,4810,HEM
19,,SING,C4A,NA,yes,N,19,,207414,4810,HEM
20,,SING,CMA,HMA,no,N,20,,207414,4810,HEM
21,,SING,CMA,HMAA,no,N,21,,207414,4810,HEM
22,,SING,CMA,HMAB,no,N,22,,207414,4810,HEM
23,,SING,CAA,CBA,no,N,23,,207414,4810,HEM
24,,SING,CAA,HAA,no,N,24,,207414,4810,HEM
25,,SING,CAA,HAAA,no,N,25,,207414,4810,HEM
26,,SING,CBA,CGA,no,N,26,,207414,4810,HEM
27,,SING,CBA,HBA,no,N,27,,207414,4810,HEM
28,,SING,CBA,HBAA,no,N,28,,207414,4810,HEM
29,,DOUB,CGA,O1A,no,N,29,,207414,4810,HEM
30,,SING,CGA,O2A,no,N,30,,207414,4810,HEM
31,,SING,C1B,C2B,no,N,31,,207414,4810,HEM
32,,SING,C1B,NB,yes,N,32,,207414,4810,HEM
33,,DOUB,C2B,C3B,yes,N,33,,207414,4810,HEM
34,,SING,C2B,CMB,yes,N,34,,207414,4810,HEM
35,,SING,C3B,C4B,no,N,35,,207414,4810,HEM
36,,SING,C3B,CAB,yes,N,36,,207414,4810,HEM
37,,DOUB,C4B,NB,no,N,37,,207414,4810,HEM
38,,SING,CMB,HMB,yes,N,38,,207414,4810,HEM
39,,SING,CMB,HMBA,no,N,39,,207414,4810,HEM
40,,SING,CMB,HMBB,no,N,40,,207414,4810,HEM
41,,DOUB,CAB,CBB,no,N,41,,207414,4810,HEM
42,,SING,CAB,HAB,no,N,42,,207414,4810,HEM
43,,SING,CBB,HBB,no,N,43,,207414,4810,HEM
44,,SING,CBB,HBBA,no,N,44,,207414,4810,HEM
45,,SING,C1C,C2C,no,N,45,,207414,4810,HEM
46,,SING,C1C,NC,yes,N,46,,207414,4810,HEM
47,,DOUB,C2C,C3C,yes,N,47,,207414,4810,HEM
48,,SING,C2C,CMC,yes,N,48,,207414,4810,HEM
49,,SING,C3C,C4C,no,N,49,,207414,4810,HEM
50,,SING,C3C,CAC,yes,N,50,,207414,4810,HEM
51,,SING,C4C,NC,no,N,51,,207414,4810,HEM
52,,SING,CMC,HMC,yes,N,52,,207414,4810,HEM
53,,SING,CMC,HMCA,no,N,53,,207414,4810,HEM
54,,SING,CMC,HMCB,no,N,54,,207414,4810,HEM
55,,DOUB,CAC,CBC,no,N,55,,207414,4810,HEM
56,,SING,CAC,HAC,no,N,56,,207414,4810,HEM
57,,SING,CBC,HBC,no,N,57,,207414,4810,HEM
58,,SING,CBC,HBCA,no,N,58,,207414,4810,HEM
59,,SING,C1D,C2D,no,N,59,,207414,4810,HEM
60,,DOUB,C1D,ND,yes,N,60,,207414,4810,HEM
61,,DOUB,C2D,C3D,yes,N,61,,207414,4810,HEM
62,,SING,C2D,CMD,yes,N,62,,207414,4810,HEM
63,,SING,C3D,C4D,no,N,63,,207414,4810,HEM
64,,SING,C3D,CAD,yes,N,64,,207414,4810,HEM
65,,SING,C4D,ND,no,N,65,,207414,4810,HEM
66,,SING,CMD,HMD,yes,N,66,,207414,4810,HEM
67,,SING,CMD,HMDA,no,N,67,,207414,4810,HEM
68,,SING,CMD,HMDB,no,N,68,,207414,4810,HEM
69,,SING,CAD,CBD,no,N,69,,207414,4810,HEM
70,,SING,CAD,HAD,no,N,70,,207414,4810,HEM
71,,SING,CAD,HADA,no,N,71,,207414,4810,HEM
72,,SING,CBD,CGD,no,N,72,,207414,4810,HEM
73,,SING,CBD,HBD,no,N,73,,207414,4810,HEM
74,,SING,CBD,HBDA,no,N,74,,207414,4810,HEM
75,,DOUB,CGD,O1D,no,N,75,,207414,4810,HEM
76,,SING,CGD,O2D,no,N,76,,207414,4810,HEM
77,,SING,O2A,H2A,no,N,77,,207414,4810,HEM
78,,SING,O2D,H2D,no,N,78,,207414,4810,HEM
79,,SING,FE,NA,no,N,79,,207414,4810,HEM
80,,SING,FE,NB,no,N,80,,207414,4810,HEM
81,,SING,FE,NC,no,N,81,,207414,4810,HEM
82,,SING,FE,ND,no,N,82,,207414,4810,HEM
1,,SING,FE,NA,no,N,1,,207415,4810,HEC
2,,SING,FE,NB,no,N,2,,207415,4810,HEC
3,,SING,FE,NC,no,N,3,,207415,4810,HEC
4,,SING,FE,ND,no,N,4,,207415,4810,HEC
5,,DOUB,CHA,C1A,no,N,5,,207415,4810,HEC
6,,SING,CHA,C4D,no,N,6,,207415,4810,HEC
7,,SING,CHA,HHA,no,N,7,,207415,4810,HEC
8,,DOUB,CHB,C4A,no,N,8,,207415,4810,HEC
9,,SING,CHB,C1B,no,N,9,,207415,4810,HEC
10,,SING,CHB,HHB,no,N,10,,207415,4810,HEC
11,,DOUB,CHC,C4B,no,N,11,,207415,4810,HEC
12,,SING,CHC,C1C,no,N,12,,207415,4810,HEC
13,,SING,CHC,HHC,no,N,13,,207415,4810,HEC
14,,DOUB,CHD,C4C,no,N,14,,207415,4810,HEC
15,,SING,CHD,C1D,no,N,15,,207415,4810,HEC
16,,SING,CHD,HHD,no,N,16,,207415,4810,HEC
17,,SING,NA,C1A,yes,N,17,,207415,4810,HEC
18,,SING,NA,C4A,yes,N,18,,207415,4810,HEC
19,,SING,C1A,C2A,yes,N,19,,207415,4810,HEC
20,,DOUB,C2A,C3A,yes,N,20,,207415,4810,HEC
21,,SING,C2A,CAA,no,N,21,,207415,4810,HEC
22,,SING,C3A,C4A,yes,N,22,,207415,4810,HEC
23,,SING,C3A,CMA,no,N,23,,207415,4810,HEC
24,,SING,CMA,HMA1,no,N,24,,207415,4810,HEC
25,,SING,CMA,HMA2,no,N,25,,207415,4810,HEC
26,,SING,CMA,HMA3,no,N,26,,207415,4810,HEC
27,,SING,CAA,CBA,no,N,27,,207415,4810,HEC
28,,SING,CAA,HAA1,no,N,28,,207415,4810,HEC
29,,SING,CAA,HAA2,no,N,29,,207415,4810,HEC
30,,SING,CBA,CGA,no,N,30,,207415,4810,HEC
31,,SING,CBA,HBA1,no,N,31,,207415,4810,HEC
32,,SING,CBA,HBA2,no,N,32,,207415,4810,HEC
33,,DOUB,CGA,O1A,no,N,33,,207415,4810,HEC
34,,SING,CGA,O2A,no,N,34,,207415,4810,HEC
35,,SING,O2A,H2A,no,N,35,,207415,4810,HEC
36,,SING,NB,C1B,yes,N,36,,207415,4810,HEC
37,,SING,NB,C4B,yes,N,37,,207415,4810,HEC
38,,DOUB,C1B,C2B,yes,N,38,,207415,4810,HEC
39,,SING,C2B,C3B,yes,N,39,,207415,4810,HEC
40,,SING,C2B,CMB,no,N,40,,207415,4810,HEC
41,,SING,C3B,C4B,yes,N,41,,207415,4810,HEC
42,,DOUB,C3B,CAB,no,E,42,,207415,4810,HEC
43,,SING,CMB,HMB1,no,N,43,,207415,4810,HEC
44,,SING,CMB,HMB2,no,N,44,,207415,4810,HEC
45,,SING,CMB,HMB3,no,N,45,,207415,4810,HEC
46,,SING,CAB,CBB,no,N,46,,207415,4810,HEC
47,,SING,CAB,HAB,no,N,47,,207415,4810,HEC
48,,SING,CBB,HBB1,no,N,48,,207415,4810,HEC
49,,SING,CBB,HBB2,no,N,49,,207415,4810,HEC
50,,SING,CBB,HBB3,no,N,50,,207415,4810,HEC
51,,SING,NC,C1C,yes,N,51,,207415,4810,HEC
52,,SING,NC,C4C,yes,N,52,,207415,4810,HEC
53,,DOUB,C1C,C2C,yes,N,53,,207415,4810,HEC
54,,SING,C2C,C3C,yes,N,54,,207415,4810,HEC
55,,SING,C2C,CMC,no,N,55,,207415,4810,HEC
56,,SING,C3C,C4C,yes,N,56,,207415,4810,HEC
57,,DOUB,C3C,CAC,no,E,57,,207415,4810,HEC
58,,SING,CMC,HMC1,no,N,58,,207415,4810,HEC
59,,SING,CMC,HMC2,no,N,59,,207415,4810,HEC
60,,SING,CMC,HMC3,no,N,60,,207415,4810,HEC
61,,SING,CAC,CBC,no,N,61,,207415,4810,HEC
62,,SING,CAC,HAC,no,N,62,,207415,4810,HEC
63,,SING,CBC,HBC1,no,N,63,,207415,4810,HEC
64,,SING,CBC,HBC2,no,N,64,,207415,4810,HEC
65,,SING,CBC,HBC3,no,N,65,,207415,4810,HEC
66,,SING,ND,C1D,yes,N,66,,207415,4810,HEC
67,,SING,ND,C4D,yes,N,67,,207415,4810,HEC
68,,DOUB,C1D,C2D,yes,N,68,,207415,4810,HEC
69,,SING,C2D,C3D,yes,N,69,,207415,4810,HEC
70,,SING,C2D,CMD,no,N,70,,207415,4810,HEC
71,,DOUB,C3D,C4D,yes,N,71,,207415,4810,HEC
72,,SING,C3D,CAD,no,N,72,,207415,4810,HEC
73,,SING,CMD,HMD1,no,N,73,,207415,4810,HEC
74,,SING,CMD,HMD2,no,N,74,,207415,4810,HEC
75,,SING,CMD,HMD3,no,N,75,,207415,4810,HEC
76,,SING,CAD,CBD,no,N,76,,207415,4810,HEC
77,,SING,CAD,HAD1,no,N,77,,207415,4810,HEC
78,,SING,CAD,HAD2,no,N,78,,207415,4810,HEC
79,,SING,CBD,CGD,no,N,79,,207415,4810,HEC
80,,SING,CBD,HBD1,no,N,80,,207415,4810,HEC
81,,SING,CBD,HBD2,no,N,81,,207415,4810,HEC
82,,DOUB,CGD,O1D,no,N,82,,207415,4810,HEC
83,,SING,CGD,O2D,no,N,83,,207415,4810,HEC
84,,SING,O2D,H2D,no,N,84,,207415,4810,HEC
1,,SING,FE,NA,,,,,207929,4837,HEC_ox
2,,SING,FE,NB,,,,,207929,4837,HEC_ox
3,,SING,FE,NC,,,,,207929,4837,HEC_ox
4,,SING,FE,ND,,,,,207929,4837,HEC_ox
5,,DOUB,CHA,C1A,,,,,207929,4837,HEC_ox
6,,SING,CHA,C4D,,,,,207929,4837,HEC_ox
7,,SING,CHA,HHA,,,,,207929,4837,HEC_ox
8,,DOUB,CHB,C4A,,,,,207929,4837,HEC_ox
9,,SING,CHB,C1B,,,,,207929,4837,HEC_ox
10,,SING,CHB,HHB,,,,,207929,4837,HEC_ox
11,,DOUB,CHC,C4B,,,,,207929,4837,HEC_ox
12,,SING,CHC,C1C,,,,,207929,4837,HEC_ox
13,,SING,CHC,HHC,,,,,207929,4837,HEC_ox
14,,SING,CHD,C4C,,,,,207929,4837,HEC_ox
15,,DOUB,CHD,C1D,,,,,207929,4837,HEC_ox
16,,SING,CHD,HHD,,,,,207929,4837,HEC_ox
17,,SING,NA,C1A,,,,,207929,4837,HEC_ox
18,,SING,NA,C4A,,,,,207929,4837,HEC_ox
19,,SING,C1A,C2A,,,,,207929,4837,HEC_ox
20,,DOUB,C2A,C3A,,,,,207929,4837,HEC_ox
21,,SING,C2A,CAA,,,,,207929,4837,HEC_ox
22,,SING,C3A,C4A,,,,,207929,4837,HEC_ox
23,,SING,C3A,CMA,,,,,207929,4837,HEC_ox
24,,SING,CMA,1HMA,,,,,207929,4837,HEC_ox
25,,SING,CMA,2HMA,,,,,207929,4837,HEC_ox
26,,SING,CMA,3HMA,,,,,207929,4837,HEC_ox
27,,SING,CAA,CBA,,,,,207929,4837,HEC_ox
28,,SING,CAA,1HAA,,,,,207929,4837,HEC_ox
29,,SING,CAA,2HAA,,,,,207929,4837,HEC_ox
30,,SING,CBA,CGA,,,,,207929,4837,HEC_ox
31,,SING,CBA,1HBA,,,,,207929,4837,HEC_ox
32,,SING,CBA,2HBA,,,,,207929,4837,HEC_ox
33,,DOUB,CGA,O1A,,,,,207929,4837,HEC_ox
34,,SING,CGA,O2A,,,,,207929,4837,HEC_ox
35,,SING,O2A,H2A,,,,,207929,4837,HEC_ox
36,,DOUB,NB,C1B,,,,,207929,4837,HEC_ox
37,,SING,NB,C4B,,,,,207929,4837,HEC_ox
38,,SING,C1B,C2B,,,,,207929,4837,HEC_ox
39,,DOUB,C2B,C3B,,,,,207929,4837,HEC_ox
40,,SING,C2B,CMB,,,,,207929,4837,HEC_ox
41,,SING,C3B,C4B,,,,,207929,4837,HEC_ox
42,,SING,C3B,CAB,,,,,207929,4837,HEC_ox
43,,SING,CMB,1HMB,,,,,207929,4837,HEC_ox
44,,SING,CMB,2HMB,,,,,207929,4837,HEC_ox
45,,SING,CMB,3HMB,,,,,207929,4837,HEC_ox
46,,SING,CAB,CBB,,,,,207929,4837,HEC_ox
47,,SING,CAB,HAB,,,,,207929,4837,HEC_ox
48,,SING,CBB,1HBB,,,,,207929,4837,HEC_ox
49,,SING,CBB,2HBB,,,,,207929,4837,HEC_ox
50,,SING,NC,C1C,,,,,207929,4837,HEC_ox
51,,SING,NC,C4C,,,,,207929,4837,HEC_ox
52,,DOUB,C1C,C2C,,,,,207929,4837,HEC_ox
53,,SING,C2C,C3C,,,,,207929,4837,HEC_ox
54,,SING,C2C,CMC,,,,,207929,4837,HEC_ox
55,,DOUB,C3C,C4C,,,,,207929,4837,HEC_ox
56,,SING,C3C,CAC,,,,,207929,4837,HEC_ox
57,,SING,CMC,1HMC,,,,,207929,4837,HEC_ox
58,,SING,CMC,2HMC,,,,,207929,4837,HEC_ox
59,,SING,CMC,3HMC,,,,,207929,4837,HEC_ox
60,,SING,CAC,CBC,,,,,207929,4837,HEC_ox
61,,SING,CAC,HAC,,,,,207929,4837,HEC_ox
62,,SING,CBC,1HBC,,,,,207929,4837,HEC_ox
63,,SING,CBC,2HBC,,,,,207929,4837,HEC_ox
64,,SING,ND,C1D,,,,,207929,4837,HEC_ox
65,,DOUB,ND,C4D,,,,,207929,4837,HEC_ox
66,,SING,C1D,C2D,,,,,207929,4837,HEC_ox
67,,DOUB,C2D,C3D,,,,,207929,4837,HEC_ox
68,,SING,C2D,CMD,,,,,207929,4837,HEC_ox
69,,SING,C3D,C4D,,,,,207929,4837,HEC_ox
70,,SING,C3D,CAD,,,,,207929,4837,HEC_ox
71,,SING,CMD,1HMD,,,,,207929,4837,HEC_ox
72,,SING,CMD,2HMD,,,,,207929,4837,HEC_ox
73,,SING,CMD,3HMD,,,,,207929,4837,HEC_ox
74,,SING,CAD,CBD,,,,,207929,4837,HEC_ox
75,,SING,CAD,1HAD,,,,,207929,4837,HEC_ox
76,,SING,CAD,2HAD,,,,,207929,4837,HEC_ox
77,,SING,CBD,CGD,,,,,207929,4837,HEC_ox
78,,SING,CBD,1HBD,,,,,207929,4837,HEC_ox
79,,SING,CBD,2HBD,,,,,207929,4837,HEC_ox
80,,DOUB,CGD,O1D,,,,,207929,4837,HEC_ox
81,,SING,CGD,O2D,,,,,207929,4837,HEC_ox
82,,SING,O2D,H2D,,,,,207929,4837,HEC_ox
1,,SING,N,HN1,no,N,1,,208041,4842,NH2
2,,SING,N,HN2,no,N,2,,208041,4842,NH2
1,,SING,N,HN1,no,N,1,,208093,4845,NH2
2,,SING,N,HN2,no,N,2,,208093,4845,NH2
1,,SING,N,HN1,no,N,1,,208108,4846,NH2
2,,SING,N,HN2,no,N,2,,208108,4846,NH2
1,,SING,N,HN1,no,N,1,,208123,4847,NH2
2,,SING,N,HN2,no,N,2,,208123,4847,NH2
1,,DOUB,C1,C2,no,N,1,,208139,4848,S3P
2,,SING,C1,C6,no,N,2,,208139,4848,S3P
3,,SING,C1,C7,no,N,3,,208139,4848,S3P
4,,SING,C2,C3,no,N,4,,208139,4848,S3P
5,,SING,C2,H2,no,N,5,,208139,4848,S3P
6,,SING,C3,C4,no,N,6,,208139,4848,S3P
7,,SING,C3,O1,no,N,7,,208139,4848,S3P
8,,SING,C3,H3,no,N,8,,208139,4848,S3P
9,,SING,C4,C5,no,N,9,,208139,4848,S3P
10,,SING,C4,O2,no,N,10,,208139,4848,S3P
11,,SING,C4,H4,no,N,11,,208139,4848,S3P
12,,SING,C5,C6,no,N,12,,208139,4848,S3P
13,,SING,C5,O3,no,N,13,,208139,4848,S3P
14,,SING,C5,H5,no,N,14,,208139,4848,S3P
15,,SING,C6,H61,no,N,15,,208139,4848,S3P
16,,SING,C6,H62,no,N,16,,208139,4848,S3P
17,,SING,C7,O4,no,N,17,,208139,4848,S3P
18,,DOUB,C7,O5,no,N,18,,208139,4848,S3P
19,,SING,O1,P1,no,N,19,,208139,4848,S3P
20,,SING,O2,HO2,no,N,20,,208139,4848,S3P
21,,SING,O3,HO3,no,N,21,,208139,4848,S3P
22,,SING,O4,HO4,no,N,22,,208139,4848,S3P
23,,DOUB,P1,O6,no,N,23,,208139,4848,S3P
24,,SING,P1,O7,no,N,24,,208139,4848,S3P
25,,SING,P1,O8,no,N,25,,208139,4848,S3P
26,,SING,O7,HO7,no,N,26,,208139,4848,S3P
27,,SING,O8,HO8,no,N,27,,208139,4848,S3P
1,,SING,N,HN1,no,N,1,,208246,4853,NH2
2,,SING,N,HN2,no,N,2,,208246,4853,NH2
1,,SING,N,CA,no,N,1,,208427,4862,AIB
2,,SING,N,H,no,N,2,,208427,4862,AIB
3,,SING,N,H2,no,N,3,,208427,4862,AIB
4,,SING,CA,C,no,N,4,,208427,4862,AIB
5,,SING,CA,CB1,no,N,5,,208427,4862,AIB
6,,SING,CA,CB2,no,N,6,,208427,4862,AIB
7,,DOUB,C,O,no,N,7,,208427,4862,AIB
8,,SING,C,OXT,no,N,8,,208427,4862,AIB
9,,SING,OXT,HO2,no,N,9,,208427,4862,AIB
10,,SING,CB1,HB11,no,N,10,,208427,4862,AIB
11,,SING,CB1,HB12,no,N,11,,208427,4862,AIB
12,,SING,CB1,HB13,no,N,12,,208427,4862,AIB
13,,SING,CB2,HB21,no,N,13,,208427,4862,AIB
14,,SING,CB2,HB22,no,N,14,,208427,4862,AIB
15,,SING,CB2,HB23,no,N,15,,208427,4862,AIB
1,,SING,N,HN1,no,N,1,,208428,4862,NH2
2,,SING,N,HN2,no,N,2,,208428,4862,NH2
1,,SING,N,HN1,no,N,1,,208643,4872,NH2
2,,SING,N,HN2,no,N,2,,208643,4872,NH2
1,,DOUB,C,O,no,N,1,,208644,4872,ACE
2,,SING,C,CH3,no,N,2,,208644,4872,ACE
3,,SING,C,H,no,N,3,,208644,4872,ACE
4,,SING,CH3,H1,no,N,4,,208644,4872,ACE
5,,SING,CH3,H2,no,N,5,,208644,4872,ACE
6,,SING,CH3,H3,no,N,6,,208644,4872,ACE
1,,SING,N1,C2,yes,N,1,,208873,4881,FMN
2,,DOUB,N1,C10,yes,N,2,,208873,4881,FMN
3,,DOUB,C2,O2,no,N,3,,208873,4881,FMN
4,,SING,C2,N3,yes,N,4,,208873,4881,FMN
5,,SING,N3,C4,yes,N,5,,208873,4881,FMN
6,,SING,N3,HN3,no,N,6,,208873,4881,FMN
7,,DOUB,C4,O4,no,N,7,,208873,4881,FMN
8,,SING,C4,C4A,yes,N,8,,208873,4881,FMN
9,,DOUB,C4A,N5,yes,N,9,,208873,4881,FMN
10,,SING,C4A,C10,yes,N,10,,208873,4881,FMN
11,,SING,N5,C5A,yes,N,11,,208873,4881,FMN
12,,DOUB,C5A,C6,yes,N,12,,208873,4881,FMN
13,,SING,C5A,C9A,yes,N,13,,208873,4881,FMN
14,,SING,C6,C7,yes,N,14,,208873,4881,FMN
15,,SING,C6,H6,no,N,15,,208873,4881,FMN
16,,SING,C7,C7M,no,N,16,,208873,4881,FMN
17,,DOUB,C7,C8,yes,N,17,,208873,4881,FMN
18,,SING,C7M,HM71,no,N,18,,208873,4881,FMN
19,,SING,C7M,HM72,no,N,19,,208873,4881,FMN
20,,SING,C7M,HM73,no,N,20,,208873,4881,FMN
21,,SING,C8,C8M,no,N,21,,208873,4881,FMN
22,,SING,C8,C9,yes,N,22,,208873,4881,FMN
23,,SING,C8M,HM81,no,N,23,,208873,4881,FMN
24,,SING,C8M,HM82,no,N,24,,208873,4881,FMN
25,,SING,C8M,HM83,no,N,25,,208873,4881,FMN
26,,DOUB,C9,C9A,yes,N,26,,208873,4881,FMN
27,,SING,C9,H9,no,N,27,,208873,4881,FMN
28,,SING,C9A,N10,yes,N,28,,208873,4881,FMN
29,,SING,N10,C10,yes,N,29,,208873,4881,FMN
30,,SING,N10,C1',no,N,30,,208873,4881,FMN
31,,SING,C1',C2',no,N,31,,208873,4881,FMN
32,,SING,C1',H1'1,no,N,32,,208873,4881,FMN
33,,SING,C1',H1'2,no,N,33,,208873,4881,FMN
34,,SING,C2',O2',no,N,34,,208873,4881,FMN
35,,SING,C2',C3',no,N,35,,208873,4881,FMN
36,,SING,C2',H2',no,N,36,,208873,4881,FMN
37,,SING,O2',HO2',no,N,37,,208873,4881,FMN
38,,SING,C3',O3',no,N,38,,208873,4881,FMN
39,,SING,C3',C4',no,N,39,,208873,4881,FMN
40,,SING,C3',H3',no,N,40,,208873,4881,FMN
41,,SING,O3',HO3',no,N,41,,208873,4881,FMN
42,,SING,C4',O4',no,N,42,,208873,4881,FMN
43,,SING,C4',C5',no,N,43,,208873,4881,FMN
44,,SING,C4',H4',no,N,44,,208873,4881,FMN
45,,SING,O4',HO4',no,N,45,,208873,4881,FMN
46,,SING,C5',O5',no,N,46,,208873,4881,FMN
47,,SING,C5',H5'1,no,N,47,,208873,4881,FMN
48,,SING,C5',H5'2,no,N,48,,208873,4881,FMN
49,,SING,O5',P,no,N,49,,208873,4881,FMN
50,,DOUB,P,O1P,no,N,50,,208873,4881,FMN
51,,SING,P,O2P,no,N,51,,208873,4881,FMN
52,,SING,P,O3P,no,N,52,,208873,4881,FMN
53,,SING,O2P,HOP2,no,N,53,,208873,4881,FMN
54,,SING,O3P,HOP3,no,N,54,,208873,4881,FMN
1,,SING,C1',C2',,,,,209224,4898,PTDINS3P
2,,SING,C1',C6',,,,,209224,4898,PTDINS3P
3,,SING,C1',H1',,,,,209224,4898,PTDINS3P
4,,SING,C1',O1',,,,,209224,4898,PTDINS3P
5,,SING,C2',C3',,,,,209224,4898,PTDINS3P
6,,SING,C2',H2',,,,,209224,4898,PTDINS3P
7,,SING,C2',O2',,,,,209224,4898,PTDINS3P
8,,SING,O2',HO2',,,,,209224,4898,PTDINS3P
9,,SING,C3',C4',,,,,209224,4898,PTDINS3P
10,,SING,C3',H3',,,,,209224,4898,PTDINS3P
11,,SING,C3',O3',,,,,209224,4898,PTDINS3P
12,,SING,O3',P2,,,,,209224,4898,PTDINS3P
13,,DOUB,P2,OP3,,,,,209224,4898,PTDINS3P
14,,SING,P2,OP4,,,,,209224,4898,PTDINS3P
15,,SING,OP4,HOP4,,,,,209224,4898,PTDINS3P
16,,SING,P2,OP5,,,,,209224,4898,PTDINS3P
17,,SING,OP5,HOP5,,,,,209224,4898,PTDINS3P
18,,SING,C4',C5',,,,,209224,4898,PTDINS3P
19,,SING,C4',H4',,,,,209224,4898,PTDINS3P
20,,SING,C4',O4',,,,,209224,4898,PTDINS3P
21,,SING,O4',HO4',,,,,209224,4898,PTDINS3P
22,,SING,C5',C6',,,,,209224,4898,PTDINS3P
23,,SING,C5',H5',,,,,209224,4898,PTDINS3P
24,,SING,C5',O5',,,,,209224,4898,PTDINS3P
25,,SING,O5',HO5',,,,,209224,4898,PTDINS3P
26,,SING,C6',H6',,,,,209224,4898,PTDINS3P
27,,SING,C6',O6',,,,,209224,4898,PTDINS3P
28,,SING,O6',HO6',,,,,209224,4898,PTDINS3P
29,,SING,O1',P1,,,,,209224,4898,PTDINS3P
30,,DOUB,P1,OP1,,,,,209224,4898,PTDINS3P
31,,SING,P1,OP2,,,,,209224,4898,PTDINS3P
32,,SING,OP2,HOP2,,,,,209224,4898,PTDINS3P
33,,SING,P1,O3,,,,,209224,4898,PTDINS3P
34,,SING,O3,C3,,,,,209224,4898,PTDINS3P
35,,SING,C3,C2,,,,,209224,4898,PTDINS3P
36,,SING,C3,H32,,,,,209224,4898,PTDINS3P
37,,SING,C3,H33,,,,,209224,4898,PTDINS3P
38,,SING,C2,C1,,,,,209224,4898,PTDINS3P
39,,SING,C2,H2,,,,,209224,4898,PTDINS3P
40,,SING,C2,O2,,,,,209224,4898,PTDINS3P
41,,SING,C1,H12,,,,,209224,4898,PTDINS3P
42,,SING,C1,H13,,,,,209224,4898,PTDINS3P
43,,SING,C1,O1,,,,,209224,4898,PTDINS3P
44,,SING,O1,C4,,,,,209224,4898,PTDINS3P
45,,SING,C4,C5,,,,,209224,4898,PTDINS3P
46,,DOUB,C4,O4,,,,,209224,4898,PTDINS3P
47,,SING,C5,C6,,,,,209224,4898,PTDINS3P
48,,SING,C5,H52,,,,,209224,4898,PTDINS3P
49,,SING,C5,H53,,,,,209224,4898,PTDINS3P
50,,SING,C6,C7,,,,,209224,4898,PTDINS3P
51,,SING,C6,H62,,,,,209224,4898,PTDINS3P
52,,SING,C6,H63,,,,,209224,4898,PTDINS3P
53,,SING,C7,H71,,,,,209224,4898,PTDINS3P
54,,SING,C7,H72,,,,,209224,4898,PTDINS3P
55,,SING,C7,H73,,,,,209224,4898,PTDINS3P
56,,SING,O2,C8,,,,,209224,4898,PTDINS3P
57,,SING,C8,C9,,,,,209224,4898,PTDINS3P
58,,DOUB,C8,O8,,,,,209224,4898,PTDINS3P
59,,SING,C9,C10,,,,,209224,4898,PTDINS3P
60,,SING,C9,H92,,,,,209224,4898,PTDINS3P
61,,SING,C9,H93,,,,,209224,4898,PTDINS3P
62,,SING,C10,C11,,,,,209224,4898,PTDINS3P
63,,SING,C10,H102,,,,,209224,4898,PTDINS3P
64,,SING,C10,H103,,,,,209224,4898,PTDINS3P
65,,SING,C11,H111,,,,,209224,4898,PTDINS3P
66,,SING,C11,H112,,,,,209224,4898,PTDINS3P
67,,SING,C11,H113,,,,,209224,4898,PTDINS3P
1,,SING,C1,C2,no,N,1,,209487,4909,LAT
2,,SING,C1,O1,no,N,2,,209487,4909,LAT
3,,SING,C1,O5,no,N,3,,209487,4909,LAT
4,,SING,C1,H1,no,N,4,,209487,4909,LAT
5,,SING,C2,C3,no,N,5,,209487,4909,LAT
6,,SING,C2,O2,no,N,6,,209487,4909,LAT
7,,SING,C2,H2,no,N,7,,209487,4909,LAT
8,,SING,C3,C4,no,N,8,,209487,4909,LAT
9,,SING,C3,O3,no,N,9,,209487,4909,LAT
10,,SING,C3,H3,no,N,10,,209487,4909,LAT
11,,SING,C4,C5,no,N,11,,209487,4909,LAT
12,,SING,C4,O4,no,N,12,,209487,4909,LAT
13,,SING,C4,H4,no,N,13,,209487,4909,LAT
14,,SING,C5,C6,no,N,14,,209487,4909,LAT
15,,SING,C5,O5,no,N,15,,209487,4909,LAT
16,,SING,C5,H5,no,N,16,,209487,4909,LAT
17,,SING,C6,O6,no,N,17,,209487,4909,LAT
18,,SING,C6,H61,no,N,18,,209487,4909,LAT
19,,SING,C6,H62,no,N,19,,209487,4909,LAT
20,,SING,O1,C4',no,N,20,,209487,4909,LAT
21,,SING,O2,HO2,no,N,21,,209487,4909,LAT
22,,SING,O3,HO3,no,N,22,,209487,4909,LAT
23,,SING,O4,HO4,no,N,23,,209487,4909,LAT
24,,SING,O6,HO6,no,N,24,,209487,4909,LAT
25,,SING,C1',C2',no,N,25,,209487,4909,LAT
26,,SING,C1',O1',no,N,26,,209487,4909,LAT
27,,SING,C1',O5',no,N,27,,209487,4909,LAT
28,,SING,C1',H1',no,N,28,,209487,4909,LAT
29,,SING,C2',C3',no,N,29,,209487,4909,LAT
30,,SING,C2',O2',no,N,30,,209487,4909,LAT
31,,SING,C2',H2',no,N,31,,209487,4909,LAT
32,,SING,C3',C4',no,N,32,,209487,4909,LAT
33,,SING,C3',O3',no,N,33,,209487,4909,LAT
34,,SING,C3',H3',no,N,34,,209487,4909,LAT
35,,SING,C4',C5',no,N,35,,209487,4909,LAT
36,,SING,C4',H4',no,N,36,,209487,4909,LAT
37,,SING,C5',C6',no,N,37,,209487,4909,LAT
38,,SING,C5',O5',no,N,38,,209487,4909,LAT
39,,SING,C5',H5',no,N,39,,209487,4909,LAT
40,,SING,C6',O6',no,N,40,,209487,4909,LAT
41,,SING,C6',H6'1,no,N,41,,209487,4909,LAT
42,,SING,C6',H6'2,no,N,42,,209487,4909,LAT
43,,SING,O1',HO1',no,N,43,,209487,4909,LAT
44,,SING,O2',HO2',no,N,44,,209487,4909,LAT
45,,SING,O3',HO3',no,N,45,,209487,4909,LAT
46,,SING,O6',HO6',no,N,46,,209487,4909,LAT
1,,SING,N,HN1,no,N,1,,209646,4916,NH2
2,,SING,N,HN2,no,N,2,,209646,4916,NH2
1,,SING,N,HN1,no,N,1,,209765,4921,NH2
2,,SING,N,HN2,no,N,2,,209765,4921,NH2
1,,SING,C1',C2',no,N,1,,210335,4947,ROM
2,,SING,C1',O5',no,N,2,,210335,4947,ROM
3,,SING,C1',O9,no,N,3,,210335,4947,ROM
4,,SING,C1',H1',no,N,4,,210335,4947,ROM
5,,SING,C2',C3',no,N,5,,210335,4947,ROM
6,,SING,C2',O2',no,N,6,,210335,4947,ROM
7,,SING,C2',H2',no,N,7,,210335,4947,ROM
8,,SING,C3',C4',no,N,8,,210335,4947,ROM
9,,SING,C3',O3',no,N,9,,210335,4947,ROM
10,,SING,C3',H3',no,N,10,,210335,4947,ROM
11,,SING,C4',C5',no,N,11,,210335,4947,ROM
12,,SING,C4',N4',no,N,12,,210335,4947,ROM
13,,SING,C4',H4',no,N,13,,210335,4947,ROM
14,,SING,C5',O5',no,N,14,,210335,4947,ROM
15,,SING,C5',C6D,no,N,15,,210335,4947,ROM
16,,SING,C5',C6B,no,N,16,,210335,4947,ROM
17,,SING,O2',H2'2,no,N,17,,210335,4947,ROM
18,,SING,O3',H3'2,no,N,18,,210335,4947,ROM
19,,SING,N4',C4D,no,N,19,,210335,4947,ROM
20,,SING,N4',C4B,no,N,20,,210335,4947,ROM
21,,SING,C6D,H6B1,no,N,21,,210335,4947,ROM
22,,SING,C6D,H6B3,no,N,22,,210335,4947,ROM
23,,SING,C6D,H6B2,no,N,23,,210335,4947,ROM
24,,SING,O9,C9,no,N,24,,210335,4947,ROM
25,,SING,C6B,H6A1,no,N,25,,210335,4947,ROM
26,,SING,C6B,H6A3,no,N,26,,210335,4947,ROM
27,,SING,C6B,H6A2,no,N,27,,210335,4947,ROM
28,,SING,C4D,H4B1,no,N,28,,210335,4947,ROM
29,,SING,C4D,H4B3,no,N,29,,210335,4947,ROM
30,,SING,C4D,H4B2,no,N,30,,210335,4947,ROM
31,,SING,C4B,H4A1,no,N,31,,210335,4947,ROM
32,,SING,C4B,H4A3,no,N,32,,210335,4947,ROM
33,,SING,C4B,H4A2,no,N,33,,210335,4947,ROM
34,,DOUB,C'8,C'7,yes,N,34,,210335,4947,ROM
35,,SING,C'8,C'9,yes,N,35,,210335,4947,ROM
36,,SING,C'8,H'8,no,N,36,,210335,4947,ROM
37,,SING,C'7,C'6,yes,N,37,,210335,4947,ROM
38,,SING,C'7,O'7,no,N,38,,210335,4947,ROM
39,,DOUB,C'6,C'5,yes,N,39,,210335,4947,ROM
40,,SING,C'6,H'6,no,N,40,,210335,4947,ROM
41,,SING,C'5,C15,yes,N,41,,210335,4947,ROM
42,,SING,C'5,O'4,no,N,42,,210335,4947,ROM
43,,DOUB,C15,C'9,yes,N,43,,210335,4947,ROM
44,,SING,C15,N'1,no,N,44,,210335,4947,ROM
45,,SING,C'9,C1A,no,N,45,,210335,4947,ROM
46,,SING,O'7,C7X,no,N,46,,210335,4947,ROM
47,,SING,C1A,O13,no,N,47,,210335,4947,ROM
48,,DOUB,C1A,O11,no,N,48,,210335,4947,ROM
49,,SING,O'4,C'3,no,N,49,,210335,4947,ROM
50,,SING,C'3,C'2,no,N,50,,210335,4947,ROM
51,,DOUB,C'3,C1B,no,N,51,,210335,4947,ROM
52,,SING,C'2,N'1,no,N,52,,210335,4947,ROM
53,,DOUB,C'2,O'2,no,N,53,,210335,4947,ROM
54,,SING,N'1,H'1,no,N,54,,210335,4947,ROM
55,,SING,C1B,H3A1,no,N,55,,210335,4947,ROM
56,,SING,C1B,H3A2,no,N,56,,210335,4947,ROM
57,,SING,O13,C13,no,N,57,,210335,4947,ROM
58,,SING,C7X,H7A1,no,N,58,,210335,4947,ROM
59,,SING,C7X,H7A3,no,N,59,,210335,4947,ROM
60,,SING,C7X,H7A2,no,N,60,,210335,4947,ROM
61,,DOUB,C3,C2,yes,N,61,,210335,4947,ROM
62,,SING,C3,C4,yes,N,62,,210335,4947,ROM
63,,SING,C3,H3,no,N,63,,210335,4947,ROM
64,,SING,C2,C7,yes,N,64,,210335,4947,ROM
65,,SING,C2,C1,no,N,65,,210335,4947,ROM
66,,DOUB,C7,C6,yes,N,66,,210335,4947,ROM
67,,SING,C7,C8,no,N,67,,210335,4947,ROM
68,,SING,C6,C5,yes,N,68,,210335,4947,ROM
69,,SING,C6,H6,no,N,69,,210335,4947,ROM
70,,DOUB,C5,C4,yes,N,70,,210335,4947,ROM
71,,SING,C5,H5,no,N,71,,210335,4947,ROM
72,,SING,C4,C13,no,N,72,,210335,4947,ROM
73,,DOUB,C1,C12,no,N,73,,210335,4947,ROM
74,,SING,C1,C9,no,N,74,,210335,4947,ROM
75,,SING,C12,C11,no,N,75,,210335,4947,ROM
76,,SING,C12,H12,no,N,76,,210335,4947,ROM
77,,SING,C9,C8,no,N,77,,210335,4947,ROM
78,,SING,C9,C10,no,N,78,,210335,4947,ROM
79,,SING,C8,O25,no,N,79,,210335,4947,ROM
80,,SING,C8,H8,no,N,80,,210335,4947,ROM
81,,SING,C13,C14,no,N,81,,210335,4947,ROM
82,,SING,C13,H13,no,N,82,,210335,4947,ROM
83,,DOUB,C10,C11,no,N,83,,210335,4947,ROM
84,,SING,C10,H10,no,N,84,,210335,4947,ROM
85,,SING,C11,H11,no,N,85,,210335,4947,ROM
86,,SING,C14,O15,no,N,86,,210335,4947,ROM
87,,SING,C14,H142,no,N,87,,210335,4947,ROM
88,,SING,C14,H141,no,N,88,,210335,4947,ROM
89,,SING,O15,C16,no,N,89,,210335,4947,ROM
90,,SING,C16,C17,no,N,90,,210335,4947,ROM
91,,DOUB,C16,O16,no,N,91,,210335,4947,ROM
92,,SING,C17,C18,no,N,92,,210335,4947,ROM
93,,SING,C17,H172,no,N,93,,210335,4947,ROM
94,,SING,C17,H171,no,N,94,,210335,4947,ROM
95,,SING,C18,C19,no,N,95,,210335,4947,ROM
96,,SING,C18,N18,no,N,96,,210335,4947,ROM
97,,SING,C18,H18,no,N,97,,210335,4947,ROM
98,,DOUB,C20,C21,yes,N,98,,210335,4947,ROM
99,,SING,C20,C19,yes,N,99,,210335,4947,ROM
100,,SING,C20,H20,no,N,100,,210335,4947,ROM
101,,SING,C21,C22,yes,N,101,,210335,4947,ROM
102,,SING,C21,CL21,no,N,102,,210335,4947,ROM
103,,DOUB,C22,C23,yes,N,103,,210335,4947,ROM
104,,SING,C22,O25,no,N,104,,210335,4947,ROM
105,,SING,C23,C24,yes,N,105,,210335,4947,ROM
106,,SING,C23,O23,no,N,106,,210335,4947,ROM
107,,DOUB,C24,C19,yes,N,107,,210335,4947,ROM
108,,SING,C24,H24,no,N,108,,210335,4947,ROM
109,,SING,N18,H183,no,N,109,,210335,4947,ROM
110,,SING,N18,H182,no,N,110,,210335,4947,ROM
111,,SING,N18,H184,no,N,111,,210335,4947,ROM
112,,SING,O23,H232,no,N,112,,210335,4947,ROM
1,,SING,N,HN1,no,N,1,,210386,4950,NH2
2,,SING,N,HN2,no,N,2,,210386,4950,NH2
1,,DOUB,C1,O1,no,N,1,,210407,4951,MYR
2,,SING,C1,O2,no,N,2,,210407,4951,MYR
3,,SING,C1,C2,no,N,3,,210407,4951,MYR
4,,SING,O2,HO2,no,N,4,,210407,4951,MYR
5,,SING,C2,C3,no,N,5,,210407,4951,MYR
6,,SING,C2,H21,no,N,6,,210407,4951,MYR
7,,SING,C2,H22,no,N,7,,210407,4951,MYR
8,,SING,C3,C4,no,N,8,,210407,4951,MYR
9,,SING,C3,H31,no,N,9,,210407,4951,MYR
10,,SING,C3,H32,no,N,10,,210407,4951,MYR
11,,SING,C4,C5,no,N,11,,210407,4951,MYR
12,,SING,C4,H41,no,N,12,,210407,4951,MYR
13,,SING,C4,H42,no,N,13,,210407,4951,MYR
14,,SING,C5,C6,no,N,14,,210407,4951,MYR
15,,SING,C5,H51,no,N,15,,210407,4951,MYR
16,,SING,C5,H52,no,N,16,,210407,4951,MYR
17,,SING,C6,C7,no,N,17,,210407,4951,MYR
18,,SING,C6,H61,no,N,18,,210407,4951,MYR
19,,SING,C6,H62,no,N,19,,210407,4951,MYR
20,,SING,C7,C8,no,N,20,,210407,4951,MYR
21,,SING,C7,H71,no,N,21,,210407,4951,MYR
22,,SING,C7,H72,no,N,22,,210407,4951,MYR
23,,SING,C8,C9,no,N,23,,210407,4951,MYR
24,,SING,C8,H81,no,N,24,,210407,4951,MYR
25,,SING,C8,H82,no,N,25,,210407,4951,MYR
26,,SING,C9,C10,no,N,26,,210407,4951,MYR
27,,SING,C9,H91,no,N,27,,210407,4951,MYR
28,,SING,C9,H92,no,N,28,,210407,4951,MYR
29,,SING,C10,C11,no,N,29,,210407,4951,MYR
30,,SING,C10,H101,no,N,30,,210407,4951,MYR
31,,SING,C10,H102,no,N,31,,210407,4951,MYR
32,,SING,C11,C12,no,N,32,,210407,4951,MYR
33,,SING,C11,H111,no,N,33,,210407,4951,MYR
34,,SING,C11,H112,no,N,34,,210407,4951,MYR
35,,SING,C12,C13,no,N,35,,210407,4951,MYR
36,,SING,C12,H121,no,N,36,,210407,4951,MYR
37,,SING,C12,H122,no,N,37,,210407,4951,MYR
38,,SING,C13,C14,no,N,38,,210407,4951,MYR
39,,SING,C13,H131,no,N,39,,210407,4951,MYR
40,,SING,C13,H132,no,N,40,,210407,4951,MYR
41,,SING,C14,H141,no,N,41,,210407,4951,MYR
42,,SING,C14,H142,no,N,42,,210407,4951,MYR
43,,SING,C14,H143,no,N,43,,210407,4951,MYR
1,,SING,N,HN1,no,N,1,,210408,4951,NH2
2,,SING,N,HN2,no,N,2,,210408,4951,NH2
1,,SING,N1,C2,yes,N,1,,210477,4954,RBF
2,,DOUB,N1,C10,yes,N,2,,210477,4954,RBF
3,,DOUB,C2,O2,no,N,3,,210477,4954,RBF
4,,SING,C2,N3,yes,N,4,,210477,4954,RBF
5,,SING,N3,C4,yes,N,5,,210477,4954,RBF
6,,SING,N3,HN3,no,N,6,,210477,4954,RBF
7,,DOUB,C4,O4,no,N,7,,210477,4954,RBF
8,,SING,C4,C4A,yes,N,8,,210477,4954,RBF
9,,DOUB,C4A,N5,yes,N,9,,210477,4954,RBF
10,,SING,C4A,C10,yes,N,10,,210477,4954,RBF
11,,SING,N5,C5A,yes,N,11,,210477,4954,RBF
12,,DOUB,C5A,C6,yes,N,12,,210477,4954,RBF
13,,SING,C5A,C9A,yes,N,13,,210477,4954,RBF
14,,SING,C6,C7,yes,N,14,,210477,4954,RBF
15,,SING,C6,HC6,no,N,15,,210477,4954,RBF
16,,SING,C7,C7M,no,N,16,,210477,4954,RBF
17,,DOUB,C7,C8,yes,N,17,,210477,4954,RBF
18,,SING,C7M,HC71,no,N,18,,210477,4954,RBF
19,,SING,C7M,HC72,no,N,19,,210477,4954,RBF
20,,SING,C7M,HC73,no,N,20,,210477,4954,RBF
21,,SING,C8,C8M,no,N,21,,210477,4954,RBF
22,,SING,C8,C9,yes,N,22,,210477,4954,RBF
23,,SING,C8M,HC81,no,N,23,,210477,4954,RBF
24,,SING,C8M,HC82,no,N,24,,210477,4954,RBF
25,,SING,C8M,HC83,no,N,25,,210477,4954,RBF
26,,DOUB,C9,C9A,yes,N,26,,210477,4954,RBF
27,,SING,C9,HC9,no,N,27,,210477,4954,RBF
28,,SING,C9A,N10,yes,N,28,,210477,4954,RBF
29,,SING,N10,C10,yes,N,29,,210477,4954,RBF
30,,SING,N10,C1',no,N,30,,210477,4954,RBF
31,,SING,C1',C2',no,N,31,,210477,4954,RBF
32,,SING,C1',HC11,no,N,32,,210477,4954,RBF
33,,SING,C1',HC12,no,N,33,,210477,4954,RBF
34,,SING,C2',O2',no,N,34,,210477,4954,RBF
35,,SING,C2',C3',no,N,35,,210477,4954,RBF
36,,SING,C2',HC2',no,N,36,,210477,4954,RBF
37,,SING,O2',HO2',no,N,37,,210477,4954,RBF
38,,SING,C3',O3',no,N,38,,210477,4954,RBF
39,,SING,C3',C4',no,N,39,,210477,4954,RBF
40,,SING,C3',HC3',no,N,40,,210477,4954,RBF
41,,SING,O3',HO3',no,N,41,,210477,4954,RBF
42,,SING,C4',O4',no,N,42,,210477,4954,RBF
43,,SING,C4',C5',no,N,43,,210477,4954,RBF
44,,SING,C4',HC4',no,N,44,,210477,4954,RBF
45,,SING,O4',HO4',no,N,45,,210477,4954,RBF
46,,SING,C5',O5',no,N,46,,210477,4954,RBF
47,,SING,C5',HC51,no,N,47,,210477,4954,RBF
48,,SING,C5',HC52,no,N,48,,210477,4954,RBF
49,,SING,O5',HO5',no,N,49,,210477,4954,RBF
1,,SING,N,CA,no,N,1,,210496,4955,CSP
2,,SING,N,H,no,N,2,,210496,4955,CSP
3,,SING,N,H2,no,N,3,,210496,4955,CSP
4,,SING,CA,CB,no,N,4,,210496,4955,CSP
5,,SING,CA,C,no,N,5,,210496,4955,CSP
6,,SING,CA,HA,no,N,6,,210496,4955,CSP
7,,SING,CB,SG,no,N,7,,210496,4955,CSP
8,,SING,CB,HB2,no,N,8,,210496,4955,CSP
9,,SING,CB,HB3,no,N,9,,210496,4955,CSP
10,,SING,SG,P,no,N,10,,210496,4955,CSP
11,,DOUB,C,O,no,N,11,,210496,4955,CSP
12,,SING,C,OXT,no,N,12,,210496,4955,CSP
13,,SING,OXT,HXT,no,N,13,,210496,4955,CSP
14,,DOUB,P,O1P,no,N,14,,210496,4955,CSP
15,,SING,P,O2P,no,N,15,,210496,4955,CSP
16,,SING,P,O3P,no,N,16,,210496,4955,CSP
17,,SING,O2P,HO2P,no,N,17,,210496,4955,CSP
18,,SING,O3P,HO3P,no,N,18,,210496,4955,CSP
1,,SING,FE,NA,no,N,1,,210615,4960,HEC
2,,SING,FE,NB,no,N,2,,210615,4960,HEC
3,,SING,FE,NC,no,N,3,,210615,4960,HEC
4,,SING,FE,ND,no,N,4,,210615,4960,HEC
5,,DOUB,CHA,C1A,no,N,5,,210615,4960,HEC
6,,SING,CHA,C4D,no,N,6,,210615,4960,HEC
7,,SING,CHA,HHA,no,N,7,,210615,4960,HEC
8,,DOUB,CHB,C4A,no,N,8,,210615,4960,HEC
9,,SING,CHB,C1B,no,N,9,,210615,4960,HEC
10,,SING,CHB,HHB,no,N,10,,210615,4960,HEC
11,,DOUB,CHC,C4B,no,N,11,,210615,4960,HEC
12,,SING,CHC,C1C,no,N,12,,210615,4960,HEC
13,,SING,CHC,HHC,no,N,13,,210615,4960,HEC
14,,DOUB,CHD,C4C,no,N,14,,210615,4960,HEC
15,,SING,CHD,C1D,no,N,15,,210615,4960,HEC
16,,SING,CHD,HHD,no,N,16,,210615,4960,HEC
17,,SING,NA,C1A,yes,N,17,,210615,4960,HEC
18,,SING,NA,C4A,yes,N,18,,210615,4960,HEC
19,,SING,C1A,C2A,yes,N,19,,210615,4960,HEC
20,,DOUB,C2A,C3A,yes,N,20,,210615,4960,HEC
21,,SING,C2A,CAA,no,N,21,,210615,4960,HEC
22,,SING,C3A,C4A,yes,N,22,,210615,4960,HEC
23,,SING,C3A,CMA,no,N,23,,210615,4960,HEC
24,,SING,CMA,HMA1,no,N,24,,210615,4960,HEC
25,,SING,CMA,HMA2,no,N,25,,210615,4960,HEC
26,,SING,CMA,HMA3,no,N,26,,210615,4960,HEC
27,,SING,CAA,CBA,no,N,27,,210615,4960,HEC
28,,SING,CAA,HAA1,no,N,28,,210615,4960,HEC
29,,SING,CAA,HAA2,no,N,29,,210615,4960,HEC
30,,SING,CBA,CGA,no,N,30,,210615,4960,HEC
31,,SING,CBA,HBA1,no,N,31,,210615,4960,HEC
32,,SING,CBA,HBA2,no,N,32,,210615,4960,HEC
33,,DOUB,CGA,O1A,no,N,33,,210615,4960,HEC
34,,SING,CGA,O2A,no,N,34,,210615,4960,HEC
35,,SING,O2A,H2A,no,N,35,,210615,4960,HEC
36,,SING,NB,C1B,yes,N,36,,210615,4960,HEC
37,,SING,NB,C4B,yes,N,37,,210615,4960,HEC
38,,DOUB,C1B,C2B,yes,N,38,,210615,4960,HEC
39,,SING,C2B,C3B,yes,N,39,,210615,4960,HEC
40,,SING,C2B,CMB,no,N,40,,210615,4960,HEC
41,,SING,C3B,C4B,yes,N,41,,210615,4960,HEC
42,,DOUB,C3B,CAB,no,E,42,,210615,4960,HEC
43,,SING,CMB,HMB1,no,N,43,,210615,4960,HEC
44,,SING,CMB,HMB2,no,N,44,,210615,4960,HEC
45,,SING,CMB,HMB3,no,N,45,,210615,4960,HEC
46,,SING,CAB,CBB,no,N,46,,210615,4960,HEC
47,,SING,CAB,HAB,no,N,47,,210615,4960,HEC
48,,SING,CBB,HBB1,no,N,48,,210615,4960,HEC
49,,SING,CBB,HBB2,no,N,49,,210615,4960,HEC
50,,SING,CBB,HBB3,no,N,50,,210615,4960,HEC
51,,SING,NC,C1C,yes,N,51,,210615,4960,HEC
52,,SING,NC,C4C,yes,N,52,,210615,4960,HEC
53,,DOUB,C1C,C2C,yes,N,53,,210615,4960,HEC
54,,SING,C2C,C3C,yes,N,54,,210615,4960,HEC
55,,SING,C2C,CMC,no,N,55,,210615,4960,HEC
56,,SING,C3C,C4C,yes,N,56,,210615,4960,HEC
57,,DOUB,C3C,CAC,no,E,57,,210615,4960,HEC
58,,SING,CMC,HMC1,no,N,58,,210615,4960,HEC
59,,SING,CMC,HMC2,no,N,59,,210615,4960,HEC
60,,SING,CMC,HMC3,no,N,60,,210615,4960,HEC
61,,SING,CAC,CBC,no,N,61,,210615,4960,HEC
62,,SING,CAC,HAC,no,N,62,,210615,4960,HEC
63,,SING,CBC,HBC1,no,N,63,,210615,4960,HEC
64,,SING,CBC,HBC2,no,N,64,,210615,4960,HEC
65,,SING,CBC,HBC3,no,N,65,,210615,4960,HEC
66,,SING,ND,C1D,yes,N,66,,210615,4960,HEC
67,,SING,ND,C4D,yes,N,67,,210615,4960,HEC
68,,DOUB,C1D,C2D,yes,N,68,,210615,4960,HEC
69,,SING,C2D,C3D,yes,N,69,,210615,4960,HEC
70,,SING,C2D,CMD,no,N,70,,210615,4960,HEC
71,,DOUB,C3D,C4D,yes,N,71,,210615,4960,HEC
72,,SING,C3D,CAD,no,N,72,,210615,4960,HEC
73,,SING,CMD,HMD1,no,N,73,,210615,4960,HEC
74,,SING,CMD,HMD2,no,N,74,,210615,4960,HEC
75,,SING,CMD,HMD3,no,N,75,,210615,4960,HEC
76,,SING,CAD,CBD,no,N,76,,210615,4960,HEC
77,,SING,CAD,HAD1,no,N,77,,210615,4960,HEC
78,,SING,CAD,HAD2,no,N,78,,210615,4960,HEC
79,,SING,CBD,CGD,no,N,79,,210615,4960,HEC
80,,SING,CBD,HBD1,no,N,80,,210615,4960,HEC
81,,SING,CBD,HBD2,no,N,81,,210615,4960,HEC
82,,DOUB,CGD,O1D,no,N,82,,210615,4960,HEC
83,,SING,CGD,O2D,no,N,83,,210615,4960,HEC
84,,SING,O2D,H2D,no,N,84,,210615,4960,HEC
1,,SING,N,CA,no,N,1,,210635,4961,PTR
2,,SING,N,H,no,N,2,,210635,4961,PTR
3,,SING,N,HN2,no,N,3,,210635,4961,PTR
4,,SING,CA,C,no,N,4,,210635,4961,PTR
5,,SING,CA,CB,no,N,5,,210635,4961,PTR
6,,SING,CA,HA,no,N,6,,210635,4961,PTR
7,,DOUB,C,O,no,N,7,,210635,4961,PTR
8,,SING,C,OXT,no,N,8,,210635,4961,PTR
9,,SING,OXT,HXT,no,N,9,,210635,4961,PTR
10,,SING,CB,CG,no,N,10,,210635,4961,PTR
11,,SING,CB,HB2,no,N,11,,210635,4961,PTR
12,,SING,CB,HB3,no,N,12,,210635,4961,PTR
13,,DOUB,CG,CD1,yes,N,13,,210635,4961,PTR
14,,SING,CG,CD2,yes,N,14,,210635,4961,PTR
15,,SING,CD1,CE1,yes,N,15,,210635,4961,PTR
16,,SING,CD1,HD1,no,N,16,,210635,4961,PTR
17,,DOUB,CD2,CE2,yes,N,17,,210635,4961,PTR
18,,SING,CD2,HD2,no,N,18,,210635,4961,PTR
19,,DOUB,CE1,CZ,yes,N,19,,210635,4961,PTR
20,,SING,CE1,HE1,no,N,20,,210635,4961,PTR
21,,SING,CE2,CZ,yes,N,21,,210635,4961,PTR
22,,SING,CE2,HE2,no,N,22,,210635,4961,PTR
23,,SING,CZ,OH,no,N,23,,210635,4961,PTR
24,,SING,OH,P,no,N,24,,210635,4961,PTR
25,,DOUB,P,O1P,no,N,25,,210635,4961,PTR
26,,SING,P,O2P,no,N,26,,210635,4961,PTR
27,,SING,P,O3P,no,N,27,,210635,4961,PTR
28,,SING,O2P,HO2P,no,N,28,,210635,4961,PTR
29,,SING,O3P,HO3P,no,N,29,,210635,4961,PTR
1,,SING,C1,C2,no,N,1,,211030,4975,GLC
2,,SING,C1,O1,no,N,2,,211030,4975,GLC
3,,SING,C1,O5,no,N,3,,211030,4975,GLC
4,,SING,C1,H1,no,N,4,,211030,4975,GLC
5,,SING,C2,C3,no,N,5,,211030,4975,GLC
6,,SING,C2,O2,no,N,6,,211030,4975,GLC
7,,SING,C2,H2,no,N,7,,211030,4975,GLC
8,,SING,C3,C4,no,N,8,,211030,4975,GLC
9,,SING,C3,O3,no,N,9,,211030,4975,GLC
10,,SING,C3,H3,no,N,10,,211030,4975,GLC
11,,SING,C4,C5,no,N,11,,211030,4975,GLC
12,,SING,C4,O4,no,N,12,,211030,4975,GLC
13,,SING,C4,H4,no,N,13,,211030,4975,GLC
14,,SING,C5,C6,no,N,14,,211030,4975,GLC
15,,SING,C5,O5,no,N,15,,211030,4975,GLC
16,,SING,C5,H5,no,N,16,,211030,4975,GLC
17,,SING,C6,O6,no,N,17,,211030,4975,GLC
18,,SING,C6,H61,no,N,18,,211030,4975,GLC
19,,SING,C6,H62,no,N,19,,211030,4975,GLC
20,,SING,O1,HO1,no,N,20,,211030,4975,GLC
21,,SING,O2,HO2,no,N,21,,211030,4975,GLC
22,,SING,O3,HO3,no,N,22,,211030,4975,GLC
23,,SING,O4,HO4,no,N,23,,211030,4975,GLC
24,,SING,O6,HO6,no,N,24,,211030,4975,GLC
1,,SING,FE,NA,no,N,1,,211154,498,HEC
2,,SING,FE,NB,no,N,2,,211154,498,HEC
3,,SING,FE,NC,no,N,3,,211154,498,HEC
4,,SING,FE,ND,no,N,4,,211154,498,HEC
5,,DOUB,CHA,C1A,no,N,5,,211154,498,HEC
6,,SING,CHA,C4D,no,N,6,,211154,498,HEC
7,,SING,CHA,HHA,no,N,7,,211154,498,HEC
8,,DOUB,CHB,C4A,no,N,8,,211154,498,HEC
9,,SING,CHB,C1B,no,N,9,,211154,498,HEC
10,,SING,CHB,HHB,no,N,10,,211154,498,HEC
11,,DOUB,CHC,C4B,no,N,11,,211154,498,HEC
12,,SING,CHC,C1C,no,N,12,,211154,498,HEC
13,,SING,CHC,HHC,no,N,13,,211154,498,HEC
14,,DOUB,CHD,C4C,no,N,14,,211154,498,HEC
15,,SING,CHD,C1D,no,N,15,,211154,498,HEC
16,,SING,CHD,HHD,no,N,16,,211154,498,HEC
17,,SING,NA,C1A,yes,N,17,,211154,498,HEC
18,,SING,NA,C4A,yes,N,18,,211154,498,HEC
19,,SING,C1A,C2A,yes,N,19,,211154,498,HEC
20,,DOUB,C2A,C3A,yes,N,20,,211154,498,HEC
21,,SING,C2A,CAA,no,N,21,,211154,498,HEC
22,,SING,C3A,C4A,yes,N,22,,211154,498,HEC
23,,SING,C3A,CMA,no,N,23,,211154,498,HEC
24,,SING,CMA,HMA1,no,N,24,,211154,498,HEC
25,,SING,CMA,HMA2,no,N,25,,211154,498,HEC
26,,SING,CMA,HMA3,no,N,26,,211154,498,HEC
27,,SING,CAA,CBA,no,N,27,,211154,498,HEC
28,,SING,CAA,HAA1,no,N,28,,211154,498,HEC
29,,SING,CAA,HAA2,no,N,29,,211154,498,HEC
30,,SING,CBA,CGA,no,N,30,,211154,498,HEC
31,,SING,CBA,HBA1,no,N,31,,211154,498,HEC
32,,SING,CBA,HBA2,no,N,32,,211154,498,HEC
33,,DOUB,CGA,O1A,no,N,33,,211154,498,HEC
34,,SING,CGA,O2A,no,N,34,,211154,498,HEC
35,,SING,O2A,H2A,no,N,35,,211154,498,HEC
36,,SING,NB,C1B,yes,N,36,,211154,498,HEC
37,,SING,NB,C4B,yes,N,37,,211154,498,HEC
38,,DOUB,C1B,C2B,yes,N,38,,211154,498,HEC
39,,SING,C2B,C3B,yes,N,39,,211154,498,HEC
40,,SING,C2B,CMB,no,N,40,,211154,498,HEC
41,,SING,C3B,C4B,yes,N,41,,211154,498,HEC
42,,DOUB,C3B,CAB,no,E,42,,211154,498,HEC
43,,SING,CMB,HMB1,no,N,43,,211154,498,HEC
44,,SING,CMB,HMB2,no,N,44,,211154,498,HEC
45,,SING,CMB,HMB3,no,N,45,,211154,498,HEC
46,,SING,CAB,CBB,no,N,46,,211154,498,HEC
47,,SING,CAB,HAB,no,N,47,,211154,498,HEC
48,,SING,CBB,HBB1,no,N,48,,211154,498,HEC
49,,SING,CBB,HBB2,no,N,49,,211154,498,HEC
50,,SING,CBB,HBB3,no,N,50,,211154,498,HEC
51,,SING,NC,C1C,yes,N,51,,211154,498,HEC
52,,SING,NC,C4C,yes,N,52,,211154,498,HEC
53,,DOUB,C1C,C2C,yes,N,53,,211154,498,HEC
54,,SING,C2C,C3C,yes,N,54,,211154,498,HEC
55,,SING,C2C,CMC,no,N,55,,211154,498,HEC
56,,SING,C3C,C4C,yes,N,56,,211154,498,HEC
57,,DOUB,C3C,CAC,no,E,57,,211154,498,HEC
58,,SING,CMC,HMC1,no,N,58,,211154,498,HEC
59,,SING,CMC,HMC2,no,N,59,,211154,498,HEC
60,,SING,CMC,HMC3,no,N,60,,211154,498,HEC
61,,SING,CAC,CBC,no,N,61,,211154,498,HEC
62,,SING,CAC,HAC,no,N,62,,211154,498,HEC
63,,SING,CBC,HBC1,no,N,63,,211154,498,HEC
64,,SING,CBC,HBC2,no,N,64,,211154,498,HEC
65,,SING,CBC,HBC3,no,N,65,,211154,498,HEC
66,,SING,ND,C1D,yes,N,66,,211154,498,HEC
67,,SING,ND,C4D,yes,N,67,,211154,498,HEC
68,,DOUB,C1D,C2D,yes,N,68,,211154,498,HEC
69,,SING,C2D,C3D,yes,N,69,,211154,498,HEC
70,,SING,C2D,CMD,no,N,70,,211154,498,HEC
71,,DOUB,C3D,C4D,yes,N,71,,211154,498,HEC
72,,SING,C3D,CAD,no,N,72,,211154,498,HEC
73,,SING,CMD,HMD1,no,N,73,,211154,498,HEC
74,,SING,CMD,HMD2,no,N,74,,211154,498,HEC
75,,SING,CMD,HMD3,no,N,75,,211154,498,HEC
76,,SING,CAD,CBD,no,N,76,,211154,498,HEC
77,,SING,CAD,HAD1,no,N,77,,211154,498,HEC
78,,SING,CAD,HAD2,no,N,78,,211154,498,HEC
79,,SING,CBD,CGD,no,N,79,,211154,498,HEC
80,,SING,CBD,HBD1,no,N,80,,211154,498,HEC
81,,SING,CBD,HBD2,no,N,81,,211154,498,HEC
82,,DOUB,CGD,O1D,no,N,82,,211154,498,HEC
83,,SING,CGD,O2D,no,N,83,,211154,498,HEC
84,,SING,O2D,H2D,no,N,84,,211154,498,HEC
1,,SING,N1,CA1,no,N,1,,211173,4980,GSH
2,,SING,N1,HN11,no,N,2,,211173,4980,GSH
3,,SING,N1,HN12,no,N,3,,211173,4980,GSH
4,,SING,CA1,C1,no,N,4,,211173,4980,GSH
5,,SING,CA1,CB1,no,N,5,,211173,4980,GSH
6,,SING,CA1,HA1,no,N,6,,211173,4980,GSH
7,,DOUB,C1,O11,no,N,7,,211173,4980,GSH
8,,SING,C1,O12,no,N,8,,211173,4980,GSH
9,,SING,O12,H12,no,N,9,,211173,4980,GSH
10,,SING,CB1,CG1,no,N,10,,211173,4980,GSH
11,,SING,CB1,HB12,no,N,11,,211173,4980,GSH
12,,SING,CB1,HB13,no,N,12,,211173,4980,GSH
13,,SING,CG1,CD1,no,N,13,,211173,4980,GSH
14,,SING,CG1,HG12,no,N,14,,211173,4980,GSH
15,,SING,CG1,HG13,no,N,15,,211173,4980,GSH
16,,DOUB,CD1,OE1,no,N,16,,211173,4980,GSH
17,,SING,CD1,N2,no,N,17,,211173,4980,GSH
18,,SING,N2,CA2,no,N,18,,211173,4980,GSH
19,,SING,N2,HN2,no,N,19,,211173,4980,GSH
20,,SING,CA2,C2,no,N,20,,211173,4980,GSH
21,,SING,CA2,CB2,no,N,21,,211173,4980,GSH
22,,SING,CA2,HA2,no,N,22,,211173,4980,GSH
23,,DOUB,C2,O2,no,N,23,,211173,4980,GSH
24,,SING,C2,N3,no,N,24,,211173,4980,GSH
25,,SING,CB2,SG2,no,N,25,,211173,4980,GSH
26,,SING,CB2,HB22,no,N,26,,211173,4980,GSH
27,,SING,CB2,HB23,no,N,27,,211173,4980,GSH
28,,SING,SG2,HSG,no,N,28,,211173,4980,GSH
29,,SING,N3,CA3,no,N,29,,211173,4980,GSH
30,,SING,N3,HN3,no,N,30,,211173,4980,GSH
31,,SING,CA3,C3,no,N,31,,211173,4980,GSH
32,,SING,CA3,HA31,no,N,32,,211173,4980,GSH
33,,SING,CA3,HA32,no,N,33,,211173,4980,GSH
34,,DOUB,C3,O31,no,N,34,,211173,4980,GSH
35,,SING,C3,O32,no,N,35,,211173,4980,GSH
36,,SING,O32,H32,no,N,36,,211173,4980,GSH
1,,SING,C1,C2,no,N,1,,211224,4982,BME
2,,SING,C1,O1,no,N,2,,211224,4982,BME
3,,SING,C1,H11,no,N,3,,211224,4982,BME
4,,SING,C1,H12,no,N,4,,211224,4982,BME
5,,SING,C2,S2,no,N,5,,211224,4982,BME
6,,SING,C2,H21,no,N,6,,211224,4982,BME
7,,SING,C2,H22,no,N,7,,211224,4982,BME
8,,SING,O1,HO1,no,N,8,,211224,4982,BME
9,,SING,S2,HS2,no,N,9,,211224,4982,BME
1,,SING,N,CA,no,N,1,,211254,4983,GLZ
2,,SING,N,H,no,N,2,,211254,4983,GLZ
3,,SING,N,H2,no,N,3,,211254,4983,GLZ
4,,SING,CA,C,no,N,4,,211254,4983,GLZ
5,,SING,CA,HA1,no,N,5,,211254,4983,GLZ
6,,SING,CA,HA2,no,N,6,,211254,4983,GLZ
7,,DOUB,C,O,no,N,7,,211254,4983,GLZ
8,,SING,C,HXT,no,N,8,,211254,4983,GLZ
1,,SING,N1,C2,yes,N,1,,211295,4985,FMN
2,,DOUB,N1,C10,yes,N,2,,211295,4985,FMN
3,,DOUB,C2,O2,no,N,3,,211295,4985,FMN
4,,SING,C2,N3,yes,N,4,,211295,4985,FMN
5,,SING,N3,C4,yes,N,5,,211295,4985,FMN
6,,SING,N3,HN3,no,N,6,,211295,4985,FMN
7,,DOUB,C4,O4,no,N,7,,211295,4985,FMN
8,,SING,C4,C4A,yes,N,8,,211295,4985,FMN
9,,DOUB,C4A,N5,yes,N,9,,211295,4985,FMN
10,,SING,C4A,C10,yes,N,10,,211295,4985,FMN
11,,SING,N5,C5A,yes,N,11,,211295,4985,FMN
12,,DOUB,C5A,C6,yes,N,12,,211295,4985,FMN
13,,SING,C5A,C9A,yes,N,13,,211295,4985,FMN
14,,SING,C6,C7,yes,N,14,,211295,4985,FMN
15,,SING,C6,H6,no,N,15,,211295,4985,FMN
16,,SING,C7,C7M,no,N,16,,211295,4985,FMN
17,,DOUB,C7,C8,yes,N,17,,211295,4985,FMN
18,,SING,C7M,HM71,no,N,18,,211295,4985,FMN
19,,SING,C7M,HM72,no,N,19,,211295,4985,FMN
20,,SING,C7M,HM73,no,N,20,,211295,4985,FMN
21,,SING,C8,C8M,no,N,21,,211295,4985,FMN
22,,SING,C8,C9,yes,N,22,,211295,4985,FMN
23,,SING,C8M,HM81,no,N,23,,211295,4985,FMN
24,,SING,C8M,HM82,no,N,24,,211295,4985,FMN
25,,SING,C8M,HM83,no,N,25,,211295,4985,FMN
26,,DOUB,C9,C9A,yes,N,26,,211295,4985,FMN
27,,SING,C9,H9,no,N,27,,211295,4985,FMN
28,,SING,C9A,N10,yes,N,28,,211295,4985,FMN
29,,SING,N10,C10,yes,N,29,,211295,4985,FMN
30,,SING,N10,C1',no,N,30,,211295,4985,FMN
31,,SING,C1',C2',no,N,31,,211295,4985,FMN
32,,SING,C1',H1'1,no,N,32,,211295,4985,FMN
33,,SING,C1',H1'2,no,N,33,,211295,4985,FMN
34,,SING,C2',O2',no,N,34,,211295,4985,FMN
35,,SING,C2',C3',no,N,35,,211295,4985,FMN
36,,SING,C2',H2',no,N,36,,211295,4985,FMN
37,,SING,O2',HO2',no,N,37,,211295,4985,FMN
38,,SING,C3',O3',no,N,38,,211295,4985,FMN
39,,SING,C3',C4',no,N,39,,211295,4985,FMN
40,,SING,C3',H3',no,N,40,,211295,4985,FMN
41,,SING,O3',HO3',no,N,41,,211295,4985,FMN
42,,SING,C4',O4',no,N,42,,211295,4985,FMN
43,,SING,C4',C5',no,N,43,,211295,4985,FMN
44,,SING,C4',H4',no,N,44,,211295,4985,FMN
45,,SING,O4',HO4',no,N,45,,211295,4985,FMN
46,,SING,C5',O5',no,N,46,,211295,4985,FMN
47,,SING,C5',H5'1,no,N,47,,211295,4985,FMN
48,,SING,C5',H5'2,no,N,48,,211295,4985,FMN
49,,SING,O5',P,no,N,49,,211295,4985,FMN
50,,DOUB,P,O1P,no,N,50,,211295,4985,FMN
51,,SING,P,O2P,no,N,51,,211295,4985,FMN
52,,SING,P,O3P,no,N,52,,211295,4985,FMN
53,,SING,O2P,HOP2,no,N,53,,211295,4985,FMN
54,,SING,O3P,HOP3,no,N,54,,211295,4985,FMN
1,,SING,C1A,C2A,no,N,1,,211347,4987,MLR
2,,SING,C1A,O1X,no,N,2,,211347,4987,MLR
3,,SING,C1A,O5A,no,N,3,,211347,4987,MLR
4,,SING,C1A,H1A,no,N,4,,211347,4987,MLR
5,,SING,C2A,C3A,no,N,5,,211347,4987,MLR
6,,SING,C2A,O2A,no,N,6,,211347,4987,MLR
7,,SING,C2A,H2A,no,N,7,,211347,4987,MLR
8,,SING,C3A,C4A,no,N,8,,211347,4987,MLR
9,,SING,C3A,O3A,no,N,9,,211347,4987,MLR
10,,SING,C3A,H3A,no,N,10,,211347,4987,MLR
11,,SING,C4A,C5A,no,N,11,,211347,4987,MLR
12,,SING,C4A,O4A,no,N,12,,211347,4987,MLR
13,,SING,C4A,H4A,no,N,13,,211347,4987,MLR
14,,SING,C5A,C6A,no,N,14,,211347,4987,MLR
15,,SING,C5A,O5A,no,N,15,,211347,4987,MLR
16,,SING,C5A,H5A,no,N,16,,211347,4987,MLR
17,,SING,C6A,O6A,no,N,17,,211347,4987,MLR
18,,SING,C6A,H6A1,no,N,18,,211347,4987,MLR
19,,SING,C6A,H6A2,no,N,19,,211347,4987,MLR
20,,SING,O1X,H1X,no,N,20,,211347,4987,MLR
21,,SING,O2A,HOA2,no,N,21,,211347,4987,MLR
22,,SING,O3A,HOA3,no,N,22,,211347,4987,MLR
23,,SING,O4A,C1B,no,N,23,,211347,4987,MLR
24,,SING,O6A,HOA6,no,N,24,,211347,4987,MLR
25,,SING,C1B,C2B,no,N,25,,211347,4987,MLR
26,,SING,C1B,O5B,no,N,26,,211347,4987,MLR
27,,SING,C1B,H1B,no,N,27,,211347,4987,MLR
28,,SING,C2B,C3B,no,N,28,,211347,4987,MLR
29,,SING,C2B,O2B,no,N,29,,211347,4987,MLR
30,,SING,C2B,H2B,no,N,30,,211347,4987,MLR
31,,SING,C3B,C4B,no,N,31,,211347,4987,MLR
32,,SING,C3B,O3B,no,N,32,,211347,4987,MLR
33,,SING,C3B,H3B,no,N,33,,211347,4987,MLR
34,,SING,C4B,C5B,no,N,34,,211347,4987,MLR
35,,SING,C4B,O4B,no,N,35,,211347,4987,MLR
36,,SING,C4B,H4B,no,N,36,,211347,4987,MLR
37,,SING,C5B,C6B,no,N,37,,211347,4987,MLR
38,,SING,C5B,O5B,no,N,38,,211347,4987,MLR
39,,SING,C5B,H5B,no,N,39,,211347,4987,MLR
40,,SING,C6B,O6B,no,N,40,,211347,4987,MLR
41,,SING,C6B,H6B1,no,N,41,,211347,4987,MLR
42,,SING,C6B,H6B2,no,N,42,,211347,4987,MLR
43,,SING,O2B,HOB2,no,N,43,,211347,4987,MLR
44,,SING,O3B,HOB3,no,N,44,,211347,4987,MLR
45,,SING,O4B,C1C,no,N,45,,211347,4987,MLR
46,,SING,O6B,HOB6,no,N,46,,211347,4987,MLR
47,,SING,C1C,C2C,no,N,47,,211347,4987,MLR
48,,SING,C1C,O5C,no,N,48,,211347,4987,MLR
49,,SING,C1C,H1C,no,N,49,,211347,4987,MLR
50,,SING,C2C,C3C,no,N,50,,211347,4987,MLR
51,,SING,C2C,O2C,no,N,51,,211347,4987,MLR
52,,SING,C2C,H2C,no,N,52,,211347,4987,MLR
53,,SING,C3C,C4C,no,N,53,,211347,4987,MLR
54,,SING,C3C,O3C,no,N,54,,211347,4987,MLR
55,,SING,C3C,H3C,no,N,55,,211347,4987,MLR
56,,SING,C4C,C5C,no,N,56,,211347,4987,MLR
57,,SING,C4C,O4C,no,N,57,,211347,4987,MLR
58,,SING,C4C,H4C,no,N,58,,211347,4987,MLR
59,,SING,C5C,C6C,no,N,59,,211347,4987,MLR
60,,SING,C5C,O5C,no,N,60,,211347,4987,MLR
61,,SING,C5C,H5C,no,N,61,,211347,4987,MLR
62,,SING,C6C,O6C,no,N,62,,211347,4987,MLR
63,,SING,C6C,H6C1,no,N,63,,211347,4987,MLR
64,,SING,C6C,H6C2,no,N,64,,211347,4987,MLR
65,,SING,O2C,HOC2,no,N,65,,211347,4987,MLR
66,,SING,O3C,HOC3,no,N,66,,211347,4987,MLR
67,,SING,O4C,HOC4,no,N,67,,211347,4987,MLR
68,,SING,O6C,HOC6,no,N,68,,211347,4987,MLR
1,,SING,C1,C2,no,N,1,,211418,499,AAC
2,,SING,C1,O1,no,N,2,,211418,499,AAC
3,,DOUB,C1,O2,no,N,3,,211418,499,AAC
4,,SING,C2,N1,no,N,4,,211418,499,AAC
5,,SING,C2,HC21,no,N,5,,211418,499,AAC
6,,SING,C2,HC22,no,N,6,,211418,499,AAC
7,,SING,C3,C4,no,N,7,,211418,499,AAC
8,,SING,C3,N1,no,N,8,,211418,499,AAC
9,,DOUB,C3,O3,no,N,9,,211418,499,AAC
10,,SING,C4,HC41,no,N,10,,211418,499,AAC
11,,SING,C4,HC42,no,N,11,,211418,499,AAC
12,,SING,C4,HC43,no,N,12,,211418,499,AAC
13,,SING,N1,HN1,no,N,13,,211418,499,AAC
14,,SING,O1,HO1,no,N,14,,211418,499,AAC
1,,SING,FE,NA,no,N,1,,211419,499,HEC
2,,SING,FE,NB,no,N,2,,211419,499,HEC
3,,SING,FE,NC,no,N,3,,211419,499,HEC
4,,SING,FE,ND,no,N,4,,211419,499,HEC
5,,DOUB,CHA,C1A,no,N,5,,211419,499,HEC
6,,SING,CHA,C4D,no,N,6,,211419,499,HEC
7,,SING,CHA,HHA,no,N,7,,211419,499,HEC
8,,DOUB,CHB,C4A,no,N,8,,211419,499,HEC
9,,SING,CHB,C1B,no,N,9,,211419,499,HEC
10,,SING,CHB,HHB,no,N,10,,211419,499,HEC
11,,DOUB,CHC,C4B,no,N,11,,211419,499,HEC
12,,SING,CHC,C1C,no,N,12,,211419,499,HEC
13,,SING,CHC,HHC,no,N,13,,211419,499,HEC
14,,DOUB,CHD,C4C,no,N,14,,211419,499,HEC
15,,SING,CHD,C1D,no,N,15,,211419,499,HEC
16,,SING,CHD,HHD,no,N,16,,211419,499,HEC
17,,SING,NA,C1A,yes,N,17,,211419,499,HEC
18,,SING,NA,C4A,yes,N,18,,211419,499,HEC
19,,SING,C1A,C2A,yes,N,19,,211419,499,HEC
20,,DOUB,C2A,C3A,yes,N,20,,211419,499,HEC
21,,SING,C2A,CAA,no,N,21,,211419,499,HEC
22,,SING,C3A,C4A,yes,N,22,,211419,499,HEC
23,,SING,C3A,CMA,no,N,23,,211419,499,HEC
24,,SING,CMA,HMA1,no,N,24,,211419,499,HEC
25,,SING,CMA,HMA2,no,N,25,,211419,499,HEC
26,,SING,CMA,HMA3,no,N,26,,211419,499,HEC
27,,SING,CAA,CBA,no,N,27,,211419,499,HEC
28,,SING,CAA,HAA1,no,N,28,,211419,499,HEC
29,,SING,CAA,HAA2,no,N,29,,211419,499,HEC
30,,SING,CBA,CGA,no,N,30,,211419,499,HEC
31,,SING,CBA,HBA1,no,N,31,,211419,499,HEC
32,,SING,CBA,HBA2,no,N,32,,211419,499,HEC
33,,DOUB,CGA,O1A,no,N,33,,211419,499,HEC
34,,SING,CGA,O2A,no,N,34,,211419,499,HEC
35,,SING,O2A,H2A,no,N,35,,211419,499,HEC
36,,SING,NB,C1B,yes,N,36,,211419,499,HEC
37,,SING,NB,C4B,yes,N,37,,211419,499,HEC
38,,DOUB,C1B,C2B,yes,N,38,,211419,499,HEC
39,,SING,C2B,C3B,yes,N,39,,211419,499,HEC
40,,SING,C2B,CMB,no,N,40,,211419,499,HEC
41,,SING,C3B,C4B,yes,N,41,,211419,499,HEC
42,,DOUB,C3B,CAB,no,E,42,,211419,499,HEC
43,,SING,CMB,HMB1,no,N,43,,211419,499,HEC
44,,SING,CMB,HMB2,no,N,44,,211419,499,HEC
45,,SING,CMB,HMB3,no,N,45,,211419,499,HEC
46,,SING,CAB,CBB,no,N,46,,211419,499,HEC
47,,SING,CAB,HAB,no,N,47,,211419,499,HEC
48,,SING,CBB,HBB1,no,N,48,,211419,499,HEC
49,,SING,CBB,HBB2,no,N,49,,211419,499,HEC
50,,SING,CBB,HBB3,no,N,50,,211419,499,HEC
51,,SING,NC,C1C,yes,N,51,,211419,499,HEC
52,,SING,NC,C4C,yes,N,52,,211419,499,HEC
53,,DOUB,C1C,C2C,yes,N,53,,211419,499,HEC
54,,SING,C2C,C3C,yes,N,54,,211419,499,HEC
55,,SING,C2C,CMC,no,N,55,,211419,499,HEC
56,,SING,C3C,C4C,yes,N,56,,211419,499,HEC
57,,DOUB,C3C,CAC,no,E,57,,211419,499,HEC
58,,SING,CMC,HMC1,no,N,58,,211419,499,HEC
59,,SING,CMC,HMC2,no,N,59,,211419,499,HEC
60,,SING,CMC,HMC3,no,N,60,,211419,499,HEC
61,,SING,CAC,CBC,no,N,61,,211419,499,HEC
62,,SING,CAC,HAC,no,N,62,,211419,499,HEC
63,,SING,CBC,HBC1,no,N,63,,211419,499,HEC
64,,SING,CBC,HBC2,no,N,64,,211419,499,HEC
65,,SING,CBC,HBC3,no,N,65,,211419,499,HEC
66,,SING,ND,C1D,yes,N,66,,211419,499,HEC
67,,SING,ND,C4D,yes,N,67,,211419,499,HEC
68,,DOUB,C1D,C2D,yes,N,68,,211419,499,HEC
69,,SING,C2D,C3D,yes,N,69,,211419,499,HEC
70,,SING,C2D,CMD,no,N,70,,211419,499,HEC
71,,DOUB,C3D,C4D,yes,N,71,,211419,499,HEC
72,,SING,C3D,CAD,no,N,72,,211419,499,HEC
73,,SING,CMD,HMD1,no,N,73,,211419,499,HEC
74,,SING,CMD,HMD2,no,N,74,,211419,499,HEC
75,,SING,CMD,HMD3,no,N,75,,211419,499,HEC
76,,SING,CAD,CBD,no,N,76,,211419,499,HEC
77,,SING,CAD,HAD1,no,N,77,,211419,499,HEC
78,,SING,CAD,HAD2,no,N,78,,211419,499,HEC
79,,SING,CBD,CGD,no,N,79,,211419,499,HEC
80,,SING,CBD,HBD1,no,N,80,,211419,499,HEC
81,,SING,CBD,HBD2,no,N,81,,211419,499,HEC
82,,DOUB,CGD,O1D,no,N,82,,211419,499,HEC
83,,SING,CGD,O2D,no,N,83,,211419,499,HEC
84,,SING,O2D,H2D,no,N,84,,211419,499,HEC
1,,SING,FE1,S1,no,N,1,,211463,4992,FES
2,,SING,FE1,S2,no,N,2,,211463,4992,FES
3,,SING,FE2,S1,no,N,3,,211463,4992,FES
4,,SING,FE2,S2,no,N,4,,211463,4992,FES
1,,DOUB,C,O,no,N,1,,211490,4993,ACE
2,,SING,C,CH3,no,N,2,,211490,4993,ACE
3,,SING,C,H,no,N,3,,211490,4993,ACE
4,,SING,CH3,H1,no,N,4,,211490,4993,ACE
5,,SING,CH3,H2,no,N,5,,211490,4993,ACE
6,,SING,CH3,H3,no,N,6,,211490,4993,ACE
1,,SING,N,CA,no,N,1,,211491,4993,DIV
2,,SING,N,H,no,N,2,,211491,4993,DIV
3,,SING,N,H2,no,N,3,,211491,4993,DIV
4,,SING,CA,CB1,no,N,4,,211491,4993,DIV
5,,SING,CA,CB2,no,N,5,,211491,4993,DIV
6,,SING,CA,C,no,N,6,,211491,4993,DIV
7,,SING,CB1,CG1,no,N,7,,211491,4993,DIV
8,,SING,CB1,HB11,no,N,8,,211491,4993,DIV
9,,SING,CB1,HB12,no,N,9,,211491,4993,DIV
10,,SING,CG1,HG11,no,N,10,,211491,4993,DIV
11,,SING,CG1,HG12,no,N,11,,211491,4993,DIV
12,,SING,CG1,HG13,no,N,12,,211491,4993,DIV
13,,SING,CB2,HB21,no,N,13,,211491,4993,DIV
14,,SING,CB2,HB22,no,N,14,,211491,4993,DIV
15,,SING,CB2,HB23,no,N,15,,211491,4993,DIV
16,,DOUB,C,O,no,N,16,,211491,4993,DIV
17,,SING,C,OXT,no,N,17,,211491,4993,DIV
18,,SING,OXT,HXT,no,N,18,,211491,4993,DIV
1,,SING,N,CA,no,N,1,,211492,4993,AIB
2,,SING,N,H,no,N,2,,211492,4993,AIB
3,,SING,N,H2,no,N,3,,211492,4993,AIB
4,,SING,CA,C,no,N,4,,211492,4993,AIB
5,,SING,CA,CB1,no,N,5,,211492,4993,AIB
6,,SING,CA,CB2,no,N,6,,211492,4993,AIB
7,,DOUB,C,O,no,N,7,,211492,4993,AIB
8,,SING,C,OXT,no,N,8,,211492,4993,AIB
9,,SING,OXT,HO2,no,N,9,,211492,4993,AIB
10,,SING,CB1,HB11,no,N,10,,211492,4993,AIB
11,,SING,CB1,HB12,no,N,11,,211492,4993,AIB
12,,SING,CB1,HB13,no,N,12,,211492,4993,AIB
13,,SING,CB2,HB21,no,N,13,,211492,4993,AIB
14,,SING,CB2,HB22,no,N,14,,211492,4993,AIB
15,,SING,CB2,HB23,no,N,15,,211492,4993,AIB
1,,SING,N,CA,no,N,1,,211493,4993,HYP
2,,SING,N,CD,no,N,2,,211493,4993,HYP
3,,SING,N,H,no,N,3,,211493,4993,HYP
4,,SING,CA,C,no,N,4,,211493,4993,HYP
5,,SING,CA,CB,no,N,5,,211493,4993,HYP
6,,SING,CA,HA,no,N,6,,211493,4993,HYP
7,,DOUB,C,O,no,N,7,,211493,4993,HYP
8,,SING,C,OXT,no,N,8,,211493,4993,HYP
9,,SING,CB,CG,no,N,9,,211493,4993,HYP
10,,SING,CB,HB2,no,N,10,,211493,4993,HYP
11,,SING,CB,HB3,no,N,11,,211493,4993,HYP
12,,SING,CG,CD,no,N,12,,211493,4993,HYP
13,,SING,CG,OD1,no,N,13,,211493,4993,HYP
14,,SING,CG,HG,no,N,14,,211493,4993,HYP
15,,SING,CD,HD22,no,N,15,,211493,4993,HYP
16,,SING,CD,HD23,no,N,16,,211493,4993,HYP
17,,SING,OD1,HD1,no,N,17,,211493,4993,HYP
18,,SING,OXT,HXT,no,N,18,,211493,4993,HYP
1,,SING,N,CA,no,N,1,,211494,4993,PHL
2,,SING,N,H,no,N,2,,211494,4993,PHL
3,,SING,N,H2,no,N,3,,211494,4993,PHL
4,,SING,CA,C,no,N,4,,211494,4993,PHL
5,,SING,CA,CB,no,N,5,,211494,4993,PHL
6,,SING,CA,HA,no,N,6,,211494,4993,PHL
7,,SING,C,O,no,N,7,,211494,4993,PHL
8,,SING,C,HC1,no,N,8,,211494,4993,PHL
9,,SING,C,HC2,no,N,9,,211494,4993,PHL
10,,SING,O,HO,no,N,10,,211494,4993,PHL
11,,SING,CB,CG,no,N,11,,211494,4993,PHL
12,,SING,CB,HB2,no,N,12,,211494,4993,PHL
13,,SING,CB,HB3,no,N,13,,211494,4993,PHL
14,,DOUB,CG,CD1,yes,N,14,,211494,4993,PHL
15,,SING,CG,CD2,yes,N,15,,211494,4993,PHL
16,,SING,CD1,CE1,yes,N,16,,211494,4993,PHL
17,,SING,CD1,HD1,no,N,17,,211494,4993,PHL
18,,DOUB,CD2,CE2,yes,N,18,,211494,4993,PHL
19,,SING,CD2,HD2,no,N,19,,211494,4993,PHL
20,,DOUB,CE1,CZ,yes,N,20,,211494,4993,PHL
21,,SING,CE1,HE1,no,N,21,,211494,4993,PHL
22,,SING,CE2,CZ,yes,N,22,,211494,4993,PHL
23,,SING,CE2,HE2,no,N,23,,211494,4993,PHL
24,,SING,CZ,HZ,no,N,24,,211494,4993,PHL
1,,SING,S1,C2,no,N,1,,211516,4994,EMD
2,,SING,S1,C6,no,N,2,,211516,4994,EMD
3,,DOUB,C2,O2,no,N,3,,211516,4994,EMD
4,,SING,C2,N3,no,N,4,,211516,4994,EMD
5,,SING,N3,N4,no,N,5,,211516,4994,EMD
6,,SING,N3,H3,no,N,6,,211516,4994,EMD
7,,DOUB,N4,C5,no,N,7,,211516,4994,EMD
8,,SING,C5,C6,no,N,8,,211516,4994,EMD
9,,SING,C5,C8,no,N,9,,211516,4994,EMD
10,,SING,C6,C7,no,N,10,,211516,4994,EMD
11,,SING,C6,H6,no,N,11,,211516,4994,EMD
12,,SING,C7,H71,no,N,12,,211516,4994,EMD
13,,SING,C7,H72,no,N,13,,211516,4994,EMD
14,,SING,C7,H73,no,N,14,,211516,4994,EMD
15,,DOUB,C8,C9,yes,N,15,,211516,4994,EMD
16,,SING,C8,C13,yes,N,16,,211516,4994,EMD
17,,SING,C9,C10,yes,N,17,,211516,4994,EMD
18,,SING,C9,H9,no,N,18,,211516,4994,EMD
19,,DOUB,C10,C11,yes,N,19,,211516,4994,EMD
20,,SING,C10,C17,no,N,20,,211516,4994,EMD
21,,SING,C11,C12,yes,N,21,,211516,4994,EMD
22,,SING,C11,N14,no,N,22,,211516,4994,EMD
23,,DOUB,C12,C13,yes,N,23,,211516,4994,EMD
24,,SING,C12,H12,no,N,24,,211516,4994,EMD
25,,SING,C13,H13,no,N,25,,211516,4994,EMD
26,,SING,N14,C15,no,N,26,,211516,4994,EMD
27,,SING,N14,C18,no,N,27,,211516,4994,EMD
28,,SING,C15,C16,no,N,28,,211516,4994,EMD
29,,SING,C15,H151,no,N,29,,211516,4994,EMD
30,,SING,C15,H152,no,N,30,,211516,4994,EMD
31,,SING,C16,C17,no,N,31,,211516,4994,EMD
32,,SING,C16,H161,no,N,32,,211516,4994,EMD
33,,SING,C16,H162,no,N,33,,211516,4994,EMD
34,,SING,C17,H171,no,N,34,,211516,4994,EMD
35,,SING,C17,H172,no,N,35,,211516,4994,EMD
36,,DOUB,C18,O18,no,N,36,,211516,4994,EMD
37,,SING,C18,C19,no,N,37,,211516,4994,EMD
38,,DOUB,C19,C20,yes,N,38,,211516,4994,EMD
39,,SING,C19,C24,yes,N,39,,211516,4994,EMD
40,,SING,C20,C21,yes,N,40,,211516,4994,EMD
41,,SING,C20,H20,no,N,41,,211516,4994,EMD
42,,SING,C21,O21,no,N,42,,211516,4994,EMD
43,,DOUB,C21,C22,yes,N,43,,211516,4994,EMD
44,,SING,O21,C25,no,N,44,,211516,4994,EMD
45,,SING,C22,O22,no,N,45,,211516,4994,EMD
46,,SING,C22,C23,yes,N,46,,211516,4994,EMD
47,,SING,O22,C26,no,N,47,,211516,4994,EMD
48,,DOUB,C23,C24,yes,N,48,,211516,4994,EMD
49,,SING,C23,H23,no,N,49,,211516,4994,EMD
50,,SING,C24,H24,no,N,50,,211516,4994,EMD
51,,SING,C25,H251,no,N,51,,211516,4994,EMD
52,,SING,C25,H252,no,N,52,,211516,4994,EMD
53,,SING,C25,H253,no,N,53,,211516,4994,EMD
54,,SING,C26,H261,no,N,54,,211516,4994,EMD
55,,SING,C26,H262,no,N,55,,211516,4994,EMD
56,,SING,C26,H263,no,N,56,,211516,4994,EMD
1,,DOUB,C,O,no,N,1,,211698,500,ACE
2,,SING,C,CH3,no,N,2,,211698,500,ACE
3,,SING,C,H,no,N,3,,211698,500,ACE
4,,SING,CH3,H1,no,N,4,,211698,500,ACE
5,,SING,CH3,H2,no,N,5,,211698,500,ACE
6,,SING,CH3,H3,no,N,6,,211698,500,ACE
1,,SING,FE,NA,no,N,1,,211699,500,HEC
2,,SING,FE,NB,no,N,2,,211699,500,HEC
3,,SING,FE,NC,no,N,3,,211699,500,HEC
4,,SING,FE,ND,no,N,4,,211699,500,HEC
5,,DOUB,CHA,C1A,no,N,5,,211699,500,HEC
6,,SING,CHA,C4D,no,N,6,,211699,500,HEC
7,,SING,CHA,HHA,no,N,7,,211699,500,HEC
8,,DOUB,CHB,C4A,no,N,8,,211699,500,HEC
9,,SING,CHB,C1B,no,N,9,,211699,500,HEC
10,,SING,CHB,HHB,no,N,10,,211699,500,HEC
11,,DOUB,CHC,C4B,no,N,11,,211699,500,HEC
12,,SING,CHC,C1C,no,N,12,,211699,500,HEC
13,,SING,CHC,HHC,no,N,13,,211699,500,HEC
14,,DOUB,CHD,C4C,no,N,14,,211699,500,HEC
15,,SING,CHD,C1D,no,N,15,,211699,500,HEC
16,,SING,CHD,HHD,no,N,16,,211699,500,HEC
17,,SING,NA,C1A,yes,N,17,,211699,500,HEC
18,,SING,NA,C4A,yes,N,18,,211699,500,HEC
19,,SING,C1A,C2A,yes,N,19,,211699,500,HEC
20,,DOUB,C2A,C3A,yes,N,20,,211699,500,HEC
21,,SING,C2A,CAA,no,N,21,,211699,500,HEC
22,,SING,C3A,C4A,yes,N,22,,211699,500,HEC
23,,SING,C3A,CMA,no,N,23,,211699,500,HEC
24,,SING,CMA,HMA1,no,N,24,,211699,500,HEC
25,,SING,CMA,HMA2,no,N,25,,211699,500,HEC
26,,SING,CMA,HMA3,no,N,26,,211699,500,HEC
27,,SING,CAA,CBA,no,N,27,,211699,500,HEC
28,,SING,CAA,HAA1,no,N,28,,211699,500,HEC
29,,SING,CAA,HAA2,no,N,29,,211699,500,HEC
30,,SING,CBA,CGA,no,N,30,,211699,500,HEC
31,,SING,CBA,HBA1,no,N,31,,211699,500,HEC
32,,SING,CBA,HBA2,no,N,32,,211699,500,HEC
33,,DOUB,CGA,O1A,no,N,33,,211699,500,HEC
34,,SING,CGA,O2A,no,N,34,,211699,500,HEC
35,,SING,O2A,H2A,no,N,35,,211699,500,HEC
36,,SING,NB,C1B,yes,N,36,,211699,500,HEC
37,,SING,NB,C4B,yes,N,37,,211699,500,HEC
38,,DOUB,C1B,C2B,yes,N,38,,211699,500,HEC
39,,SING,C2B,C3B,yes,N,39,,211699,500,HEC
40,,SING,C2B,CMB,no,N,40,,211699,500,HEC
41,,SING,C3B,C4B,yes,N,41,,211699,500,HEC
42,,DOUB,C3B,CAB,no,E,42,,211699,500,HEC
43,,SING,CMB,HMB1,no,N,43,,211699,500,HEC
44,,SING,CMB,HMB2,no,N,44,,211699,500,HEC
45,,SING,CMB,HMB3,no,N,45,,211699,500,HEC
46,,SING,CAB,CBB,no,N,46,,211699,500,HEC
47,,SING,CAB,HAB,no,N,47,,211699,500,HEC
48,,SING,CBB,HBB1,no,N,48,,211699,500,HEC
49,,SING,CBB,HBB2,no,N,49,,211699,500,HEC
50,,SING,CBB,HBB3,no,N,50,,211699,500,HEC
51,,SING,NC,C1C,yes,N,51,,211699,500,HEC
52,,SING,NC,C4C,yes,N,52,,211699,500,HEC
53,,DOUB,C1C,C2C,yes,N,53,,211699,500,HEC
54,,SING,C2C,C3C,yes,N,54,,211699,500,HEC
55,,SING,C2C,CMC,no,N,55,,211699,500,HEC
56,,SING,C3C,C4C,yes,N,56,,211699,500,HEC
57,,DOUB,C3C,CAC,no,E,57,,211699,500,HEC
58,,SING,CMC,HMC1,no,N,58,,211699,500,HEC
59,,SING,CMC,HMC2,no,N,59,,211699,500,HEC
60,,SING,CMC,HMC3,no,N,60,,211699,500,HEC
61,,SING,CAC,CBC,no,N,61,,211699,500,HEC
62,,SING,CAC,HAC,no,N,62,,211699,500,HEC
63,,SING,CBC,HBC1,no,N,63,,211699,500,HEC
64,,SING,CBC,HBC2,no,N,64,,211699,500,HEC
65,,SING,CBC,HBC3,no,N,65,,211699,500,HEC
66,,SING,ND,C1D,yes,N,66,,211699,500,HEC
67,,SING,ND,C4D,yes,N,67,,211699,500,HEC
68,,DOUB,C1D,C2D,yes,N,68,,211699,500,HEC
69,,SING,C2D,C3D,yes,N,69,,211699,500,HEC
70,,SING,C2D,CMD,no,N,70,,211699,500,HEC
71,,DOUB,C3D,C4D,yes,N,71,,211699,500,HEC
72,,SING,C3D,CAD,no,N,72,,211699,500,HEC
73,,SING,CMD,HMD1,no,N,73,,211699,500,HEC
74,,SING,CMD,HMD2,no,N,74,,211699,500,HEC
75,,SING,CMD,HMD3,no,N,75,,211699,500,HEC
76,,SING,CAD,CBD,no,N,76,,211699,500,HEC
77,,SING,CAD,HAD1,no,N,77,,211699,500,HEC
78,,SING,CAD,HAD2,no,N,78,,211699,500,HEC
79,,SING,CBD,CGD,no,N,79,,211699,500,HEC
80,,SING,CBD,HBD1,no,N,80,,211699,500,HEC
81,,SING,CBD,HBD2,no,N,81,,211699,500,HEC
82,,DOUB,CGD,O1D,no,N,82,,211699,500,HEC
83,,SING,CGD,O2D,no,N,83,,211699,500,HEC
84,,SING,O2D,H2D,no,N,84,,211699,500,HEC
1,,DOUB,C17,C18,yes,N,1,,211736,50000,EEY
2,,SING,C17,N16,yes,N,2,,211736,50000,EEY
3,,SING,C18,C13,yes,N,3,,211736,50000,EEY
4,,DOUB,N16,C15,yes,N,4,,211736,50000,EEY
5,,DOUB,C13,C14,yes,N,5,,211736,50000,EEY
6,,SING,C13,N12,no,N,6,,211736,50000,EEY
7,,SING,C15,C14,yes,N,7,,211736,50000,EEY
8,,DOUB,O11,C10,no,N,8,,211736,50000,EEY
9,,SING,C10,N12,no,N,9,,211736,50000,EEY
10,,SING,C10,C04,no,N,10,,211736,50000,EEY
11,,DOUB,C03,C04,yes,N,11,,211736,50000,EEY
12,,SING,C03,C02,yes,N,12,,211736,50000,EEY
13,,SING,C04,C05,yes,N,13,,211736,50000,EEY
14,,DOUB,C02,C01,yes,N,14,,211736,50000,EEY
15,,DOUB,C05,C06,yes,N,15,,211736,50000,EEY
16,,SING,C01,C06,yes,N,16,,211736,50000,EEY
17,,SING,C06,N07,no,N,17,,211736,50000,EEY
18,,DOUB,N07,O09,no,N,18,,211736,50000,EEY
19,,SING,N07,O08,no,N,19,,211736,50000,EEY
20,,SING,C03,CL1,no,N,20,,211736,50000,EEY
21,,SING,N12,H1,no,N,21,,211736,50000,EEY
22,,SING,C15,H2,no,N,22,,211736,50000,EEY
23,,SING,C17,H3,no,N,23,,211736,50000,EEY
24,,SING,C01,H4,no,N,24,,211736,50000,EEY
25,,SING,C02,H5,no,N,25,,211736,50000,EEY
26,,SING,C05,H6,no,N,26,,211736,50000,EEY
27,,SING,C14,H7,no,N,27,,211736,50000,EEY
28,,SING,C18,H8,no,N,28,,211736,50000,EEY
1,,SING,P1,O2P,no,N,1,,211754,50001,C2E
2,,DOUB,O1P,P1,no,N,2,,211754,50001,C2E
3,,SING,O5',P1,no,N,3,,211754,50001,C2E
4,,SING,C5',O5',no,N,4,,211754,50001,C2E
5,,SING,C4',O4',no,N,5,,211754,50001,C2E
6,,SING,C4',C5',no,N,6,,211754,50001,C2E
7,,SING,C3',C4',no,N,7,,211754,50001,C2E
8,,SING,O3',P11,no,N,8,,211754,50001,C2E
9,,SING,O3',C3',no,N,9,,211754,50001,C2E
10,,SING,C2',C3',no,N,10,,211754,50001,C2E
11,,SING,C2',C1',no,N,11,,211754,50001,C2E
12,,SING,O2',C2',no,N,12,,211754,50001,C2E
13,,SING,C1',O4',no,N,13,,211754,50001,C2E
14,,SING,C1',N9,no,N,14,,211754,50001,C2E
15,,SING,N9,C4,yes,N,15,,211754,50001,C2E
16,,SING,N9,C8,yes,N,16,,211754,50001,C2E
17,,DOUB,C8,N7,yes,N,17,,211754,50001,C2E
18,,SING,C5,N7,yes,N,18,,211754,50001,C2E
19,,SING,C5,C6,no,N,19,,211754,50001,C2E
20,,DOUB,C6,O6,no,N,20,,211754,50001,C2E
21,,SING,N1,C6,no,N,21,,211754,50001,C2E
22,,SING,C2,N1,no,N,22,,211754,50001,C2E
23,,SING,N2,C2,no,N,23,,211754,50001,C2E
24,,DOUB,N3,C2,no,N,24,,211754,50001,C2E
25,,SING,N3,C4,no,N,25,,211754,50001,C2E
26,,DOUB,C4,C5,yes,N,26,,211754,50001,C2E
27,,SING,P11,O21,no,N,27,,211754,50001,C2E
28,,SING,P11,O5A,no,N,28,,211754,50001,C2E
29,,DOUB,O11,P11,no,N,29,,211754,50001,C2E
30,,SING,C5A,O5A,no,N,30,,211754,50001,C2E
31,,SING,C5A,C4A,no,N,31,,211754,50001,C2E
32,,SING,C4A,O4A,no,N,32,,211754,50001,C2E
33,,SING,C4A,C3A,no,N,33,,211754,50001,C2E
34,,SING,O4A,C1A,no,N,34,,211754,50001,C2E
35,,SING,C3A,C2A,no,N,35,,211754,50001,C2E
36,,SING,O3A,C3A,no,N,36,,211754,50001,C2E
37,,SING,O3A,P1,no,N,37,,211754,50001,C2E
38,,SING,C2A,O2A,no,N,38,,211754,50001,C2E
39,,SING,C1A,C2A,no,N,39,,211754,50001,C2E
40,,SING,C1A,N91,no,N,40,,211754,50001,C2E
41,,SING,N91,C41,yes,N,41,,211754,50001,C2E
42,,DOUB,C81,N71,yes,N,42,,211754,50001,C2E
43,,SING,C81,N91,yes,N,43,,211754,50001,C2E
44,,SING,N71,C51,yes,N,44,,211754,50001,C2E
45,,DOUB,C51,C41,yes,N,45,,211754,50001,C2E
46,,SING,C51,C61,no,N,46,,211754,50001,C2E
47,,DOUB,C61,O61,no,N,47,,211754,50001,C2E
48,,SING,C61,N11,no,N,48,,211754,50001,C2E
49,,SING,C21,N11,no,N,49,,211754,50001,C2E
50,,SING,C21,N21,no,N,50,,211754,50001,C2E
51,,DOUB,N31,C21,no,N,51,,211754,50001,C2E
52,,SING,C41,N31,no,N,52,,211754,50001,C2E
53,,SING,O2P,HO2P,no,N,53,,211754,50001,C2E
54,,SING,C5',H5'1,no,N,54,,211754,50001,C2E
55,,SING,C5',H5'2,no,N,55,,211754,50001,C2E
56,,SING,C4',H4',no,N,56,,211754,50001,C2E
57,,SING,C3',H3',no,N,57,,211754,50001,C2E
58,,SING,C2',H2',no,N,58,,211754,50001,C2E
59,,SING,O2',HO2',no,N,59,,211754,50001,C2E
60,,SING,C1',H1',no,N,60,,211754,50001,C2E
61,,SING,C8,H8,no,N,61,,211754,50001,C2E
62,,SING,N1,HN1,no,N,62,,211754,50001,C2E
63,,SING,N2,HN21,no,N,63,,211754,50001,C2E
64,,SING,N2,HN22,no,N,64,,211754,50001,C2E
65,,SING,O21,HO21,no,N,65,,211754,50001,C2E
66,,SING,C5A,H511,no,N,66,,211754,50001,C2E
67,,SING,C5A,H512,no,N,67,,211754,50001,C2E
68,,SING,C4A,H4A,no,N,68,,211754,50001,C2E
69,,SING,C3A,H3A,no,N,69,,211754,50001,C2E
70,,SING,C2A,H2A,no,N,70,,211754,50001,C2E
71,,SING,O2A,HO2A,no,N,71,,211754,50001,C2E
72,,SING,C1A,H1A,no,N,72,,211754,50001,C2E
73,,SING,C81,H81,no,N,73,,211754,50001,C2E
74,,SING,N11,HN11,no,N,74,,211754,50001,C2E
75,,SING,N21,HN24,no,N,75,,211754,50001,C2E
76,,SING,N21,HN23,no,N,76,,211754,50001,C2E
1,,SING,N1,CA1,no,N,1,,211859,50010,PIA
2,,SING,N1,HN11,no,N,2,,211859,50010,PIA
3,,SING,N1,HN12,no,N,3,,211859,50010,PIA
4,,SING,CA1,CB1,no,N,4,,211859,50010,PIA
5,,SING,CA1,C1,no,N,5,,211859,50010,PIA
6,,SING,CA1,HA1,no,N,6,,211859,50010,PIA
7,,SING,CB1,HB11,no,N,7,,211859,50010,PIA
8,,SING,CB1,HB12,no,N,8,,211859,50010,PIA
9,,SING,CB1,HB13,no,N,9,,211859,50010,PIA
10,,DOUB,C1,N2,no,N,10,,211859,50010,PIA
11,,SING,C1,N3,no,N,11,,211859,50010,PIA
12,,SING,N2,CA2,no,N,12,,211859,50010,PIA
13,,SING,N3,C2,no,N,13,,211859,50010,PIA
14,,SING,N3,CA3,no,N,14,,211859,50010,PIA
15,,DOUB,C2,O2,no,N,15,,211859,50010,PIA
16,,SING,C2,CA2,no,N,16,,211859,50010,PIA
17,,DOUB,CA2,CB2,no,Z,17,,211859,50010,PIA
18,,SING,CA3,C3,no,N,18,,211859,50010,PIA
19,,SING,CA3,HA31,no,N,19,,211859,50010,PIA
20,,SING,CA3,HA32,no,N,20,,211859,50010,PIA
21,,DOUB,C3,O3,no,N,21,,211859,50010,PIA
22,,SING,C3,O31,no,N,22,,211859,50010,PIA
23,,SING,CB2,CG2,no,N,23,,211859,50010,PIA
24,,SING,CB2,HB2,no,N,24,,211859,50010,PIA
25,,DOUB,CG2,CD1,yes,N,25,,211859,50010,PIA
26,,SING,CG2,CD2,yes,N,26,,211859,50010,PIA
27,,SING,CD1,CE1,yes,N,27,,211859,50010,PIA
28,,SING,CD1,HD1,no,N,28,,211859,50010,PIA
29,,DOUB,CD2,CE2,yes,N,29,,211859,50010,PIA
30,,SING,CD2,HD2,no,N,30,,211859,50010,PIA
31,,DOUB,CE1,CZ,yes,N,31,,211859,50010,PIA
32,,SING,CE1,HE1,no,N,32,,211859,50010,PIA
33,,SING,CE2,CZ,yes,N,33,,211859,50010,PIA
34,,SING,CE2,HE2,no,N,34,,211859,50010,PIA
35,,SING,CZ,OH,no,N,35,,211859,50010,PIA
36,,SING,OH,HH,no,N,36,,211859,50010,PIA
37,,SING,O31,HO',no,N,37,,211859,50010,PIA
1,,SING,N1,CA1,no,N,1,,211875,50011,PIA
2,,SING,N1,HN11,no,N,2,,211875,50011,PIA
3,,SING,N1,HN12,no,N,3,,211875,50011,PIA
4,,SING,CA1,CB1,no,N,4,,211875,50011,PIA
5,,SING,CA1,C1,no,N,5,,211875,50011,PIA
6,,SING,CA1,HA1,no,N,6,,211875,50011,PIA
7,,SING,CB1,HB11,no,N,7,,211875,50011,PIA
8,,SING,CB1,HB12,no,N,8,,211875,50011,PIA
9,,SING,CB1,HB13,no,N,9,,211875,50011,PIA
10,,DOUB,C1,N2,no,N,10,,211875,50011,PIA
11,,SING,C1,N3,no,N,11,,211875,50011,PIA
12,,SING,N2,CA2,no,N,12,,211875,50011,PIA
13,,SING,N3,C2,no,N,13,,211875,50011,PIA
14,,SING,N3,CA3,no,N,14,,211875,50011,PIA
15,,DOUB,C2,O2,no,N,15,,211875,50011,PIA
16,,SING,C2,CA2,no,N,16,,211875,50011,PIA
17,,DOUB,CA2,CB2,no,Z,17,,211875,50011,PIA
18,,SING,CA3,C3,no,N,18,,211875,50011,PIA
19,,SING,CA3,HA31,no,N,19,,211875,50011,PIA
20,,SING,CA3,HA32,no,N,20,,211875,50011,PIA
21,,DOUB,C3,O3,no,N,21,,211875,50011,PIA
22,,SING,C3,O31,no,N,22,,211875,50011,PIA
23,,SING,CB2,CG2,no,N,23,,211875,50011,PIA
24,,SING,CB2,HB2,no,N,24,,211875,50011,PIA
25,,DOUB,CG2,CD1,yes,N,25,,211875,50011,PIA
26,,SING,CG2,CD2,yes,N,26,,211875,50011,PIA
27,,SING,CD1,CE1,yes,N,27,,211875,50011,PIA
28,,SING,CD1,HD1,no,N,28,,211875,50011,PIA
29,,DOUB,CD2,CE2,yes,N,29,,211875,50011,PIA
30,,SING,CD2,HD2,no,N,30,,211875,50011,PIA
31,,DOUB,CE1,CZ,yes,N,31,,211875,50011,PIA
32,,SING,CE1,HE1,no,N,32,,211875,50011,PIA
33,,SING,CE2,CZ,yes,N,33,,211875,50011,PIA
34,,SING,CE2,HE2,no,N,34,,211875,50011,PIA
35,,SING,CZ,OH,no,N,35,,211875,50011,PIA
36,,SING,OH,HH,no,N,36,,211875,50011,PIA
37,,SING,O31,HO',no,N,37,,211875,50011,PIA
1,,DOUB,C,O,no,N,1,,211906,50013,1RG
2,,SING,C,CA,no,N,2,,211906,50013,1RG
3,,SING,C,NAX,no,N,3,,211906,50013,1RG
4,,SING,N,CA,no,N,4,,211906,50013,1RG
5,,SING,N,CD,no,N,5,,211906,50013,1RG
6,,SING,CA,CB,no,N,6,,211906,50013,1RG
7,,SING,CB,CG,no,N,7,,211906,50013,1RG
8,,SING,CD,CG,no,N,8,,211906,50013,1RG
9,,SING,CG,SAK,no,N,9,,211906,50013,1RG
10,,SING,CAA,CAB,no,N,10,,211906,50013,1RG
11,,DOUB,CAA,OAC,no,N,11,,211906,50013,1RG
12,,SING,CAB,CAD,no,N,12,,211906,50013,1RG
13,,SING,CAB,CAE,no,N,13,,211906,50013,1RG
14,,SING,CAD,CAH,no,N,14,,211906,50013,1RG
15,,SING,CAD,NAJ,no,N,15,,211906,50013,1RG
16,,SING,CAE,CAF,no,N,16,,211906,50013,1RG
17,,SING,CAE,OAG,no,N,17,,211906,50013,1RG
18,,SING,CAH,CAI,no,N,18,,211906,50013,1RG
19,,SING,CAH,CAS,no,N,19,,211906,50013,1RG
20,,SING,CAI,SAK,no,N,20,,211906,50013,1RG
21,,DOUB,CAI,CAL,no,N,21,,211906,50013,1RG
22,,SING,NAJ,CAL,no,N,22,,211906,50013,1RG
23,,SING,CAL,CAM,no,N,23,,211906,50013,1RG
24,,DOUB,CAM,OAT,no,N,24,,211906,50013,1RG
25,,SING,CAM,OAU,no,N,25,,211906,50013,1RG
26,,SING,NAX,CAY,no,N,26,,211906,50013,1RG
27,,DOUB,CAY,CAZ,yes,N,27,,211906,50013,1RG
28,,SING,CAY,CBD,yes,N,28,,211906,50013,1RG
29,,SING,CAZ,CBA,yes,N,29,,211906,50013,1RG
30,,DOUB,CBA,CBB,yes,N,30,,211906,50013,1RG
31,,SING,CBA,CBE,no,N,31,,211906,50013,1RG
32,,SING,CBB,CBC,yes,N,32,,211906,50013,1RG
33,,DOUB,CBC,CBD,yes,N,33,,211906,50013,1RG
34,,SING,CBE,OBF,no,N,34,,211906,50013,1RG
35,,DOUB,CBE,OBG,no,N,35,,211906,50013,1RG
36,,SING,N,HN,no,N,36,,211906,50013,1RG
37,,SING,CA,HA,no,N,37,,211906,50013,1RG
38,,SING,CB,HB,no,N,38,,211906,50013,1RG
39,,SING,CB,HBA,no,N,39,,211906,50013,1RG
40,,SING,CD,HD,no,N,40,,211906,50013,1RG
41,,SING,CD,HDA,no,N,41,,211906,50013,1RG
42,,SING,CG,HG,no,N,42,,211906,50013,1RG
43,,SING,CAA,HAA,no,N,43,,211906,50013,1RG
44,,SING,CAB,HAB,no,N,44,,211906,50013,1RG
45,,SING,CAD,HAD,no,N,45,,211906,50013,1RG
46,,SING,CAE,HAE,no,N,46,,211906,50013,1RG
47,,SING,CAF,HAF,no,N,47,,211906,50013,1RG
48,,SING,CAF,HAFA,no,N,48,,211906,50013,1RG
49,,SING,CAF,HAFB,no,N,49,,211906,50013,1RG
50,,SING,OAG,HOAG,no,N,50,,211906,50013,1RG
51,,SING,CAH,HAH,no,N,51,,211906,50013,1RG
52,,SING,NAJ,HNAJ,no,N,52,,211906,50013,1RG
53,,SING,CAS,HAS,no,N,53,,211906,50013,1RG
54,,SING,CAS,HASA,no,N,54,,211906,50013,1RG
55,,SING,CAS,HASB,no,N,55,,211906,50013,1RG
56,,SING,NAX,HNAX,no,N,56,,211906,50013,1RG
57,,SING,CAZ,HAZ,no,N,57,,211906,50013,1RG
58,,SING,CBB,HBB,no,N,58,,211906,50013,1RG
59,,SING,CBC,HBC,no,N,59,,211906,50013,1RG
60,,SING,CBD,HBD,no,N,60,,211906,50013,1RG
61,,SING,OAU,HOAU,no,N,61,,211906,50013,1RG
62,,SING,OBF,HOBF,no,N,62,,211906,50013,1RG
1,,SING,FE,NA,no,N,1,,212169,5005,HEC
2,,SING,FE,NB,no,N,2,,212169,5005,HEC
3,,SING,FE,NC,no,N,3,,212169,5005,HEC
4,,SING,FE,ND,no,N,4,,212169,5005,HEC
5,,DOUB,CHA,C1A,no,N,5,,212169,5005,HEC
6,,SING,CHA,C4D,no,N,6,,212169,5005,HEC
7,,SING,CHA,HHA,no,N,7,,212169,5005,HEC
8,,DOUB,CHB,C4A,no,N,8,,212169,5005,HEC
9,,SING,CHB,C1B,no,N,9,,212169,5005,HEC
10,,SING,CHB,HHB,no,N,10,,212169,5005,HEC
11,,DOUB,CHC,C4B,no,N,11,,212169,5005,HEC
12,,SING,CHC,C1C,no,N,12,,212169,5005,HEC
13,,SING,CHC,HHC,no,N,13,,212169,5005,HEC
14,,DOUB,CHD,C4C,no,N,14,,212169,5005,HEC
15,,SING,CHD,C1D,no,N,15,,212169,5005,HEC
16,,SING,CHD,HHD,no,N,16,,212169,5005,HEC
17,,SING,NA,C1A,yes,N,17,,212169,5005,HEC
18,,SING,NA,C4A,yes,N,18,,212169,5005,HEC
19,,SING,C1A,C2A,yes,N,19,,212169,5005,HEC
20,,DOUB,C2A,C3A,yes,N,20,,212169,5005,HEC
21,,SING,C2A,CAA,no,N,21,,212169,5005,HEC
22,,SING,C3A,C4A,yes,N,22,,212169,5005,HEC
23,,SING,C3A,CMA,no,N,23,,212169,5005,HEC
24,,SING,CMA,HMA1,no,N,24,,212169,5005,HEC
25,,SING,CMA,HMA2,no,N,25,,212169,5005,HEC
26,,SING,CMA,HMA3,no,N,26,,212169,5005,HEC
27,,SING,CAA,CBA,no,N,27,,212169,5005,HEC
28,,SING,CAA,HAA1,no,N,28,,212169,5005,HEC
29,,SING,CAA,HAA2,no,N,29,,212169,5005,HEC
30,,SING,CBA,CGA,no,N,30,,212169,5005,HEC
31,,SING,CBA,HBA1,no,N,31,,212169,5005,HEC
32,,SING,CBA,HBA2,no,N,32,,212169,5005,HEC
33,,DOUB,CGA,O1A,no,N,33,,212169,5005,HEC
34,,SING,CGA,O2A,no,N,34,,212169,5005,HEC
35,,SING,O2A,H2A,no,N,35,,212169,5005,HEC
36,,SING,NB,C1B,yes,N,36,,212169,5005,HEC
37,,SING,NB,C4B,yes,N,37,,212169,5005,HEC
38,,DOUB,C1B,C2B,yes,N,38,,212169,5005,HEC
39,,SING,C2B,C3B,yes,N,39,,212169,5005,HEC
40,,SING,C2B,CMB,no,N,40,,212169,5005,HEC
41,,SING,C3B,C4B,yes,N,41,,212169,5005,HEC
42,,DOUB,C3B,CAB,no,E,42,,212169,5005,HEC
43,,SING,CMB,HMB1,no,N,43,,212169,5005,HEC
44,,SING,CMB,HMB2,no,N,44,,212169,5005,HEC
45,,SING,CMB,HMB3,no,N,45,,212169,5005,HEC
46,,SING,CAB,CBB,no,N,46,,212169,5005,HEC
47,,SING,CAB,HAB,no,N,47,,212169,5005,HEC
48,,SING,CBB,HBB1,no,N,48,,212169,5005,HEC
49,,SING,CBB,HBB2,no,N,49,,212169,5005,HEC
50,,SING,CBB,HBB3,no,N,50,,212169,5005,HEC
51,,SING,NC,C1C,yes,N,51,,212169,5005,HEC
52,,SING,NC,C4C,yes,N,52,,212169,5005,HEC
53,,DOUB,C1C,C2C,yes,N,53,,212169,5005,HEC
54,,SING,C2C,C3C,yes,N,54,,212169,5005,HEC
55,,SING,C2C,CMC,no,N,55,,212169,5005,HEC
56,,SING,C3C,C4C,yes,N,56,,212169,5005,HEC
57,,DOUB,C3C,CAC,no,E,57,,212169,5005,HEC
58,,SING,CMC,HMC1,no,N,58,,212169,5005,HEC
59,,SING,CMC,HMC2,no,N,59,,212169,5005,HEC
60,,SING,CMC,HMC3,no,N,60,,212169,5005,HEC
61,,SING,CAC,CBC,no,N,61,,212169,5005,HEC
62,,SING,CAC,HAC,no,N,62,,212169,5005,HEC
63,,SING,CBC,HBC1,no,N,63,,212169,5005,HEC
64,,SING,CBC,HBC2,no,N,64,,212169,5005,HEC
65,,SING,CBC,HBC3,no,N,65,,212169,5005,HEC
66,,SING,ND,C1D,yes,N,66,,212169,5005,HEC
67,,SING,ND,C4D,yes,N,67,,212169,5005,HEC
68,,DOUB,C1D,C2D,yes,N,68,,212169,5005,HEC
69,,SING,C2D,C3D,yes,N,69,,212169,5005,HEC
70,,SING,C2D,CMD,no,N,70,,212169,5005,HEC
71,,DOUB,C3D,C4D,yes,N,71,,212169,5005,HEC
72,,SING,C3D,CAD,no,N,72,,212169,5005,HEC
73,,SING,CMD,HMD1,no,N,73,,212169,5005,HEC
74,,SING,CMD,HMD2,no,N,74,,212169,5005,HEC
75,,SING,CMD,HMD3,no,N,75,,212169,5005,HEC
76,,SING,CAD,CBD,no,N,76,,212169,5005,HEC
77,,SING,CAD,HAD1,no,N,77,,212169,5005,HEC
78,,SING,CAD,HAD2,no,N,78,,212169,5005,HEC
79,,SING,CBD,CGD,no,N,79,,212169,5005,HEC
80,,SING,CBD,HBD1,no,N,80,,212169,5005,HEC
81,,SING,CBD,HBD2,no,N,81,,212169,5005,HEC
82,,DOUB,CGD,O1D,no,N,82,,212169,5005,HEC
83,,SING,CGD,O2D,no,N,83,,212169,5005,HEC
84,,SING,O2D,H2D,no,N,84,,212169,5005,HEC
1,,DOUB,PG,O1G,no,N,1,,213341,50172,GTP
2,,SING,PG,O2G,no,N,2,,213341,50172,GTP
3,,SING,PG,O3G,no,N,3,,213341,50172,GTP
4,,SING,PG,O3B,no,N,4,,213341,50172,GTP
5,,SING,O2G,HOG2,no,N,5,,213341,50172,GTP
6,,SING,O3G,HOG3,no,N,6,,213341,50172,GTP
7,,SING,O3B,PB,no,N,7,,213341,50172,GTP
8,,DOUB,PB,O1B,no,N,8,,213341,50172,GTP
9,,SING,PB,O2B,no,N,9,,213341,50172,GTP
10,,SING,PB,O3A,no,N,10,,213341,50172,GTP
11,,SING,O2B,HOB2,no,N,11,,213341,50172,GTP
12,,SING,O3A,PA,no,N,12,,213341,50172,GTP
13,,DOUB,PA,O1A,no,N,13,,213341,50172,GTP
14,,SING,PA,O2A,no,N,14,,213341,50172,GTP
15,,SING,PA,O5',no,N,15,,213341,50172,GTP
16,,SING,O2A,HOA2,no,N,16,,213341,50172,GTP
17,,SING,O5',C5',no,N,17,,213341,50172,GTP
18,,SING,C5',C4',no,N,18,,213341,50172,GTP
19,,SING,C5',H5',no,N,19,,213341,50172,GTP
20,,SING,C5',H5'',no,N,20,,213341,50172,GTP
21,,SING,C4',O4',no,N,21,,213341,50172,GTP
22,,SING,C4',C3',no,N,22,,213341,50172,GTP
23,,SING,C4',H4',no,N,23,,213341,50172,GTP
24,,SING,O4',C1',no,N,24,,213341,50172,GTP
25,,SING,C3',O3',no,N,25,,213341,50172,GTP
26,,SING,C3',C2',no,N,26,,213341,50172,GTP
27,,SING,C3',H3',no,N,27,,213341,50172,GTP
28,,SING,O3',HO3',no,N,28,,213341,50172,GTP
29,,SING,C2',O2',no,N,29,,213341,50172,GTP
30,,SING,C2',C1',no,N,30,,213341,50172,GTP
31,,SING,C2',H2',no,N,31,,213341,50172,GTP
32,,SING,O2',HO2',no,N,32,,213341,50172,GTP
33,,SING,C1',N9,no,N,33,,213341,50172,GTP
34,,SING,C1',H1',no,N,34,,213341,50172,GTP
35,,SING,N9,C8,yes,N,35,,213341,50172,GTP
36,,SING,N9,C4,yes,N,36,,213341,50172,GTP
37,,DOUB,C8,N7,yes,N,37,,213341,50172,GTP
38,,SING,C8,H8,no,N,38,,213341,50172,GTP
39,,SING,N7,C5,yes,N,39,,213341,50172,GTP
40,,SING,C5,C6,no,N,40,,213341,50172,GTP
41,,DOUB,C5,C4,yes,N,41,,213341,50172,GTP
42,,DOUB,C6,O6,no,N,42,,213341,50172,GTP
43,,SING,C6,N1,no,N,43,,213341,50172,GTP
44,,SING,N1,C2,no,N,44,,213341,50172,GTP
45,,SING,N1,HN1,no,N,45,,213341,50172,GTP
46,,SING,C2,N2,no,N,46,,213341,50172,GTP
47,,DOUB,C2,N3,no,N,47,,213341,50172,GTP
48,,SING,N2,HN21,no,N,48,,213341,50172,GTP
49,,SING,N2,HN22,no,N,49,,213341,50172,GTP
50,,SING,N3,C4,no,N,50,,213341,50172,GTP
1,,DOUB,PB,O1B,no,N,1,,213358,50173,GDP
2,,SING,PB,O2B,no,N,2,,213358,50173,GDP
3,,SING,PB,O3B,no,N,3,,213358,50173,GDP
4,,SING,PB,O3A,no,N,4,,213358,50173,GDP
5,,SING,O2B,HOB2,no,N,5,,213358,50173,GDP
6,,SING,O3B,HOB3,no,N,6,,213358,50173,GDP
7,,SING,O3A,PA,no,N,7,,213358,50173,GDP
8,,DOUB,PA,O1A,no,N,8,,213358,50173,GDP
9,,SING,PA,O2A,no,N,9,,213358,50173,GDP
10,,SING,PA,O5',no,N,10,,213358,50173,GDP
11,,SING,O2A,HOA2,no,N,11,,213358,50173,GDP
12,,SING,O5',C5',no,N,12,,213358,50173,GDP
13,,SING,C5',C4',no,N,13,,213358,50173,GDP
14,,SING,C5',H5',no,N,14,,213358,50173,GDP
15,,SING,C5',H5'',no,N,15,,213358,50173,GDP
16,,SING,C4',O4',no,N,16,,213358,50173,GDP
17,,SING,C4',C3',no,N,17,,213358,50173,GDP
18,,SING,C4',H4',no,N,18,,213358,50173,GDP
19,,SING,O4',C1',no,N,19,,213358,50173,GDP
20,,SING,C3',O3',no,N,20,,213358,50173,GDP
21,,SING,C3',C2',no,N,21,,213358,50173,GDP
22,,SING,C3',H3',no,N,22,,213358,50173,GDP
23,,SING,O3',HO3',no,N,23,,213358,50173,GDP
24,,SING,C2',O2',no,N,24,,213358,50173,GDP
25,,SING,C2',C1',no,N,25,,213358,50173,GDP
26,,SING,C2',H2',no,N,26,,213358,50173,GDP
27,,SING,O2',HO2',no,N,27,,213358,50173,GDP
28,,SING,C1',N9,no,N,28,,213358,50173,GDP
29,,SING,C1',H1',no,N,29,,213358,50173,GDP
30,,SING,N9,C8,yes,N,30,,213358,50173,GDP
31,,SING,N9,C4,yes,N,31,,213358,50173,GDP
32,,DOUB,C8,N7,yes,N,32,,213358,50173,GDP
33,,SING,C8,H8,no,N,33,,213358,50173,GDP
34,,SING,N7,C5,yes,N,34,,213358,50173,GDP
35,,SING,C5,C6,no,N,35,,213358,50173,GDP
36,,DOUB,C5,C4,yes,N,36,,213358,50173,GDP
37,,DOUB,C6,O6,no,N,37,,213358,50173,GDP
38,,SING,C6,N1,no,N,38,,213358,50173,GDP
39,,SING,N1,C2,no,N,39,,213358,50173,GDP
40,,SING,N1,HN1,no,N,40,,213358,50173,GDP
41,,SING,C2,N2,no,N,41,,213358,50173,GDP
42,,DOUB,C2,N3,no,N,42,,213358,50173,GDP
43,,SING,N2,HN21,no,N,43,,213358,50173,GDP
44,,SING,N2,HN22,no,N,44,,213358,50173,GDP
45,,SING,N3,C4,no,N,45,,213358,50173,GDP
1,,DOUB,PG,O1G,no,N,1,,213375,50174,GTP
2,,SING,PG,O2G,no,N,2,,213375,50174,GTP
3,,SING,PG,O3G,no,N,3,,213375,50174,GTP
4,,SING,PG,O3B,no,N,4,,213375,50174,GTP
5,,SING,O2G,HOG2,no,N,5,,213375,50174,GTP
6,,SING,O3G,HOG3,no,N,6,,213375,50174,GTP
7,,SING,O3B,PB,no,N,7,,213375,50174,GTP
8,,DOUB,PB,O1B,no,N,8,,213375,50174,GTP
9,,SING,PB,O2B,no,N,9,,213375,50174,GTP
10,,SING,PB,O3A,no,N,10,,213375,50174,GTP
11,,SING,O2B,HOB2,no,N,11,,213375,50174,GTP
12,,SING,O3A,PA,no,N,12,,213375,50174,GTP
13,,DOUB,PA,O1A,no,N,13,,213375,50174,GTP
14,,SING,PA,O2A,no,N,14,,213375,50174,GTP
15,,SING,PA,O5',no,N,15,,213375,50174,GTP
16,,SING,O2A,HOA2,no,N,16,,213375,50174,GTP
17,,SING,O5',C5',no,N,17,,213375,50174,GTP
18,,SING,C5',C4',no,N,18,,213375,50174,GTP
19,,SING,C5',H5',no,N,19,,213375,50174,GTP
20,,SING,C5',H5'',no,N,20,,213375,50174,GTP
21,,SING,C4',O4',no,N,21,,213375,50174,GTP
22,,SING,C4',C3',no,N,22,,213375,50174,GTP
23,,SING,C4',H4',no,N,23,,213375,50174,GTP
24,,SING,O4',C1',no,N,24,,213375,50174,GTP
25,,SING,C3',O3',no,N,25,,213375,50174,GTP
26,,SING,C3',C2',no,N,26,,213375,50174,GTP
27,,SING,C3',H3',no,N,27,,213375,50174,GTP
28,,SING,O3',HO3',no,N,28,,213375,50174,GTP
29,,SING,C2',O2',no,N,29,,213375,50174,GTP
30,,SING,C2',C1',no,N,30,,213375,50174,GTP
31,,SING,C2',H2',no,N,31,,213375,50174,GTP
32,,SING,O2',HO2',no,N,32,,213375,50174,GTP
33,,SING,C1',N9,no,N,33,,213375,50174,GTP
34,,SING,C1',H1',no,N,34,,213375,50174,GTP
35,,SING,N9,C8,yes,N,35,,213375,50174,GTP
36,,SING,N9,C4,yes,N,36,,213375,50174,GTP
37,,DOUB,C8,N7,yes,N,37,,213375,50174,GTP
38,,SING,C8,H8,no,N,38,,213375,50174,GTP
39,,SING,N7,C5,yes,N,39,,213375,50174,GTP
40,,SING,C5,C6,no,N,40,,213375,50174,GTP
41,,DOUB,C5,C4,yes,N,41,,213375,50174,GTP
42,,DOUB,C6,O6,no,N,42,,213375,50174,GTP
43,,SING,C6,N1,no,N,43,,213375,50174,GTP
44,,SING,N1,C2,no,N,44,,213375,50174,GTP
45,,SING,N1,HN1,no,N,45,,213375,50174,GTP
46,,SING,C2,N2,no,N,46,,213375,50174,GTP
47,,DOUB,C2,N3,no,N,47,,213375,50174,GTP
48,,SING,N2,HN21,no,N,48,,213375,50174,GTP
49,,SING,N2,HN22,no,N,49,,213375,50174,GTP
50,,SING,N3,C4,no,N,50,,213375,50174,GTP
1,,DOUB,PB,O1B,no,N,1,,213390,50175,GDP
2,,SING,PB,O2B,no,N,2,,213390,50175,GDP
3,,SING,PB,O3B,no,N,3,,213390,50175,GDP
4,,SING,PB,O3A,no,N,4,,213390,50175,GDP
5,,SING,O2B,HOB2,no,N,5,,213390,50175,GDP
6,,SING,O3B,HOB3,no,N,6,,213390,50175,GDP
7,,SING,O3A,PA,no,N,7,,213390,50175,GDP
8,,DOUB,PA,O1A,no,N,8,,213390,50175,GDP
9,,SING,PA,O2A,no,N,9,,213390,50175,GDP
10,,SING,PA,O5',no,N,10,,213390,50175,GDP
11,,SING,O2A,HOA2,no,N,11,,213390,50175,GDP
12,,SING,O5',C5',no,N,12,,213390,50175,GDP
13,,SING,C5',C4',no,N,13,,213390,50175,GDP
14,,SING,C5',H5',no,N,14,,213390,50175,GDP
15,,SING,C5',H5'',no,N,15,,213390,50175,GDP
16,,SING,C4',O4',no,N,16,,213390,50175,GDP
17,,SING,C4',C3',no,N,17,,213390,50175,GDP
18,,SING,C4',H4',no,N,18,,213390,50175,GDP
19,,SING,O4',C1',no,N,19,,213390,50175,GDP
20,,SING,C3',O3',no,N,20,,213390,50175,GDP
21,,SING,C3',C2',no,N,21,,213390,50175,GDP
22,,SING,C3',H3',no,N,22,,213390,50175,GDP
23,,SING,O3',HO3',no,N,23,,213390,50175,GDP
24,,SING,C2',O2',no,N,24,,213390,50175,GDP
25,,SING,C2',C1',no,N,25,,213390,50175,GDP
26,,SING,C2',H2',no,N,26,,213390,50175,GDP
27,,SING,O2',HO2',no,N,27,,213390,50175,GDP
28,,SING,C1',N9,no,N,28,,213390,50175,GDP
29,,SING,C1',H1',no,N,29,,213390,50175,GDP
30,,SING,N9,C8,yes,N,30,,213390,50175,GDP
31,,SING,N9,C4,yes,N,31,,213390,50175,GDP
32,,DOUB,C8,N7,yes,N,32,,213390,50175,GDP
33,,SING,C8,H8,no,N,33,,213390,50175,GDP
34,,SING,N7,C5,yes,N,34,,213390,50175,GDP
35,,SING,C5,C6,no,N,35,,213390,50175,GDP
36,,DOUB,C5,C4,yes,N,36,,213390,50175,GDP
37,,DOUB,C6,O6,no,N,37,,213390,50175,GDP
38,,SING,C6,N1,no,N,38,,213390,50175,GDP
39,,SING,N1,C2,no,N,39,,213390,50175,GDP
40,,SING,N1,HN1,no,N,40,,213390,50175,GDP
41,,SING,C2,N2,no,N,41,,213390,50175,GDP
42,,DOUB,C2,N3,no,N,42,,213390,50175,GDP
43,,SING,N2,HN21,no,N,43,,213390,50175,GDP
44,,SING,N2,HN22,no,N,44,,213390,50175,GDP
45,,SING,N3,C4,no,N,45,,213390,50175,GDP
1,,DOUB,PG,O1G,no,N,1,,213405,50176,GTP
2,,SING,PG,O2G,no,N,2,,213405,50176,GTP
3,,SING,PG,O3G,no,N,3,,213405,50176,GTP
4,,SING,PG,O3B,no,N,4,,213405,50176,GTP
5,,SING,O2G,HOG2,no,N,5,,213405,50176,GTP
6,,SING,O3G,HOG3,no,N,6,,213405,50176,GTP
7,,SING,O3B,PB,no,N,7,,213405,50176,GTP
8,,DOUB,PB,O1B,no,N,8,,213405,50176,GTP
9,,SING,PB,O2B,no,N,9,,213405,50176,GTP
10,,SING,PB,O3A,no,N,10,,213405,50176,GTP
11,,SING,O2B,HOB2,no,N,11,,213405,50176,GTP
12,,SING,O3A,PA,no,N,12,,213405,50176,GTP
13,,DOUB,PA,O1A,no,N,13,,213405,50176,GTP
14,,SING,PA,O2A,no,N,14,,213405,50176,GTP
15,,SING,PA,O5',no,N,15,,213405,50176,GTP
16,,SING,O2A,HOA2,no,N,16,,213405,50176,GTP
17,,SING,O5',C5',no,N,17,,213405,50176,GTP
18,,SING,C5',C4',no,N,18,,213405,50176,GTP
19,,SING,C5',H5',no,N,19,,213405,50176,GTP
20,,SING,C5',H5'',no,N,20,,213405,50176,GTP
21,,SING,C4',O4',no,N,21,,213405,50176,GTP
22,,SING,C4',C3',no,N,22,,213405,50176,GTP
23,,SING,C4',H4',no,N,23,,213405,50176,GTP
24,,SING,O4',C1',no,N,24,,213405,50176,GTP
25,,SING,C3',O3',no,N,25,,213405,50176,GTP
26,,SING,C3',C2',no,N,26,,213405,50176,GTP
27,,SING,C3',H3',no,N,27,,213405,50176,GTP
28,,SING,O3',HO3',no,N,28,,213405,50176,GTP
29,,SING,C2',O2',no,N,29,,213405,50176,GTP
30,,SING,C2',C1',no,N,30,,213405,50176,GTP
31,,SING,C2',H2',no,N,31,,213405,50176,GTP
32,,SING,O2',HO2',no,N,32,,213405,50176,GTP
33,,SING,C1',N9,no,N,33,,213405,50176,GTP
34,,SING,C1',H1',no,N,34,,213405,50176,GTP
35,,SING,N9,C8,yes,N,35,,213405,50176,GTP
36,,SING,N9,C4,yes,N,36,,213405,50176,GTP
37,,DOUB,C8,N7,yes,N,37,,213405,50176,GTP
38,,SING,C8,H8,no,N,38,,213405,50176,GTP
39,,SING,N7,C5,yes,N,39,,213405,50176,GTP
40,,SING,C5,C6,no,N,40,,213405,50176,GTP
41,,DOUB,C5,C4,yes,N,41,,213405,50176,GTP
42,,DOUB,C6,O6,no,N,42,,213405,50176,GTP
43,,SING,C6,N1,no,N,43,,213405,50176,GTP
44,,SING,N1,C2,no,N,44,,213405,50176,GTP
45,,SING,N1,HN1,no,N,45,,213405,50176,GTP
46,,SING,C2,N2,no,N,46,,213405,50176,GTP
47,,DOUB,C2,N3,no,N,47,,213405,50176,GTP
48,,SING,N2,HN21,no,N,48,,213405,50176,GTP
49,,SING,N2,HN22,no,N,49,,213405,50176,GTP
50,,SING,N3,C4,no,N,50,,213405,50176,GTP
1,,DOUB,PB,O1B,no,N,1,,213420,50177,GDP
2,,SING,PB,O2B,no,N,2,,213420,50177,GDP
3,,SING,PB,O3B,no,N,3,,213420,50177,GDP
4,,SING,PB,O3A,no,N,4,,213420,50177,GDP
5,,SING,O2B,HOB2,no,N,5,,213420,50177,GDP
6,,SING,O3B,HOB3,no,N,6,,213420,50177,GDP
7,,SING,O3A,PA,no,N,7,,213420,50177,GDP
8,,DOUB,PA,O1A,no,N,8,,213420,50177,GDP
9,,SING,PA,O2A,no,N,9,,213420,50177,GDP
10,,SING,PA,O5',no,N,10,,213420,50177,GDP
11,,SING,O2A,HOA2,no,N,11,,213420,50177,GDP
12,,SING,O5',C5',no,N,12,,213420,50177,GDP
13,,SING,C5',C4',no,N,13,,213420,50177,GDP
14,,SING,C5',H5',no,N,14,,213420,50177,GDP
15,,SING,C5',H5'',no,N,15,,213420,50177,GDP
16,,SING,C4',O4',no,N,16,,213420,50177,GDP
17,,SING,C4',C3',no,N,17,,213420,50177,GDP
18,,SING,C4',H4',no,N,18,,213420,50177,GDP
19,,SING,O4',C1',no,N,19,,213420,50177,GDP
20,,SING,C3',O3',no,N,20,,213420,50177,GDP
21,,SING,C3',C2',no,N,21,,213420,50177,GDP
22,,SING,C3',H3',no,N,22,,213420,50177,GDP
23,,SING,O3',HO3',no,N,23,,213420,50177,GDP
24,,SING,C2',O2',no,N,24,,213420,50177,GDP
25,,SING,C2',C1',no,N,25,,213420,50177,GDP
26,,SING,C2',H2',no,N,26,,213420,50177,GDP
27,,SING,O2',HO2',no,N,27,,213420,50177,GDP
28,,SING,C1',N9,no,N,28,,213420,50177,GDP
29,,SING,C1',H1',no,N,29,,213420,50177,GDP
30,,SING,N9,C8,yes,N,30,,213420,50177,GDP
31,,SING,N9,C4,yes,N,31,,213420,50177,GDP
32,,DOUB,C8,N7,yes,N,32,,213420,50177,GDP
33,,SING,C8,H8,no,N,33,,213420,50177,GDP
34,,SING,N7,C5,yes,N,34,,213420,50177,GDP
35,,SING,C5,C6,no,N,35,,213420,50177,GDP
36,,DOUB,C5,C4,yes,N,36,,213420,50177,GDP
37,,DOUB,C6,O6,no,N,37,,213420,50177,GDP
38,,SING,C6,N1,no,N,38,,213420,50177,GDP
39,,SING,N1,C2,no,N,39,,213420,50177,GDP
40,,SING,N1,HN1,no,N,40,,213420,50177,GDP
41,,SING,C2,N2,no,N,41,,213420,50177,GDP
42,,DOUB,C2,N3,no,N,42,,213420,50177,GDP
43,,SING,N2,HN21,no,N,43,,213420,50177,GDP
44,,SING,N2,HN22,no,N,44,,213420,50177,GDP
45,,SING,N3,C4,no,N,45,,213420,50177,GDP
1,,DOUB,PG,O1G,no,N,1,,213435,50178,GTP
2,,SING,PG,O2G,no,N,2,,213435,50178,GTP
3,,SING,PG,O3G,no,N,3,,213435,50178,GTP
4,,SING,PG,O3B,no,N,4,,213435,50178,GTP
5,,SING,O2G,HOG2,no,N,5,,213435,50178,GTP
6,,SING,O3G,HOG3,no,N,6,,213435,50178,GTP
7,,SING,O3B,PB,no,N,7,,213435,50178,GTP
8,,DOUB,PB,O1B,no,N,8,,213435,50178,GTP
9,,SING,PB,O2B,no,N,9,,213435,50178,GTP
10,,SING,PB,O3A,no,N,10,,213435,50178,GTP
11,,SING,O2B,HOB2,no,N,11,,213435,50178,GTP
12,,SING,O3A,PA,no,N,12,,213435,50178,GTP
13,,DOUB,PA,O1A,no,N,13,,213435,50178,GTP
14,,SING,PA,O2A,no,N,14,,213435,50178,GTP
15,,SING,PA,O5',no,N,15,,213435,50178,GTP
16,,SING,O2A,HOA2,no,N,16,,213435,50178,GTP
17,,SING,O5',C5',no,N,17,,213435,50178,GTP
18,,SING,C5',C4',no,N,18,,213435,50178,GTP
19,,SING,C5',H5',no,N,19,,213435,50178,GTP
20,,SING,C5',H5'',no,N,20,,213435,50178,GTP
21,,SING,C4',O4',no,N,21,,213435,50178,GTP
22,,SING,C4',C3',no,N,22,,213435,50178,GTP
23,,SING,C4',H4',no,N,23,,213435,50178,GTP
24,,SING,O4',C1',no,N,24,,213435,50178,GTP
25,,SING,C3',O3',no,N,25,,213435,50178,GTP
26,,SING,C3',C2',no,N,26,,213435,50178,GTP
27,,SING,C3',H3',no,N,27,,213435,50178,GTP
28,,SING,O3',HO3',no,N,28,,213435,50178,GTP
29,,SING,C2',O2',no,N,29,,213435,50178,GTP
30,,SING,C2',C1',no,N,30,,213435,50178,GTP
31,,SING,C2',H2',no,N,31,,213435,50178,GTP
32,,SING,O2',HO2',no,N,32,,213435,50178,GTP
33,,SING,C1',N9,no,N,33,,213435,50178,GTP
34,,SING,C1',H1',no,N,34,,213435,50178,GTP
35,,SING,N9,C8,yes,N,35,,213435,50178,GTP
36,,SING,N9,C4,yes,N,36,,213435,50178,GTP
37,,DOUB,C8,N7,yes,N,37,,213435,50178,GTP
38,,SING,C8,H8,no,N,38,,213435,50178,GTP
39,,SING,N7,C5,yes,N,39,,213435,50178,GTP
40,,SING,C5,C6,no,N,40,,213435,50178,GTP
41,,DOUB,C5,C4,yes,N,41,,213435,50178,GTP
42,,DOUB,C6,O6,no,N,42,,213435,50178,GTP
43,,SING,C6,N1,no,N,43,,213435,50178,GTP
44,,SING,N1,C2,no,N,44,,213435,50178,GTP
45,,SING,N1,HN1,no,N,45,,213435,50178,GTP
46,,SING,C2,N2,no,N,46,,213435,50178,GTP
47,,DOUB,C2,N3,no,N,47,,213435,50178,GTP
48,,SING,N2,HN21,no,N,48,,213435,50178,GTP
49,,SING,N2,HN22,no,N,49,,213435,50178,GTP
50,,SING,N3,C4,no,N,50,,213435,50178,GTP
1,,DOUB,PB,O1B,no,N,1,,213450,50179,GDP
2,,SING,PB,O2B,no,N,2,,213450,50179,GDP
3,,SING,PB,O3B,no,N,3,,213450,50179,GDP
4,,SING,PB,O3A,no,N,4,,213450,50179,GDP
5,,SING,O2B,HOB2,no,N,5,,213450,50179,GDP
6,,SING,O3B,HOB3,no,N,6,,213450,50179,GDP
7,,SING,O3A,PA,no,N,7,,213450,50179,GDP
8,,DOUB,PA,O1A,no,N,8,,213450,50179,GDP
9,,SING,PA,O2A,no,N,9,,213450,50179,GDP
10,,SING,PA,O5',no,N,10,,213450,50179,GDP
11,,SING,O2A,HOA2,no,N,11,,213450,50179,GDP
12,,SING,O5',C5',no,N,12,,213450,50179,GDP
13,,SING,C5',C4',no,N,13,,213450,50179,GDP
14,,SING,C5',H5',no,N,14,,213450,50179,GDP
15,,SING,C5',H5'',no,N,15,,213450,50179,GDP
16,,SING,C4',O4',no,N,16,,213450,50179,GDP
17,,SING,C4',C3',no,N,17,,213450,50179,GDP
18,,SING,C4',H4',no,N,18,,213450,50179,GDP
19,,SING,O4',C1',no,N,19,,213450,50179,GDP
20,,SING,C3',O3',no,N,20,,213450,50179,GDP
21,,SING,C3',C2',no,N,21,,213450,50179,GDP
22,,SING,C3',H3',no,N,22,,213450,50179,GDP
23,,SING,O3',HO3',no,N,23,,213450,50179,GDP
24,,SING,C2',O2',no,N,24,,213450,50179,GDP
25,,SING,C2',C1',no,N,25,,213450,50179,GDP
26,,SING,C2',H2',no,N,26,,213450,50179,GDP
27,,SING,O2',HO2',no,N,27,,213450,50179,GDP
28,,SING,C1',N9,no,N,28,,213450,50179,GDP
29,,SING,C1',H1',no,N,29,,213450,50179,GDP
30,,SING,N9,C8,yes,N,30,,213450,50179,GDP
31,,SING,N9,C4,yes,N,31,,213450,50179,GDP
32,,DOUB,C8,N7,yes,N,32,,213450,50179,GDP
33,,SING,C8,H8,no,N,33,,213450,50179,GDP
34,,SING,N7,C5,yes,N,34,,213450,50179,GDP
35,,SING,C5,C6,no,N,35,,213450,50179,GDP
36,,DOUB,C5,C4,yes,N,36,,213450,50179,GDP
37,,DOUB,C6,O6,no,N,37,,213450,50179,GDP
38,,SING,C6,N1,no,N,38,,213450,50179,GDP
39,,SING,N1,C2,no,N,39,,213450,50179,GDP
40,,SING,N1,HN1,no,N,40,,213450,50179,GDP
41,,SING,C2,N2,no,N,41,,213450,50179,GDP
42,,DOUB,C2,N3,no,N,42,,213450,50179,GDP
43,,SING,N2,HN21,no,N,43,,213450,50179,GDP
44,,SING,N2,HN22,no,N,44,,213450,50179,GDP
45,,SING,N3,C4,no,N,45,,213450,50179,GDP
1,,DOUB,PG,O1G,no,N,1,,213484,50180,GTP
2,,SING,PG,O2G,no,N,2,,213484,50180,GTP
3,,SING,PG,O3G,no,N,3,,213484,50180,GTP
4,,SING,PG,O3B,no,N,4,,213484,50180,GTP
5,,SING,O2G,HOG2,no,N,5,,213484,50180,GTP
6,,SING,O3G,HOG3,no,N,6,,213484,50180,GTP
7,,SING,O3B,PB,no,N,7,,213484,50180,GTP
8,,DOUB,PB,O1B,no,N,8,,213484,50180,GTP
9,,SING,PB,O2B,no,N,9,,213484,50180,GTP
10,,SING,PB,O3A,no,N,10,,213484,50180,GTP
11,,SING,O2B,HOB2,no,N,11,,213484,50180,GTP
12,,SING,O3A,PA,no,N,12,,213484,50180,GTP
13,,DOUB,PA,O1A,no,N,13,,213484,50180,GTP
14,,SING,PA,O2A,no,N,14,,213484,50180,GTP
15,,SING,PA,O5',no,N,15,,213484,50180,GTP
16,,SING,O2A,HOA2,no,N,16,,213484,50180,GTP
17,,SING,O5',C5',no,N,17,,213484,50180,GTP
18,,SING,C5',C4',no,N,18,,213484,50180,GTP
19,,SING,C5',H5',no,N,19,,213484,50180,GTP
20,,SING,C5',H5'',no,N,20,,213484,50180,GTP
21,,SING,C4',O4',no,N,21,,213484,50180,GTP
22,,SING,C4',C3',no,N,22,,213484,50180,GTP
23,,SING,C4',H4',no,N,23,,213484,50180,GTP
24,,SING,O4',C1',no,N,24,,213484,50180,GTP
25,,SING,C3',O3',no,N,25,,213484,50180,GTP
26,,SING,C3',C2',no,N,26,,213484,50180,GTP
27,,SING,C3',H3',no,N,27,,213484,50180,GTP
28,,SING,O3',HO3',no,N,28,,213484,50180,GTP
29,,SING,C2',O2',no,N,29,,213484,50180,GTP
30,,SING,C2',C1',no,N,30,,213484,50180,GTP
31,,SING,C2',H2',no,N,31,,213484,50180,GTP
32,,SING,O2',HO2',no,N,32,,213484,50180,GTP
33,,SING,C1',N9,no,N,33,,213484,50180,GTP
34,,SING,C1',H1',no,N,34,,213484,50180,GTP
35,,SING,N9,C8,yes,N,35,,213484,50180,GTP
36,,SING,N9,C4,yes,N,36,,213484,50180,GTP
37,,DOUB,C8,N7,yes,N,37,,213484,50180,GTP
38,,SING,C8,H8,no,N,38,,213484,50180,GTP
39,,SING,N7,C5,yes,N,39,,213484,50180,GTP
40,,SING,C5,C6,no,N,40,,213484,50180,GTP
41,,DOUB,C5,C4,yes,N,41,,213484,50180,GTP
42,,DOUB,C6,O6,no,N,42,,213484,50180,GTP
43,,SING,C6,N1,no,N,43,,213484,50180,GTP
44,,SING,N1,C2,no,N,44,,213484,50180,GTP
45,,SING,N1,HN1,no,N,45,,213484,50180,GTP
46,,SING,C2,N2,no,N,46,,213484,50180,GTP
47,,DOUB,C2,N3,no,N,47,,213484,50180,GTP
48,,SING,N2,HN21,no,N,48,,213484,50180,GTP
49,,SING,N2,HN22,no,N,49,,213484,50180,GTP
50,,SING,N3,C4,no,N,50,,213484,50180,GTP
1,,DOUB,PB,O1B,no,N,1,,213499,50181,GDP
2,,SING,PB,O2B,no,N,2,,213499,50181,GDP
3,,SING,PB,O3B,no,N,3,,213499,50181,GDP
4,,SING,PB,O3A,no,N,4,,213499,50181,GDP
5,,SING,O2B,HOB2,no,N,5,,213499,50181,GDP
6,,SING,O3B,HOB3,no,N,6,,213499,50181,GDP
7,,SING,O3A,PA,no,N,7,,213499,50181,GDP
8,,DOUB,PA,O1A,no,N,8,,213499,50181,GDP
9,,SING,PA,O2A,no,N,9,,213499,50181,GDP
10,,SING,PA,O5',no,N,10,,213499,50181,GDP
11,,SING,O2A,HOA2,no,N,11,,213499,50181,GDP
12,,SING,O5',C5',no,N,12,,213499,50181,GDP
13,,SING,C5',C4',no,N,13,,213499,50181,GDP
14,,SING,C5',H5',no,N,14,,213499,50181,GDP
15,,SING,C5',H5'',no,N,15,,213499,50181,GDP
16,,SING,C4',O4',no,N,16,,213499,50181,GDP
17,,SING,C4',C3',no,N,17,,213499,50181,GDP
18,,SING,C4',H4',no,N,18,,213499,50181,GDP
19,,SING,O4',C1',no,N,19,,213499,50181,GDP
20,,SING,C3',O3',no,N,20,,213499,50181,GDP
21,,SING,C3',C2',no,N,21,,213499,50181,GDP
22,,SING,C3',H3',no,N,22,,213499,50181,GDP
23,,SING,O3',HO3',no,N,23,,213499,50181,GDP
24,,SING,C2',O2',no,N,24,,213499,50181,GDP
25,,SING,C2',C1',no,N,25,,213499,50181,GDP
26,,SING,C2',H2',no,N,26,,213499,50181,GDP
27,,SING,O2',HO2',no,N,27,,213499,50181,GDP
28,,SING,C1',N9,no,N,28,,213499,50181,GDP
29,,SING,C1',H1',no,N,29,,213499,50181,GDP
30,,SING,N9,C8,yes,N,30,,213499,50181,GDP
31,,SING,N9,C4,yes,N,31,,213499,50181,GDP
32,,DOUB,C8,N7,yes,N,32,,213499,50181,GDP
33,,SING,C8,H8,no,N,33,,213499,50181,GDP
34,,SING,N7,C5,yes,N,34,,213499,50181,GDP
35,,SING,C5,C6,no,N,35,,213499,50181,GDP
36,,DOUB,C5,C4,yes,N,36,,213499,50181,GDP
37,,DOUB,C6,O6,no,N,37,,213499,50181,GDP
38,,SING,C6,N1,no,N,38,,213499,50181,GDP
39,,SING,N1,C2,no,N,39,,213499,50181,GDP
40,,SING,N1,HN1,no,N,40,,213499,50181,GDP
41,,SING,C2,N2,no,N,41,,213499,50181,GDP
42,,DOUB,C2,N3,no,N,42,,213499,50181,GDP
43,,SING,N2,HN21,no,N,43,,213499,50181,GDP
44,,SING,N2,HN22,no,N,44,,213499,50181,GDP
45,,SING,N3,C4,no,N,45,,213499,50181,GDP
1,,DOUB,PG,O1G,no,N,1,,213514,50182,GTP
2,,SING,PG,O2G,no,N,2,,213514,50182,GTP
3,,SING,PG,O3G,no,N,3,,213514,50182,GTP
4,,SING,PG,O3B,no,N,4,,213514,50182,GTP
5,,SING,O2G,HOG2,no,N,5,,213514,50182,GTP
6,,SING,O3G,HOG3,no,N,6,,213514,50182,GTP
7,,SING,O3B,PB,no,N,7,,213514,50182,GTP
8,,DOUB,PB,O1B,no,N,8,,213514,50182,GTP
9,,SING,PB,O2B,no,N,9,,213514,50182,GTP
10,,SING,PB,O3A,no,N,10,,213514,50182,GTP
11,,SING,O2B,HOB2,no,N,11,,213514,50182,GTP
12,,SING,O3A,PA,no,N,12,,213514,50182,GTP
13,,DOUB,PA,O1A,no,N,13,,213514,50182,GTP
14,,SING,PA,O2A,no,N,14,,213514,50182,GTP
15,,SING,PA,O5',no,N,15,,213514,50182,GTP
16,,SING,O2A,HOA2,no,N,16,,213514,50182,GTP
17,,SING,O5',C5',no,N,17,,213514,50182,GTP
18,,SING,C5',C4',no,N,18,,213514,50182,GTP
19,,SING,C5',H5',no,N,19,,213514,50182,GTP
20,,SING,C5',H5'',no,N,20,,213514,50182,GTP
21,,SING,C4',O4',no,N,21,,213514,50182,GTP
22,,SING,C4',C3',no,N,22,,213514,50182,GTP
23,,SING,C4',H4',no,N,23,,213514,50182,GTP
24,,SING,O4',C1',no,N,24,,213514,50182,GTP
25,,SING,C3',O3',no,N,25,,213514,50182,GTP
26,,SING,C3',C2',no,N,26,,213514,50182,GTP
27,,SING,C3',H3',no,N,27,,213514,50182,GTP
28,,SING,O3',HO3',no,N,28,,213514,50182,GTP
29,,SING,C2',O2',no,N,29,,213514,50182,GTP
30,,SING,C2',C1',no,N,30,,213514,50182,GTP
31,,SING,C2',H2',no,N,31,,213514,50182,GTP
32,,SING,O2',HO2',no,N,32,,213514,50182,GTP
33,,SING,C1',N9,no,N,33,,213514,50182,GTP
34,,SING,C1',H1',no,N,34,,213514,50182,GTP
35,,SING,N9,C8,yes,N,35,,213514,50182,GTP
36,,SING,N9,C4,yes,N,36,,213514,50182,GTP
37,,DOUB,C8,N7,yes,N,37,,213514,50182,GTP
38,,SING,C8,H8,no,N,38,,213514,50182,GTP
39,,SING,N7,C5,yes,N,39,,213514,50182,GTP
40,,SING,C5,C6,no,N,40,,213514,50182,GTP
41,,DOUB,C5,C4,yes,N,41,,213514,50182,GTP
42,,DOUB,C6,O6,no,N,42,,213514,50182,GTP
43,,SING,C6,N1,no,N,43,,213514,50182,GTP
44,,SING,N1,C2,no,N,44,,213514,50182,GTP
45,,SING,N1,HN1,no,N,45,,213514,50182,GTP
46,,SING,C2,N2,no,N,46,,213514,50182,GTP
47,,DOUB,C2,N3,no,N,47,,213514,50182,GTP
48,,SING,N2,HN21,no,N,48,,213514,50182,GTP
49,,SING,N2,HN22,no,N,49,,213514,50182,GTP
50,,SING,N3,C4,no,N,50,,213514,50182,GTP
1,,DOUB,PB,O1B,no,N,1,,213529,50183,GDP
2,,SING,PB,O2B,no,N,2,,213529,50183,GDP
3,,SING,PB,O3B,no,N,3,,213529,50183,GDP
4,,SING,PB,O3A,no,N,4,,213529,50183,GDP
5,,SING,O2B,HOB2,no,N,5,,213529,50183,GDP
6,,SING,O3B,HOB3,no,N,6,,213529,50183,GDP
7,,SING,O3A,PA,no,N,7,,213529,50183,GDP
8,,DOUB,PA,O1A,no,N,8,,213529,50183,GDP
9,,SING,PA,O2A,no,N,9,,213529,50183,GDP
10,,SING,PA,O5',no,N,10,,213529,50183,GDP
11,,SING,O2A,HOA2,no,N,11,,213529,50183,GDP
12,,SING,O5',C5',no,N,12,,213529,50183,GDP
13,,SING,C5',C4',no,N,13,,213529,50183,GDP
14,,SING,C5',H5',no,N,14,,213529,50183,GDP
15,,SING,C5',H5'',no,N,15,,213529,50183,GDP
16,,SING,C4',O4',no,N,16,,213529,50183,GDP
17,,SING,C4',C3',no,N,17,,213529,50183,GDP
18,,SING,C4',H4',no,N,18,,213529,50183,GDP
19,,SING,O4',C1',no,N,19,,213529,50183,GDP
20,,SING,C3',O3',no,N,20,,213529,50183,GDP
21,,SING,C3',C2',no,N,21,,213529,50183,GDP
22,,SING,C3',H3',no,N,22,,213529,50183,GDP
23,,SING,O3',HO3',no,N,23,,213529,50183,GDP
24,,SING,C2',O2',no,N,24,,213529,50183,GDP
25,,SING,C2',C1',no,N,25,,213529,50183,GDP
26,,SING,C2',H2',no,N,26,,213529,50183,GDP
27,,SING,O2',HO2',no,N,27,,213529,50183,GDP
28,,SING,C1',N9,no,N,28,,213529,50183,GDP
29,,SING,C1',H1',no,N,29,,213529,50183,GDP
30,,SING,N9,C8,yes,N,30,,213529,50183,GDP
31,,SING,N9,C4,yes,N,31,,213529,50183,GDP
32,,DOUB,C8,N7,yes,N,32,,213529,50183,GDP
33,,SING,C8,H8,no,N,33,,213529,50183,GDP
34,,SING,N7,C5,yes,N,34,,213529,50183,GDP
35,,SING,C5,C6,no,N,35,,213529,50183,GDP
36,,DOUB,C5,C4,yes,N,36,,213529,50183,GDP
37,,DOUB,C6,O6,no,N,37,,213529,50183,GDP
38,,SING,C6,N1,no,N,38,,213529,50183,GDP
39,,SING,N1,C2,no,N,39,,213529,50183,GDP
40,,SING,N1,HN1,no,N,40,,213529,50183,GDP
41,,SING,C2,N2,no,N,41,,213529,50183,GDP
42,,DOUB,C2,N3,no,N,42,,213529,50183,GDP
43,,SING,N2,HN21,no,N,43,,213529,50183,GDP
44,,SING,N2,HN22,no,N,44,,213529,50183,GDP
45,,SING,N3,C4,no,N,45,,213529,50183,GDP
1,,DOUB,C,O,no,N,1,,213679,5020,ACE
2,,SING,C,CH3,no,N,2,,213679,5020,ACE
3,,SING,C,H,no,N,3,,213679,5020,ACE
4,,SING,CH3,H1,no,N,4,,213679,5020,ACE
5,,SING,CH3,H2,no,N,5,,213679,5020,ACE
6,,SING,CH3,H3,no,N,6,,213679,5020,ACE
1,,SING,N,HN1,no,N,1,,213680,5020,NH2
2,,SING,N,HN2,no,N,2,,213680,5020,NH2
1,,SING,N,CA,no,N,1,,213699,50202,ZAE
2,,SING,N,C10,no,N,2,,213699,50202,ZAE
3,,SING,N,H,no,N,3,,213699,50202,ZAE
4,,SING,CA,C,no,N,4,,213699,50202,ZAE
5,,SING,CA,CB,no,N,5,,213699,50202,ZAE
6,,SING,CA,HA,no,N,6,,213699,50202,ZAE
7,,DOUB,C,O,no,N,7,,213699,50202,ZAE
8,,SING,C,OXT,no,N,8,,213699,50202,ZAE
9,,SING,OXT,HXT,no,N,9,,213699,50202,ZAE
10,,SING,CB,CG,no,N,10,,213699,50202,ZAE
11,,SING,CB,HB2,no,N,11,,213699,50202,ZAE
12,,SING,CB,HB3,no,N,12,,213699,50202,ZAE
13,,DOUB,CG,CD1,yes,N,13,,213699,50202,ZAE
14,,SING,CG,CD2,yes,N,14,,213699,50202,ZAE
15,,SING,CD1,CE1,yes,N,15,,213699,50202,ZAE
16,,SING,CD1,HD1,no,N,16,,213699,50202,ZAE
17,,DOUB,CD2,CE2,yes,N,17,,213699,50202,ZAE
18,,SING,CD2,HD2,no,N,18,,213699,50202,ZAE
19,,DOUB,CE1,CZ,yes,N,19,,213699,50202,ZAE
20,,SING,CE1,HE1,no,N,20,,213699,50202,ZAE
21,,SING,CE2,CZ,yes,N,21,,213699,50202,ZAE
22,,SING,CE2,HE2,no,N,22,,213699,50202,ZAE
23,,SING,CZ,HZ,no,N,23,,213699,50202,ZAE
24,,SING,C10,H11,no,N,24,,213699,50202,ZAE
25,,SING,C10,H12,no,N,25,,213699,50202,ZAE
26,,SING,C10,H13,no,N,26,,213699,50202,ZAE
1,,SING,N,CA,no,N,1,,213700,50202,DAR
2,,SING,N,H,no,N,2,,213700,50202,DAR
3,,SING,N,H2,no,N,3,,213700,50202,DAR
4,,SING,CA,CB,no,N,4,,213700,50202,DAR
5,,SING,CA,C,no,N,5,,213700,50202,DAR
6,,SING,CA,HA,no,N,6,,213700,50202,DAR
7,,SING,CB,CG,no,N,7,,213700,50202,DAR
8,,SING,CB,HB2,no,N,8,,213700,50202,DAR
9,,SING,CB,HB3,no,N,9,,213700,50202,DAR
10,,SING,CG,CD,no,N,10,,213700,50202,DAR
11,,SING,CG,HG2,no,N,11,,213700,50202,DAR
12,,SING,CG,HG3,no,N,12,,213700,50202,DAR
13,,SING,CD,NE,no,N,13,,213700,50202,DAR
14,,SING,CD,HD2,no,N,14,,213700,50202,DAR
15,,SING,CD,HD3,no,N,15,,213700,50202,DAR
16,,SING,NE,CZ,no,N,16,,213700,50202,DAR
17,,SING,NE,HE,no,N,17,,213700,50202,DAR
18,,SING,CZ,NH1,no,N,18,,213700,50202,DAR
19,,DOUB,CZ,NH2,no,N,19,,213700,50202,DAR
20,,SING,NH1,HH11,no,N,20,,213700,50202,DAR
21,,SING,NH1,HH12,no,N,21,,213700,50202,DAR
22,,SING,NH2,HH21,no,N,22,,213700,50202,DAR
23,,SING,NH2,HH22,no,N,23,,213700,50202,DAR
24,,DOUB,C,O,no,N,24,,213700,50202,DAR
25,,SING,C,OXT,no,N,25,,213700,50202,DAR
26,,SING,OXT,HXT,no,N,26,,213700,50202,DAR
1,,SING,CG2,CB,no,N,1,,213701,50202,28J
2,,SING,CB,CG1,no,N,2,,213701,50202,28J
3,,SING,CB,CA,no,N,3,,213701,50202,28J
4,,SING,CG1,CD1,no,N,4,,213701,50202,28J
5,,SING,CA,N,no,N,5,,213701,50202,28J
6,,SING,CA,C,no,N,6,,213701,50202,28J
7,,DOUB,C,O,no,N,7,,213701,50202,28J
8,,SING,N,H20,no,N,8,,213701,50202,28J
9,,SING,CA,H21,no,N,9,,213701,50202,28J
10,,SING,CB,H22,no,N,10,,213701,50202,28J
11,,SING,CG2,H23,no,N,11,,213701,50202,28J
12,,SING,CG2,H24,no,N,12,,213701,50202,28J
13,,SING,CG2,H25,no,N,13,,213701,50202,28J
14,,SING,CG1,H26,no,N,14,,213701,50202,28J
15,,SING,CG1,H27,no,N,15,,213701,50202,28J
16,,SING,CD1,H28,no,N,16,,213701,50202,28J
17,,SING,CD1,H29,no,N,17,,213701,50202,28J
18,,SING,CD1,H30,no,N,18,,213701,50202,28J
19,,SING,N,H2,no,N,19,,213701,50202,28J
20,,SING,C,OXT,no,N,20,,213701,50202,28J
21,,SING,OXT,HXT,no,N,21,,213701,50202,28J
1,,SING,N,CA,no,N,1,,213702,50202,DTH
2,,SING,N,H,no,N,2,,213702,50202,DTH
3,,SING,N,HN2,no,N,3,,213702,50202,DTH
4,,SING,CA,CB,no,N,4,,213702,50202,DTH
5,,SING,CA,C,no,N,5,,213702,50202,DTH
6,,SING,CA,HA,no,N,6,,213702,50202,DTH
7,,SING,CB,CG2,no,N,7,,213702,50202,DTH
8,,SING,CB,OG1,no,N,8,,213702,50202,DTH
9,,SING,CB,HB,no,N,9,,213702,50202,DTH
10,,SING,CG2,HG21,no,N,10,,213702,50202,DTH
11,,SING,CG2,HG22,no,N,11,,213702,50202,DTH
12,,SING,CG2,HG23,no,N,12,,213702,50202,DTH
13,,SING,OG1,HG1,no,N,13,,213702,50202,DTH
14,,DOUB,C,O,no,N,14,,213702,50202,DTH
15,,SING,C,OXT,no,N,15,,213702,50202,DTH
16,,SING,OXT,HXT,no,N,16,,213702,50202,DTH
1,,SING,N,CA,no,N,1,,213703,50202,DAL
2,,SING,N,H,no,N,2,,213703,50202,DAL
3,,SING,N,H2,no,N,3,,213703,50202,DAL
4,,SING,CA,CB,no,N,4,,213703,50202,DAL
5,,SING,CA,C,no,N,5,,213703,50202,DAL
6,,SING,CA,HA,no,N,6,,213703,50202,DAL
7,,SING,CB,HB1,no,N,7,,213703,50202,DAL
8,,SING,CB,HB2,no,N,8,,213703,50202,DAL
9,,SING,CB,HB3,no,N,9,,213703,50202,DAL
10,,DOUB,C,O,no,N,10,,213703,50202,DAL
11,,SING,C,OXT,no,N,11,,213703,50202,DAL
12,,SING,OXT,HXT,no,N,12,,213703,50202,DAL
1,,SING,N,CA,no,N,1,,213704,50202,DGL
2,,SING,N,H,no,N,2,,213704,50202,DGL
3,,SING,N,H2,no,N,3,,213704,50202,DGL
4,,SING,CA,C,no,N,4,,213704,50202,DGL
5,,SING,CA,CB,no,N,5,,213704,50202,DGL
6,,SING,CA,HA,no,N,6,,213704,50202,DGL
7,,DOUB,C,O,no,N,7,,213704,50202,DGL
8,,SING,C,OXT,no,N,8,,213704,50202,DGL
9,,SING,CB,CG,no,N,9,,213704,50202,DGL
10,,SING,CB,HB2,no,N,10,,213704,50202,DGL
11,,SING,CB,HB3,no,N,11,,213704,50202,DGL
12,,SING,CG,CD,no,N,12,,213704,50202,DGL
13,,SING,CG,HG2,no,N,13,,213704,50202,DGL
14,,SING,CG,HG3,no,N,14,,213704,50202,DGL
15,,DOUB,CD,OE1,no,N,15,,213704,50202,DGL
16,,SING,CD,OE2,no,N,16,,213704,50202,DGL
17,,SING,OE2,HE2,no,N,17,,213704,50202,DGL
18,,SING,OXT,HXT,no,N,18,,213704,50202,DGL
1,,SING,N,CA,no,N,1,,213705,50202,GGL
2,,SING,N,H,no,N,2,,213705,50202,GGL
3,,SING,N,H2,no,N,3,,213705,50202,GGL
4,,SING,CA,C,no,N,4,,213705,50202,GGL
5,,SING,CA,CB,no,N,5,,213705,50202,GGL
6,,SING,CA,HA,no,N,6,,213705,50202,GGL
7,,DOUB,C,O,no,N,7,,213705,50202,GGL
8,,SING,C,OXT,no,N,8,,213705,50202,GGL
9,,SING,CB,CG,no,N,9,,213705,50202,GGL
10,,SING,CB,HB2,no,N,10,,213705,50202,GGL
11,,SING,CB,HB3,no,N,11,,213705,50202,GGL
12,,SING,CG,CD,no,N,12,,213705,50202,GGL
13,,SING,CG,HG2,no,N,13,,213705,50202,GGL
14,,SING,CG,HG3,no,N,14,,213705,50202,GGL
15,,DOUB,CD,OE1,no,N,15,,213705,50202,GGL
16,,SING,CD,OE2,no,N,16,,213705,50202,GGL
17,,SING,OE2,HE2,no,N,17,,213705,50202,GGL
18,,SING,OXT,HXT,no,N,18,,213705,50202,GGL
1,,SING,C1,C2,no,N,1,,213706,50202,MUB
2,,SING,C2,C3,no,N,2,,213706,50202,MUB
3,,SING,C3,C4,no,N,3,,213706,50202,MUB
4,,SING,C4,C5,no,N,4,,213706,50202,MUB
5,,SING,C5,C6,no,N,5,,213706,50202,MUB
6,,SING,C7,C8,no,N,6,,213706,50202,MUB
7,,SING,C9,C10,no,N,7,,213706,50202,MUB
8,,SING,C9,C11,no,N,8,,213706,50202,MUB
9,,SING,C1,O1,no,N,9,,213706,50202,MUB
10,,SING,C3,O3,no,N,10,,213706,50202,MUB
11,,SING,C9,O3,no,N,11,,213706,50202,MUB
12,,SING,C4,O4,no,N,12,,213706,50202,MUB
13,,SING,C1,O5,no,N,13,,213706,50202,MUB
14,,SING,C5,O5,no,N,14,,213706,50202,MUB
15,,SING,C6,O6,no,N,15,,213706,50202,MUB
16,,DOUB,C7,O7,no,N,16,,213706,50202,MUB
17,,SING,C10,O11,no,N,17,,213706,50202,MUB
18,,DOUB,C10,O10,no,N,18,,213706,50202,MUB
19,,SING,C2,N2,no,N,19,,213706,50202,MUB
20,,SING,C7,N2,no,N,20,,213706,50202,MUB
21,,SING,C1,H1,no,N,21,,213706,50202,MUB
22,,SING,C2,H2,no,N,22,,213706,50202,MUB
23,,SING,N2,HN2,no,N,23,,213706,50202,MUB
24,,SING,C8,H81,no,N,24,,213706,50202,MUB
25,,SING,C8,H82,no,N,25,,213706,50202,MUB
26,,SING,C8,H83,no,N,26,,213706,50202,MUB
27,,SING,C3,H3,no,N,27,,213706,50202,MUB
28,,SING,C9,H9,no,N,28,,213706,50202,MUB
29,,SING,C11,H111,no,N,29,,213706,50202,MUB
30,,SING,C11,H112,no,N,30,,213706,50202,MUB
31,,SING,C11,H113,no,N,31,,213706,50202,MUB
32,,SING,C4,H4A,no,N,32,,213706,50202,MUB
33,,SING,C5,H5,no,N,33,,213706,50202,MUB
34,,SING,C6,H61,no,N,34,,213706,50202,MUB
35,,SING,C6,H62,no,N,35,,213706,50202,MUB
36,,SING,O6,HO6,no,N,36,,213706,50202,MUB
37,,SING,O4,H4,no,N,37,,213706,50202,MUB
38,,SING,O11,H1',no,N,38,,213706,50202,MUB
39,,SING,O1,HO1,no,N,39,,213706,50202,MUB
1,,SING,C1,C2,no,N,1,,213707,50202,NAG
2,,SING,C1,O1,no,N,2,,213707,50202,NAG
3,,SING,C1,O5,no,N,3,,213707,50202,NAG
4,,SING,C1,H1,no,N,4,,213707,50202,NAG
5,,SING,C2,C3,no,N,5,,213707,50202,NAG
6,,SING,C2,N2,no,N,6,,213707,50202,NAG
7,,SING,C2,H2,no,N,7,,213707,50202,NAG
8,,SING,C3,C4,no,N,8,,213707,50202,NAG
9,,SING,C3,O3,no,N,9,,213707,50202,NAG
10,,SING,C3,H3,no,N,10,,213707,50202,NAG
11,,SING,C4,C5,no,N,11,,213707,50202,NAG
12,,SING,C4,O4,no,N,12,,213707,50202,NAG
13,,SING,C4,H4,no,N,13,,213707,50202,NAG
14,,SING,C5,C6,no,N,14,,213707,50202,NAG
15,,SING,C5,O5,no,N,15,,213707,50202,NAG
16,,SING,C5,H5,no,N,16,,213707,50202,NAG
17,,SING,C6,O6,no,N,17,,213707,50202,NAG
18,,SING,C6,H61,no,N,18,,213707,50202,NAG
19,,SING,C6,H62,no,N,19,,213707,50202,NAG
20,,SING,C7,C8,no,N,20,,213707,50202,NAG
21,,SING,C7,N2,no,N,21,,213707,50202,NAG
22,,DOUB,C7,O7,no,N,22,,213707,50202,NAG
23,,SING,C8,H81,no,N,23,,213707,50202,NAG
24,,SING,C8,H82,no,N,24,,213707,50202,NAG
25,,SING,C8,H83,no,N,25,,213707,50202,NAG
26,,SING,N2,HN2,no,N,26,,213707,50202,NAG
27,,SING,O1,HO1,no,N,27,,213707,50202,NAG
28,,SING,O3,HO3,no,N,28,,213707,50202,NAG
29,,SING,O4,HO4,no,N,29,,213707,50202,NAG
30,,SING,O6,HO6,no,N,30,,213707,50202,NAG
1,,SING,PA,O1A,no,N,1,,213725,50203,PCG
2,,DOUB,PA,O2A,no,N,2,,213725,50203,PCG
3,,SING,PA,O5',no,N,3,,213725,50203,PCG
4,,SING,PA,O3',no,N,4,,213725,50203,PCG
5,,SING,O1A,HO1A,no,N,5,,213725,50203,PCG
6,,SING,O5',C5',no,N,6,,213725,50203,PCG
7,,SING,C5',C4',no,N,7,,213725,50203,PCG
8,,SING,C5',H5'1,no,N,8,,213725,50203,PCG
9,,SING,C5',H5'2,no,N,9,,213725,50203,PCG
10,,SING,C4',O4',no,N,10,,213725,50203,PCG
11,,SING,C4',C3',no,N,11,,213725,50203,PCG
12,,SING,C4',H4',no,N,12,,213725,50203,PCG
13,,SING,O4',C1',no,N,13,,213725,50203,PCG
14,,SING,C3',O3',no,N,14,,213725,50203,PCG
15,,SING,C3',C2',no,N,15,,213725,50203,PCG
16,,SING,C3',H3',no,N,16,,213725,50203,PCG
17,,SING,C2',O2',no,N,17,,213725,50203,PCG
18,,SING,C2',C1',no,N,18,,213725,50203,PCG
19,,SING,C2',H2',no,N,19,,213725,50203,PCG
20,,SING,O2',HO2',no,N,20,,213725,50203,PCG
21,,SING,C1',N9,no,N,21,,213725,50203,PCG
22,,SING,C1',H1',no,N,22,,213725,50203,PCG
23,,SING,N9,C8,yes,N,23,,213725,50203,PCG
24,,SING,N9,C4,yes,N,24,,213725,50203,PCG
25,,DOUB,C8,N7,yes,N,25,,213725,50203,PCG
26,,SING,C8,H8,no,N,26,,213725,50203,PCG
27,,SING,N7,C5,yes,N,27,,213725,50203,PCG
28,,SING,C5,C6,no,N,28,,213725,50203,PCG
29,,DOUB,C5,C4,yes,N,29,,213725,50203,PCG
30,,DOUB,C6,O6,no,N,30,,213725,50203,PCG
31,,SING,C6,N1,no,N,31,,213725,50203,PCG
32,,SING,N1,C2,no,N,32,,213725,50203,PCG
33,,SING,N1,HN1,no,N,33,,213725,50203,PCG
34,,SING,C2,N2,no,N,34,,213725,50203,PCG
35,,DOUB,C2,N3,no,N,35,,213725,50203,PCG
36,,SING,N2,HN21,no,N,36,,213725,50203,PCG
37,,SING,N2,HN22,no,N,37,,213725,50203,PCG
38,,SING,N3,C4,no,N,38,,213725,50203,PCG
1,,DOUB,C,O,no,N,1,,213821,5021,ACE
2,,SING,C,CH3,no,N,2,,213821,5021,ACE
3,,SING,C,H,no,N,3,,213821,5021,ACE
4,,SING,CH3,H1,no,N,4,,213821,5021,ACE
5,,SING,CH3,H2,no,N,5,,213821,5021,ACE
6,,SING,CH3,H3,no,N,6,,213821,5021,ACE
1,,SING,N,HN1,no,N,1,,213822,5021,NH2
2,,SING,N,HN2,no,N,2,,213822,5021,NH2
1,,DOUB,P,O1,no,N,1,,213856,50212,PO4
2,,SING,P,O2,no,N,2,,213856,50212,PO4
3,,SING,P,O3,no,N,3,,213856,50212,PO4
4,,SING,P,O4,no,N,4,,213856,50212,PO4
1,,SING,OP3,P,no,N,1,,214155,50242,DU
2,,SING,OP3,HOP3,no,N,2,,214155,50242,DU
3,,DOUB,P,OP1,no,N,3,,214155,50242,DU
4,,SING,P,OP2,no,N,4,,214155,50242,DU
5,,SING,P,O5',no,N,5,,214155,50242,DU
6,,SING,OP2,HOP2,no,N,6,,214155,50242,DU
7,,SING,O5',C5',no,N,7,,214155,50242,DU
8,,SING,C5',C4',no,N,8,,214155,50242,DU
9,,SING,C5',H5',no,N,9,,214155,50242,DU
10,,SING,C5',H5'',no,N,10,,214155,50242,DU
11,,SING,C4',O4',no,N,11,,214155,50242,DU
12,,SING,C4',C3',no,N,12,,214155,50242,DU
13,,SING,C4',H4',no,N,13,,214155,50242,DU
14,,SING,O4',C1',no,N,14,,214155,50242,DU
15,,SING,C3',O3',no,N,15,,214155,50242,DU
16,,SING,C3',C2',no,N,16,,214155,50242,DU
17,,SING,C3',H3',no,N,17,,214155,50242,DU
18,,SING,O3',HO3',no,N,18,,214155,50242,DU
19,,SING,C2',C1',no,N,19,,214155,50242,DU
20,,SING,C2',H2',no,N,20,,214155,50242,DU
21,,SING,C2',H2'',no,N,21,,214155,50242,DU
22,,SING,C1',N1,no,N,22,,214155,50242,DU
23,,SING,C1',H1',no,N,23,,214155,50242,DU
24,,SING,N1,C2,no,N,24,,214155,50242,DU
25,,SING,N1,C6,no,N,25,,214155,50242,DU
26,,DOUB,C2,O2,no,N,26,,214155,50242,DU
27,,SING,C2,N3,no,N,27,,214155,50242,DU
28,,SING,N3,C4,no,N,28,,214155,50242,DU
29,,SING,N3,H3,no,N,29,,214155,50242,DU
30,,DOUB,C4,O4,no,N,30,,214155,50242,DU
31,,SING,C4,C5,no,N,31,,214155,50242,DU
32,,DOUB,C5,C6,no,N,32,,214155,50242,DU
33,,SING,C5,H5,no,N,33,,214155,50242,DU
34,,SING,C6,H6,no,N,34,,214155,50242,DU
1,,DOUB,PG,O1G,no,N,1,,214173,50243,ANP
2,,SING,PG,O2G,no,N,2,,214173,50243,ANP
3,,SING,PG,O3G,no,N,3,,214173,50243,ANP
4,,SING,PG,N3B,no,N,4,,214173,50243,ANP
5,,SING,O2G,HOG2,no,N,5,,214173,50243,ANP
6,,SING,O3G,HOG3,no,N,6,,214173,50243,ANP
7,,DOUB,PB,O1B,no,N,7,,214173,50243,ANP
8,,SING,PB,O2B,no,N,8,,214173,50243,ANP
9,,SING,PB,N3B,no,N,9,,214173,50243,ANP
10,,SING,PB,O3A,no,N,10,,214173,50243,ANP
11,,SING,O2B,HOB2,no,N,11,,214173,50243,ANP
12,,SING,N3B,HNB1,no,N,12,,214173,50243,ANP
13,,DOUB,PA,O1A,no,N,13,,214173,50243,ANP
14,,SING,PA,O2A,no,N,14,,214173,50243,ANP
15,,SING,PA,O3A,no,N,15,,214173,50243,ANP
16,,SING,PA,O5',no,N,16,,214173,50243,ANP
17,,SING,O2A,HOA2,no,N,17,,214173,50243,ANP
18,,SING,O5',C5',no,N,18,,214173,50243,ANP
19,,SING,C5',C4',no,N,19,,214173,50243,ANP
20,,SING,C5',H5'1,no,N,20,,214173,50243,ANP
21,,SING,C5',H5'2,no,N,21,,214173,50243,ANP
22,,SING,C4',O4',no,N,22,,214173,50243,ANP
23,,SING,C4',C3',no,N,23,,214173,50243,ANP
24,,SING,C4',H4',no,N,24,,214173,50243,ANP
25,,SING,O4',C1',no,N,25,,214173,50243,ANP
26,,SING,C3',O3',no,N,26,,214173,50243,ANP
27,,SING,C3',C2',no,N,27,,214173,50243,ANP
28,,SING,C3',H3',no,N,28,,214173,50243,ANP
29,,SING,O3',HO3',no,N,29,,214173,50243,ANP
30,,SING,C2',O2',no,N,30,,214173,50243,ANP
31,,SING,C2',C1',no,N,31,,214173,50243,ANP
32,,SING,C2',H2',no,N,32,,214173,50243,ANP
33,,SING,O2',HO2',no,N,33,,214173,50243,ANP
34,,SING,C1',N9,no,N,34,,214173,50243,ANP
35,,SING,C1',H1',no,N,35,,214173,50243,ANP
36,,SING,N9,C8,yes,N,36,,214173,50243,ANP
37,,SING,N9,C4,yes,N,37,,214173,50243,ANP
38,,DOUB,C8,N7,yes,N,38,,214173,50243,ANP
39,,SING,C8,H8,no,N,39,,214173,50243,ANP
40,,SING,N7,C5,yes,N,40,,214173,50243,ANP
41,,SING,C5,C6,yes,N,41,,214173,50243,ANP
42,,DOUB,C5,C4,yes,N,42,,214173,50243,ANP
43,,SING,C6,N6,no,N,43,,214173,50243,ANP
44,,DOUB,C6,N1,yes,N,44,,214173,50243,ANP
45,,SING,N6,HN61,no,N,45,,214173,50243,ANP
46,,SING,N6,HN62,no,N,46,,214173,50243,ANP
47,,SING,N1,C2,yes,N,47,,214173,50243,ANP
48,,DOUB,C2,N3,yes,N,48,,214173,50243,ANP
49,,SING,C2,H2,no,N,49,,214173,50243,ANP
50,,SING,N3,C4,yes,N,50,,214173,50243,ANP
1,,DOUB,OAC,CAM,no,N,1,,214226,50246,38T
2,,SING,NAI,CAM,no,N,2,,214226,50246,38T
3,,SING,NAI,CAL,no,N,3,,214226,50246,38T
4,,DOUB,OAB,CAL,no,N,4,,214226,50246,38T
5,,SING,CAM,NAR,no,N,5,,214226,50246,38T
6,,SING,O2',C2',no,N,6,,214226,50246,38T
7,,SING,C2',C3',no,N,7,,214226,50246,38T
8,,SING,C2',C1',no,N,8,,214226,50246,38T
9,,SING,CAL,CAK,no,N,9,,214226,50246,38T
10,,SING,O3',C3',no,N,10,,214226,50246,38T
11,,SING,NAR,C1',no,N,11,,214226,50246,38T
12,,SING,NAR,CAG,no,N,12,,214226,50246,38T
13,,SING,C3',C4',no,N,13,,214226,50246,38T
14,,SING,C1',O4',no,N,14,,214226,50246,38T
15,,DOUB,CAK,CAG,no,N,15,,214226,50246,38T
16,,SING,CAK,CAA,no,N,16,,214226,50246,38T
17,,SING,C4',O4',no,N,17,,214226,50246,38T
18,,SING,C4',C5',no,N,18,,214226,50246,38T
19,,SING,O5',C5',no,N,19,,214226,50246,38T
20,,SING,NAI,H1,no,N,20,,214226,50246,38T
21,,SING,CAA,H2,no,N,21,,214226,50246,38T
22,,SING,CAA,H3,no,N,22,,214226,50246,38T
23,,SING,CAA,H4,no,N,23,,214226,50246,38T
24,,SING,CAG,H5,no,N,24,,214226,50246,38T
25,,SING,C1',H6,no,N,25,,214226,50246,38T
26,,SING,C4',H7,no,N,26,,214226,50246,38T
27,,SING,C5',H8,no,N,27,,214226,50246,38T
28,,SING,C5',H9,no,N,28,,214226,50246,38T
29,,SING,O5',H10,no,N,29,,214226,50246,38T
30,,SING,C3',H11,no,N,30,,214226,50246,38T
31,,SING,O3',H12,no,N,31,,214226,50246,38T
32,,SING,C2',H13,no,N,32,,214226,50246,38T
33,,SING,O2',H14,no,N,33,,214226,50246,38T
1,,DOUB,O4,C4,no,N,1,,214241,50247,LLT
2,,SING,N3,C4,no,N,2,,214241,50247,LLT
3,,SING,C4,C5,no,N,3,,214241,50247,LLT
4,,SING,C5,C7,no,N,4,,214241,50247,LLT
5,,DOUB,C5,C6,no,N,5,,214241,50247,LLT
6,,SING,C7,H7,no,N,6,,214241,50247,LLT
7,,SING,C7,H7A,no,N,7,,214241,50247,LLT
8,,SING,C7,H7B,no,N,8,,214241,50247,LLT
9,,SING,N1,C6,no,N,9,,214241,50247,LLT
10,,SING,C6,H6,no,N,10,,214241,50247,LLT
11,,SING,N3,C2,no,N,11,,214241,50247,LLT
12,,SING,N3,HN3,no,N,12,,214241,50247,LLT
13,,DOUB,O2,C2,no,N,13,,214241,50247,LLT
14,,SING,C2,N1,no,N,14,,214241,50247,LLT
15,,SING,N1,C1',no,N,15,,214241,50247,LLT
16,,SING,O4',C1',no,N,16,,214241,50247,LLT
17,,SING,C1',C2',no,N,17,,214241,50247,LLT
18,,SING,C1',H1',no,N,18,,214241,50247,LLT
19,,SING,O4',C4',no,N,19,,214241,50247,LLT
20,,SING,C4',C5',no,N,20,,214241,50247,LLT
21,,SING,C4',C3',no,N,21,,214241,50247,LLT
22,,SING,C4',H4',no,N,22,,214241,50247,LLT
23,,SING,O5',C5',no,N,23,,214241,50247,LLT
24,,SING,C5',H5',no,N,24,,214241,50247,LLT
25,,SING,C5',H5'A,no,N,25,,214241,50247,LLT
26,,SING,O5',HO5',no,N,26,,214241,50247,LLT
27,,SING,C2',C3',no,N,27,,214241,50247,LLT
28,,SING,O3',C3',no,N,28,,214241,50247,LLT
29,,SING,C3',H3',no,N,29,,214241,50247,LLT
30,,SING,O3',HO3',no,N,30,,214241,50247,LLT
31,,SING,C2',H2',no,N,31,,214241,50247,LLT
32,,SING,C2',H2'A,no,N,32,,214241,50247,LLT
1,,SING,N,CA,no,N,1,,214285,5025,HSL
2,,SING,N,H,no,N,2,,214285,5025,HSL
3,,SING,N,H2,no,N,3,,214285,5025,HSL
4,,SING,CA,C,no,N,4,,214285,5025,HSL
5,,SING,CA,CB,no,N,5,,214285,5025,HSL
6,,SING,CA,HA,no,N,6,,214285,5025,HSL
7,,DOUB,C,O,no,N,7,,214285,5025,HSL
8,,SING,C,OD,no,N,8,,214285,5025,HSL
9,,SING,CB,CG,no,N,9,,214285,5025,HSL
10,,SING,CB,HB2,no,N,10,,214285,5025,HSL
11,,SING,CB,HB3,no,N,11,,214285,5025,HSL
12,,SING,CG,OD,no,N,12,,214285,5025,HSL
13,,SING,CG,HG2,no,N,13,,214285,5025,HSL
14,,SING,CG,HG3,no,N,14,,214285,5025,HSL
1,,SING,PA,O1A,no,N,1,,214311,50250,MGP
2,,DOUB,PA,O2A,no,N,2,,214311,50250,MGP
3,,SING,PA,O3A,no,N,3,,214311,50250,MGP
4,,SING,PA,O5',no,N,4,,214311,50250,MGP
5,,SING,O3A,PB,no,N,5,,214311,50250,MGP
6,,SING,O5',C5',no,N,6,,214311,50250,MGP
7,,SING,PB,O1B,no,N,7,,214311,50250,MGP
8,,DOUB,PB,O2B,no,N,8,,214311,50250,MGP
9,,SING,PB,O3B,no,N,9,,214311,50250,MGP
10,,SING,O3B,PC,no,N,10,,214311,50250,MGP
11,,SING,PC,O1C,no,N,11,,214311,50250,MGP
12,,DOUB,PC,O2C,no,N,12,,214311,50250,MGP
13,,SING,PC,O3C,no,N,13,,214311,50250,MGP
14,,SING,C5',C4',no,N,14,,214311,50250,MGP
15,,SING,C5',H5',no,N,15,,214311,50250,MGP
16,,SING,C5',H5'A,no,N,16,,214311,50250,MGP
17,,SING,C4',O4',no,N,17,,214311,50250,MGP
18,,SING,C4',C3',no,N,18,,214311,50250,MGP
19,,SING,C4',H4',no,N,19,,214311,50250,MGP
20,,SING,O4',C1',no,N,20,,214311,50250,MGP
21,,SING,C3',O3',no,N,21,,214311,50250,MGP
22,,SING,C3',C2',no,N,22,,214311,50250,MGP
23,,SING,C3',H3',no,N,23,,214311,50250,MGP
24,,SING,O3',HO3',no,N,24,,214311,50250,MGP
25,,SING,C2',O2',no,N,25,,214311,50250,MGP
26,,SING,C2',C1',no,N,26,,214311,50250,MGP
27,,SING,C2',H2',no,N,27,,214311,50250,MGP
28,,SING,O2',HO2',no,N,28,,214311,50250,MGP
29,,SING,C1',N9,no,N,29,,214311,50250,MGP
30,,SING,C1',H1',no,N,30,,214311,50250,MGP
31,,SING,N9,C8,yes,N,31,,214311,50250,MGP
32,,SING,N9,C4,yes,N,32,,214311,50250,MGP
33,,DOUB,C8,N7,yes,N,33,,214311,50250,MGP
34,,SING,C8,H8,no,N,34,,214311,50250,MGP
35,,SING,N7,CM7,no,N,35,,214311,50250,MGP
36,,SING,N7,C5,yes,N,36,,214311,50250,MGP
37,,SING,CM7,HM7,no,N,37,,214311,50250,MGP
38,,SING,CM7,HM7A,no,N,38,,214311,50250,MGP
39,,SING,CM7,HM7B,no,N,39,,214311,50250,MGP
40,,SING,C5,C6,no,N,40,,214311,50250,MGP
41,,DOUB,C5,C4,yes,N,41,,214311,50250,MGP
42,,DOUB,C6,O6,no,N,42,,214311,50250,MGP
43,,SING,C6,N1,no,N,43,,214311,50250,MGP
44,,SING,N1,C2,no,N,44,,214311,50250,MGP
45,,SING,N1,HN1,no,N,45,,214311,50250,MGP
46,,SING,C2,N2,no,N,46,,214311,50250,MGP
47,,DOUB,C2,N3,no,N,47,,214311,50250,MGP
48,,SING,N2,HN2,no,N,48,,214311,50250,MGP
49,,SING,N2,HN2A,no,N,49,,214311,50250,MGP
50,,SING,N3,C4,no,N,50,,214311,50250,MGP
51,,SING,O1A,H16,no,N,51,,214311,50250,MGP
52,,SING,O1B,H17,no,N,52,,214311,50250,MGP
53,,SING,O1C,H18,no,N,53,,214311,50250,MGP
54,,SING,O3C,H19,no,N,54,,214311,50250,MGP
1,,SING,FE,NA,no,N,1,,214403,5026,HEC
2,,SING,FE,NB,no,N,2,,214403,5026,HEC
3,,SING,FE,NC,no,N,3,,214403,5026,HEC
4,,SING,FE,ND,no,N,4,,214403,5026,HEC
5,,DOUB,CHA,C1A,no,N,5,,214403,5026,HEC
6,,SING,CHA,C4D,no,N,6,,214403,5026,HEC
7,,SING,CHA,HHA,no,N,7,,214403,5026,HEC
8,,DOUB,CHB,C4A,no,N,8,,214403,5026,HEC
9,,SING,CHB,C1B,no,N,9,,214403,5026,HEC
10,,SING,CHB,HHB,no,N,10,,214403,5026,HEC
11,,DOUB,CHC,C4B,no,N,11,,214403,5026,HEC
12,,SING,CHC,C1C,no,N,12,,214403,5026,HEC
13,,SING,CHC,HHC,no,N,13,,214403,5026,HEC
14,,DOUB,CHD,C4C,no,N,14,,214403,5026,HEC
15,,SING,CHD,C1D,no,N,15,,214403,5026,HEC
16,,SING,CHD,HHD,no,N,16,,214403,5026,HEC
17,,SING,NA,C1A,yes,N,17,,214403,5026,HEC
18,,SING,NA,C4A,yes,N,18,,214403,5026,HEC
19,,SING,C1A,C2A,yes,N,19,,214403,5026,HEC
20,,DOUB,C2A,C3A,yes,N,20,,214403,5026,HEC
21,,SING,C2A,CAA,no,N,21,,214403,5026,HEC
22,,SING,C3A,C4A,yes,N,22,,214403,5026,HEC
23,,SING,C3A,CMA,no,N,23,,214403,5026,HEC
24,,SING,CMA,HMA1,no,N,24,,214403,5026,HEC
25,,SING,CMA,HMA2,no,N,25,,214403,5026,HEC
26,,SING,CMA,HMA3,no,N,26,,214403,5026,HEC
27,,SING,CAA,CBA,no,N,27,,214403,5026,HEC
28,,SING,CAA,HAA1,no,N,28,,214403,5026,HEC
29,,SING,CAA,HAA2,no,N,29,,214403,5026,HEC
30,,SING,CBA,CGA,no,N,30,,214403,5026,HEC
31,,SING,CBA,HBA1,no,N,31,,214403,5026,HEC
32,,SING,CBA,HBA2,no,N,32,,214403,5026,HEC
33,,DOUB,CGA,O1A,no,N,33,,214403,5026,HEC
34,,SING,CGA,O2A,no,N,34,,214403,5026,HEC
35,,SING,O2A,H2A,no,N,35,,214403,5026,HEC
36,,SING,NB,C1B,yes,N,36,,214403,5026,HEC
37,,SING,NB,C4B,yes,N,37,,214403,5026,HEC
38,,DOUB,C1B,C2B,yes,N,38,,214403,5026,HEC
39,,SING,C2B,C3B,yes,N,39,,214403,5026,HEC
40,,SING,C2B,CMB,no,N,40,,214403,5026,HEC
41,,SING,C3B,C4B,yes,N,41,,214403,5026,HEC
42,,DOUB,C3B,CAB,no,E,42,,214403,5026,HEC
43,,SING,CMB,HMB1,no,N,43,,214403,5026,HEC
44,,SING,CMB,HMB2,no,N,44,,214403,5026,HEC
45,,SING,CMB,HMB3,no,N,45,,214403,5026,HEC
46,,SING,CAB,CBB,no,N,46,,214403,5026,HEC
47,,SING,CAB,HAB,no,N,47,,214403,5026,HEC
48,,SING,CBB,HBB1,no,N,48,,214403,5026,HEC
49,,SING,CBB,HBB2,no,N,49,,214403,5026,HEC
50,,SING,CBB,HBB3,no,N,50,,214403,5026,HEC
51,,SING,NC,C1C,yes,N,51,,214403,5026,HEC
52,,SING,NC,C4C,yes,N,52,,214403,5026,HEC
53,,DOUB,C1C,C2C,yes,N,53,,214403,5026,HEC
54,,SING,C2C,C3C,yes,N,54,,214403,5026,HEC
55,,SING,C2C,CMC,no,N,55,,214403,5026,HEC
56,,SING,C3C,C4C,yes,N,56,,214403,5026,HEC
57,,DOUB,C3C,CAC,no,E,57,,214403,5026,HEC
58,,SING,CMC,HMC1,no,N,58,,214403,5026,HEC
59,,SING,CMC,HMC2,no,N,59,,214403,5026,HEC
60,,SING,CMC,HMC3,no,N,60,,214403,5026,HEC
61,,SING,CAC,CBC,no,N,61,,214403,5026,HEC
62,,SING,CAC,HAC,no,N,62,,214403,5026,HEC
63,,SING,CBC,HBC1,no,N,63,,214403,5026,HEC
64,,SING,CBC,HBC2,no,N,64,,214403,5026,HEC
65,,SING,CBC,HBC3,no,N,65,,214403,5026,HEC
66,,SING,ND,C1D,yes,N,66,,214403,5026,HEC
67,,SING,ND,C4D,yes,N,67,,214403,5026,HEC
68,,DOUB,C1D,C2D,yes,N,68,,214403,5026,HEC
69,,SING,C2D,C3D,yes,N,69,,214403,5026,HEC
70,,SING,C2D,CMD,no,N,70,,214403,5026,HEC
71,,DOUB,C3D,C4D,yes,N,71,,214403,5026,HEC
72,,SING,C3D,CAD,no,N,72,,214403,5026,HEC
73,,SING,CMD,HMD1,no,N,73,,214403,5026,HEC
74,,SING,CMD,HMD2,no,N,74,,214403,5026,HEC
75,,SING,CMD,HMD3,no,N,75,,214403,5026,HEC
76,,SING,CAD,CBD,no,N,76,,214403,5026,HEC
77,,SING,CAD,HAD1,no,N,77,,214403,5026,HEC
78,,SING,CAD,HAD2,no,N,78,,214403,5026,HEC
79,,SING,CBD,CGD,no,N,79,,214403,5026,HEC
80,,SING,CBD,HBD1,no,N,80,,214403,5026,HEC
81,,SING,CBD,HBD2,no,N,81,,214403,5026,HEC
82,,DOUB,CGD,O1D,no,N,82,,214403,5026,HEC
83,,SING,CGD,O2D,no,N,83,,214403,5026,HEC
84,,SING,O2D,H2D,no,N,84,,214403,5026,HEC
1,,TRIP,C,N,no,N,1,,214404,5026,CYN
1,,DOUB,PB,O1B,no,N,1,,214425,50260,GDP
2,,SING,PB,O2B,no,N,2,,214425,50260,GDP
3,,SING,PB,O3B,no,N,3,,214425,50260,GDP
4,,SING,PB,O3A,no,N,4,,214425,50260,GDP
5,,SING,O2B,HOB2,no,N,5,,214425,50260,GDP
6,,SING,O3B,HOB3,no,N,6,,214425,50260,GDP
7,,SING,O3A,PA,no,N,7,,214425,50260,GDP
8,,DOUB,PA,O1A,no,N,8,,214425,50260,GDP
9,,SING,PA,O2A,no,N,9,,214425,50260,GDP
10,,SING,PA,O5',no,N,10,,214425,50260,GDP
11,,SING,O2A,HOA2,no,N,11,,214425,50260,GDP
12,,SING,O5',C5',no,N,12,,214425,50260,GDP
13,,SING,C5',C4',no,N,13,,214425,50260,GDP
14,,SING,C5',H5',no,N,14,,214425,50260,GDP
15,,SING,C5',H5'',no,N,15,,214425,50260,GDP
16,,SING,C4',O4',no,N,16,,214425,50260,GDP
17,,SING,C4',C3',no,N,17,,214425,50260,GDP
18,,SING,C4',H4',no,N,18,,214425,50260,GDP
19,,SING,O4',C1',no,N,19,,214425,50260,GDP
20,,SING,C3',O3',no,N,20,,214425,50260,GDP
21,,SING,C3',C2',no,N,21,,214425,50260,GDP
22,,SING,C3',H3',no,N,22,,214425,50260,GDP
23,,SING,O3',HO3',no,N,23,,214425,50260,GDP
24,,SING,C2',O2',no,N,24,,214425,50260,GDP
25,,SING,C2',C1',no,N,25,,214425,50260,GDP
26,,SING,C2',H2',no,N,26,,214425,50260,GDP
27,,SING,O2',HO2',no,N,27,,214425,50260,GDP
28,,SING,C1',N9,no,N,28,,214425,50260,GDP
29,,SING,C1',H1',no,N,29,,214425,50260,GDP
30,,SING,N9,C8,yes,N,30,,214425,50260,GDP
31,,SING,N9,C4,yes,N,31,,214425,50260,GDP
32,,DOUB,C8,N7,yes,N,32,,214425,50260,GDP
33,,SING,C8,H8,no,N,33,,214425,50260,GDP
34,,SING,N7,C5,yes,N,34,,214425,50260,GDP
35,,SING,C5,C6,no,N,35,,214425,50260,GDP
36,,DOUB,C5,C4,yes,N,36,,214425,50260,GDP
37,,DOUB,C6,O6,no,N,37,,214425,50260,GDP
38,,SING,C6,N1,no,N,38,,214425,50260,GDP
39,,SING,N1,C2,no,N,39,,214425,50260,GDP
40,,SING,N1,HN1,no,N,40,,214425,50260,GDP
41,,SING,C2,N2,no,N,41,,214425,50260,GDP
42,,DOUB,C2,N3,no,N,42,,214425,50260,GDP
43,,SING,N2,HN21,no,N,43,,214425,50260,GDP
44,,SING,N2,HN22,no,N,44,,214425,50260,GDP
45,,SING,N3,C4,no,N,45,,214425,50260,GDP
1,,SING,C16,C14,no,N,1,,214457,50262,UED
2,,DOUB,C3,C2,yes,N,2,,214457,50262,UED
3,,SING,C3,C4,yes,N,3,,214457,50262,UED
4,,SING,C2,C1,yes,N,4,,214457,50262,UED
5,,SING,C14,C13,no,N,5,,214457,50262,UED
6,,SING,C14,C15,no,N,6,,214457,50262,UED
7,,SING,C13,C12,no,N,7,,214457,50262,UED
8,,DOUB,C4,C5,yes,N,8,,214457,50262,UED
9,,SING,O8,C7,no,N,9,,214457,50262,UED
10,,SING,O8,C9,no,N,10,,214457,50262,UED
11,,SING,N11,C12,no,N,11,,214457,50262,UED
12,,SING,N11,C9,no,N,12,,214457,50262,UED
13,,SING,C1,C7,no,N,13,,214457,50262,UED
14,,DOUB,C1,C6,yes,N,14,,214457,50262,UED
15,,DOUB,O18,C17,no,N,15,,214457,50262,UED
16,,SING,C5,C6,yes,N,16,,214457,50262,UED
17,,SING,C12,C17,no,N,17,,214457,50262,UED
18,,DOUB,C9,O10,no,N,18,,214457,50262,UED
19,,SING,C17,N19,no,N,19,,214457,50262,UED
20,,SING,C26,C27,no,N,20,,214457,50262,UED
21,,SING,C26,C25,no,N,21,,214457,50262,UED
22,,SING,N19,C20,no,N,22,,214457,50262,UED
23,,SING,C20,C21,no,N,23,,214457,50262,UED
24,,SING,C20,C24,no,N,24,,214457,50262,UED
25,,SING,C27,N28,no,N,25,,214457,50262,UED
26,,SING,O22,C21,no,N,26,,214457,50262,UED
27,,SING,C25,C24,no,N,27,,214457,50262,UED
28,,SING,C25,C29,no,N,28,,214457,50262,UED
29,,SING,N28,C29,no,N,29,,214457,50262,UED
30,,DOUB,C29,O30,no,N,30,,214457,50262,UED
31,,SING,C7,H1,no,N,31,,214457,50262,UED
32,,SING,C7,H2,no,N,32,,214457,50262,UED
33,,SING,C2,H3,no,N,33,,214457,50262,UED
34,,SING,C3,H4,no,N,34,,214457,50262,UED
35,,SING,C4,H5,no,N,35,,214457,50262,UED
36,,SING,C5,H6,no,N,36,,214457,50262,UED
37,,SING,C6,H7,no,N,37,,214457,50262,UED
38,,SING,N11,H8,no,N,38,,214457,50262,UED
39,,SING,C12,H9,no,N,39,,214457,50262,UED
40,,SING,C13,H10,no,N,40,,214457,50262,UED
41,,SING,C13,H11,no,N,41,,214457,50262,UED
42,,SING,C14,H12,no,N,42,,214457,50262,UED
43,,SING,C15,H13,no,N,43,,214457,50262,UED
44,,SING,C15,H14,no,N,44,,214457,50262,UED
45,,SING,C15,H15,no,N,45,,214457,50262,UED
46,,SING,C16,H16,no,N,46,,214457,50262,UED
47,,SING,C16,H17,no,N,47,,214457,50262,UED
48,,SING,C16,H18,no,N,48,,214457,50262,UED
49,,SING,N19,H19,no,N,49,,214457,50262,UED
50,,SING,C20,H20,no,N,50,,214457,50262,UED
51,,SING,C24,H21,no,N,51,,214457,50262,UED
52,,SING,C24,H22,no,N,52,,214457,50262,UED
53,,SING,C25,H23,no,N,53,,214457,50262,UED
54,,SING,C26,H24,no,N,54,,214457,50262,UED
55,,SING,C26,H25,no,N,55,,214457,50262,UED
56,,SING,C27,H26,no,N,56,,214457,50262,UED
57,,SING,C27,H27,no,N,57,,214457,50262,UED
58,,SING,N28,H28,no,N,58,,214457,50262,UED
59,,SING,C21,H29,no,N,59,,214457,50262,UED
60,,SING,C21,H30,no,N,60,,214457,50262,UED
61,,SING,O22,H31,no,N,61,,214457,50262,UED
1,,SING,PG,O3B,no,N,1,,214517,50267,GSP
2,,DOUB,PG,S1G,no,N,2,,214517,50267,GSP
3,,SING,PG,O2G,no,N,3,,214517,50267,GSP
4,,SING,PG,O3G,no,N,4,,214517,50267,GSP
5,,SING,O3B,PB,no,N,5,,214517,50267,GSP
6,,SING,O2G,HOG2,no,N,6,,214517,50267,GSP
7,,SING,O3G,HOG3,no,N,7,,214517,50267,GSP
8,,DOUB,PB,O1B,no,N,8,,214517,50267,GSP
9,,SING,PB,O2B,no,N,9,,214517,50267,GSP
10,,SING,PB,O3A,no,N,10,,214517,50267,GSP
11,,SING,O2B,HOB2,no,N,11,,214517,50267,GSP
12,,DOUB,PA,O1A,no,N,12,,214517,50267,GSP
13,,SING,PA,O2A,no,N,13,,214517,50267,GSP
14,,SING,PA,O3A,no,N,14,,214517,50267,GSP
15,,SING,PA,O5',no,N,15,,214517,50267,GSP
16,,SING,O2A,HOA2,no,N,16,,214517,50267,GSP
17,,SING,O5',C5',no,N,17,,214517,50267,GSP
18,,SING,C5',C4',no,N,18,,214517,50267,GSP
19,,SING,C5',H5'1,no,N,19,,214517,50267,GSP
20,,SING,C5',H5'2,no,N,20,,214517,50267,GSP
21,,SING,C4',O4',no,N,21,,214517,50267,GSP
22,,SING,C4',C3',no,N,22,,214517,50267,GSP
23,,SING,C4',H4',no,N,23,,214517,50267,GSP
24,,SING,O4',C1',no,N,24,,214517,50267,GSP
25,,SING,C3',O3',no,N,25,,214517,50267,GSP
26,,SING,C3',C2',no,N,26,,214517,50267,GSP
27,,SING,C3',H3',no,N,27,,214517,50267,GSP
28,,SING,O3',HO3',no,N,28,,214517,50267,GSP
29,,SING,C2',O2',no,N,29,,214517,50267,GSP
30,,SING,C2',C1',no,N,30,,214517,50267,GSP
31,,SING,C2',H2',no,N,31,,214517,50267,GSP
32,,SING,O2',HO2',no,N,32,,214517,50267,GSP
33,,SING,C1',N9,no,N,33,,214517,50267,GSP
34,,SING,C1',H1',no,N,34,,214517,50267,GSP
35,,SING,N9,C8,yes,N,35,,214517,50267,GSP
36,,SING,N9,C4,yes,N,36,,214517,50267,GSP
37,,DOUB,C8,N7,yes,N,37,,214517,50267,GSP
38,,SING,C8,H8,no,N,38,,214517,50267,GSP
39,,SING,N7,C5,yes,N,39,,214517,50267,GSP
40,,SING,C5,C6,no,N,40,,214517,50267,GSP
41,,DOUB,C5,C4,yes,N,41,,214517,50267,GSP
42,,DOUB,C6,O6,no,N,42,,214517,50267,GSP
43,,SING,C6,N1,no,N,43,,214517,50267,GSP
44,,SING,N1,C2,no,N,44,,214517,50267,GSP
45,,SING,N1,HN1,no,N,45,,214517,50267,GSP
46,,SING,C2,N2,no,N,46,,214517,50267,GSP
47,,DOUB,C2,N3,no,N,47,,214517,50267,GSP
48,,SING,N2,HN21,no,N,48,,214517,50267,GSP
49,,SING,N2,HN22,no,N,49,,214517,50267,GSP
50,,SING,N3,C4,no,N,50,,214517,50267,GSP
1,,SING,P,OP2,no,N,1,,214670,50278,5FC
2,,DOUB,P,OP1,no,N,2,,214670,50278,5FC
3,,SING,P,O5',no,N,3,,214670,50278,5FC
4,,SING,P,OP3,no,N,4,,214670,50278,5FC
5,,SING,OP2,HOP2,no,N,5,,214670,50278,5FC
6,,SING,O5',C5',no,N,6,,214670,50278,5FC
7,,SING,N1,C6,no,N,7,,214670,50278,5FC
8,,SING,N1,C2,no,N,8,,214670,50278,5FC
9,,SING,N1,C1',no,N,9,,214670,50278,5FC
10,,DOUB,C6,C5,no,N,10,,214670,50278,5FC
11,,SING,C6,H6,no,N,11,,214670,50278,5FC
12,,DOUB,C2,O2,no,N,12,,214670,50278,5FC
13,,SING,C2,N3,no,N,13,,214670,50278,5FC
14,,DOUB,N3,C4,no,N,14,,214670,50278,5FC
15,,SING,C4,N4,no,N,15,,214670,50278,5FC
16,,SING,C4,C5,no,N,16,,214670,50278,5FC
17,,SING,N4,HN41,no,N,17,,214670,50278,5FC
18,,SING,N4,HN42,no,N,18,,214670,50278,5FC
19,,SING,C5,C5A,no,N,19,,214670,50278,5FC
20,,SING,C2',C1',no,N,20,,214670,50278,5FC
21,,SING,C2',C3',no,N,21,,214670,50278,5FC
22,,SING,C2',H2',no,N,22,,214670,50278,5FC
23,,SING,C2',H2'',no,N,23,,214670,50278,5FC
24,,SING,C5',C4',no,N,24,,214670,50278,5FC
25,,SING,C5',H5',no,N,25,,214670,50278,5FC
26,,SING,C5',H5'',no,N,26,,214670,50278,5FC
27,,SING,C4',O4',no,N,27,,214670,50278,5FC
28,,SING,C4',C3',no,N,28,,214670,50278,5FC
29,,SING,C4',H4',no,N,29,,214670,50278,5FC
30,,SING,O4',C1',no,N,30,,214670,50278,5FC
31,,SING,C1',H1',no,N,31,,214670,50278,5FC
32,,SING,C3',O3',no,N,32,,214670,50278,5FC
33,,SING,C3',H3',no,N,33,,214670,50278,5FC
34,,SING,O3',HO3',no,N,34,,214670,50278,5FC
35,,DOUB,C5A,O5A,no,N,35,,214670,50278,5FC
36,,SING,C5A,H5A,no,N,36,,214670,50278,5FC
37,,SING,OP3,HOP3,no,N,37,,214670,50278,5FC
1,,SING,N,CA,no,N,1,,214738,50298,TPO
2,,SING,N,H,no,N,2,,214738,50298,TPO
3,,SING,N,H2,no,N,3,,214738,50298,TPO
4,,SING,CA,CB,no,N,4,,214738,50298,TPO
5,,SING,CA,C,no,N,5,,214738,50298,TPO
6,,SING,CA,HA,no,N,6,,214738,50298,TPO
7,,SING,CB,CG2,no,N,7,,214738,50298,TPO
8,,SING,CB,OG1,no,N,8,,214738,50298,TPO
9,,SING,CB,HB,no,N,9,,214738,50298,TPO
10,,SING,CG2,HG21,no,N,10,,214738,50298,TPO
11,,SING,CG2,HG22,no,N,11,,214738,50298,TPO
12,,SING,CG2,HG23,no,N,12,,214738,50298,TPO
13,,SING,OG1,P,no,N,13,,214738,50298,TPO
14,,DOUB,P,O1P,no,N,14,,214738,50298,TPO
15,,SING,P,O2P,no,N,15,,214738,50298,TPO
16,,SING,P,O3P,no,N,16,,214738,50298,TPO
17,,SING,O2P,HOP2,no,N,17,,214738,50298,TPO
18,,SING,O3P,HOP3,no,N,18,,214738,50298,TPO
19,,DOUB,C,O,no,N,19,,214738,50298,TPO
20,,SING,C,OXT,no,N,20,,214738,50298,TPO
21,,SING,OXT,HXT,no,N,21,,214738,50298,TPO
1,,SING,N,CA,no,N,1,,214739,50298,SEP
2,,SING,N,H,no,N,2,,214739,50298,SEP
3,,SING,N,H2,no,N,3,,214739,50298,SEP
4,,SING,CA,CB,no,N,4,,214739,50298,SEP
5,,SING,CA,C,no,N,5,,214739,50298,SEP
6,,SING,CA,HA,no,N,6,,214739,50298,SEP
7,,SING,CB,OG,no,N,7,,214739,50298,SEP
8,,SING,CB,HB2,no,N,8,,214739,50298,SEP
9,,SING,CB,HB3,no,N,9,,214739,50298,SEP
10,,SING,OG,P,no,N,10,,214739,50298,SEP
11,,DOUB,C,O,no,N,11,,214739,50298,SEP
12,,SING,C,OXT,no,N,12,,214739,50298,SEP
13,,SING,OXT,HXT,no,N,13,,214739,50298,SEP
14,,DOUB,P,O1P,no,N,14,,214739,50298,SEP
15,,SING,P,O2P,no,N,15,,214739,50298,SEP
16,,SING,P,O3P,no,N,16,,214739,50298,SEP
17,,SING,O2P,HOP2,no,N,17,,214739,50298,SEP
18,,SING,O3P,HOP3,no,N,18,,214739,50298,SEP
1,,DOUB,C1,C2,yes,N,1,,215081,50333,LCM
2,,SING,C1,C6,yes,N,2,,215081,50333,LCM
3,,SING,C2,C3,yes,N,3,,215081,50333,LCM
4,,SING,C2,O26,no,N,4,,215081,50333,LCM
5,,DOUB,C3,C4,yes,N,5,,215081,50333,LCM
6,,SING,C3,O25,no,N,6,,215081,50333,LCM
7,,SING,C4,C5,yes,N,7,,215081,50333,LCM
8,,SING,C4,C7,no,N,8,,215081,50333,LCM
9,,DOUB,C5,C6,yes,N,9,,215081,50333,LCM
10,,SING,C7,N8,no,N,10,,215081,50333,LCM
11,,DOUB,C7,O9,no,N,11,,215081,50333,LCM
12,,SING,N8,C10,no,N,12,,215081,50333,LCM
13,,SING,C10,C11,no,N,13,,215081,50333,LCM
14,,SING,C11,C12,no,N,14,,215081,50333,LCM
15,,SING,C12,C13,no,N,15,,215081,50333,LCM
16,,SING,C13,N14,no,N,16,,215081,50333,LCM
17,,SING,N14,C15,no,N,17,,215081,50333,LCM
18,,SING,C15,C16,no,N,18,,215081,50333,LCM
19,,DOUB,C15,O17,no,N,19,,215081,50333,LCM
20,,DOUB,C16,C18,yes,N,20,,215081,50333,LCM
21,,SING,C16,C22,yes,N,21,,215081,50333,LCM
22,,SING,C18,C19,yes,N,22,,215081,50333,LCM
23,,SING,C18,O23,no,N,23,,215081,50333,LCM
24,,DOUB,C19,C20,yes,N,24,,215081,50333,LCM
25,,SING,C19,O24,no,N,25,,215081,50333,LCM
26,,SING,C20,C21,yes,N,26,,215081,50333,LCM
27,,DOUB,C21,C22,yes,N,27,,215081,50333,LCM
28,,SING,C1,H1,no,N,28,,215081,50333,LCM
29,,SING,C5,H5,no,N,29,,215081,50333,LCM
30,,SING,C6,H6,no,N,30,,215081,50333,LCM
31,,SING,N8,HN8,no,N,31,,215081,50333,LCM
32,,SING,C10,H10,no,N,32,,215081,50333,LCM
33,,SING,C10,H10A,no,N,33,,215081,50333,LCM
34,,SING,C11,H11,no,N,34,,215081,50333,LCM
35,,SING,C11,H11A,no,N,35,,215081,50333,LCM
36,,SING,C12,H12,no,N,36,,215081,50333,LCM
37,,SING,C12,H12A,no,N,37,,215081,50333,LCM
38,,SING,C13,H13,no,N,38,,215081,50333,LCM
39,,SING,C13,H13A,no,N,39,,215081,50333,LCM
40,,SING,N14,HN14,no,N,40,,215081,50333,LCM
41,,SING,C20,H20,no,N,41,,215081,50333,LCM
42,,SING,C21,H21,no,N,42,,215081,50333,LCM
43,,SING,C22,H22,no,N,43,,215081,50333,LCM
44,,SING,O23,HO23,no,N,44,,215081,50333,LCM
45,,SING,O24,HO24,no,N,45,,215081,50333,LCM
46,,SING,O25,HO25,no,N,46,,215081,50333,LCM
47,,SING,O26,HO26,no,N,47,,215081,50333,LCM
1,,DOUB,PG,O1G,no,N,1,,215498,50385,ATP
2,,SING,PG,O2G,no,N,2,,215498,50385,ATP
3,,SING,PG,O3G,no,N,3,,215498,50385,ATP
4,,SING,PG,O3B,no,N,4,,215498,50385,ATP
5,,SING,O2G,HOG2,no,N,5,,215498,50385,ATP
6,,SING,O3G,HOG3,no,N,6,,215498,50385,ATP
7,,DOUB,PB,O1B,no,N,7,,215498,50385,ATP
8,,SING,PB,O2B,no,N,8,,215498,50385,ATP
9,,SING,PB,O3B,no,N,9,,215498,50385,ATP
10,,SING,PB,O3A,no,N,10,,215498,50385,ATP
11,,SING,O2B,HOB2,no,N,11,,215498,50385,ATP
12,,DOUB,PA,O1A,no,N,12,,215498,50385,ATP
13,,SING,PA,O2A,no,N,13,,215498,50385,ATP
14,,SING,PA,O3A,no,N,14,,215498,50385,ATP
15,,SING,PA,O5',no,N,15,,215498,50385,ATP
16,,SING,O2A,HOA2,no,N,16,,215498,50385,ATP
17,,SING,O5',C5',no,N,17,,215498,50385,ATP
18,,SING,C5',C4',no,N,18,,215498,50385,ATP
19,,SING,C5',H5'1,no,N,19,,215498,50385,ATP
20,,SING,C5',H5'2,no,N,20,,215498,50385,ATP
21,,SING,C4',O4',no,N,21,,215498,50385,ATP
22,,SING,C4',C3',no,N,22,,215498,50385,ATP
23,,SING,C4',H4',no,N,23,,215498,50385,ATP
24,,SING,O4',C1',no,N,24,,215498,50385,ATP
25,,SING,C3',O3',no,N,25,,215498,50385,ATP
26,,SING,C3',C2',no,N,26,,215498,50385,ATP
27,,SING,C3',H3',no,N,27,,215498,50385,ATP
28,,SING,O3',HO3',no,N,28,,215498,50385,ATP
29,,SING,C2',O2',no,N,29,,215498,50385,ATP
30,,SING,C2',C1',no,N,30,,215498,50385,ATP
31,,SING,C2',H2',no,N,31,,215498,50385,ATP
32,,SING,O2',HO2',no,N,32,,215498,50385,ATP
33,,SING,C1',N9,no,N,33,,215498,50385,ATP
34,,SING,C1',H1',no,N,34,,215498,50385,ATP
35,,SING,N9,C8,yes,N,35,,215498,50385,ATP
36,,SING,N9,C4,yes,N,36,,215498,50385,ATP
37,,DOUB,C8,N7,yes,N,37,,215498,50385,ATP
38,,SING,C8,H8,no,N,38,,215498,50385,ATP
39,,SING,N7,C5,yes,N,39,,215498,50385,ATP
40,,SING,C5,C6,yes,N,40,,215498,50385,ATP
41,,DOUB,C5,C4,yes,N,41,,215498,50385,ATP
42,,SING,C6,N6,no,N,42,,215498,50385,ATP
43,,DOUB,C6,N1,yes,N,43,,215498,50385,ATP
44,,SING,N6,HN61,no,N,44,,215498,50385,ATP
45,,SING,N6,HN62,no,N,45,,215498,50385,ATP
46,,SING,N1,C2,yes,N,46,,215498,50385,ATP
47,,DOUB,C2,N3,yes,N,47,,215498,50385,ATP
48,,SING,C2,H2,no,N,48,,215498,50385,ATP
49,,SING,N3,C4,yes,N,49,,215498,50385,ATP
1,,DOUB,C1,O1,no,N,1,,215513,50386,PEP
2,,SING,C1,O2',no,N,2,,215513,50386,PEP
3,,SING,C1,C2,no,N,3,,215513,50386,PEP
4,,SING,O2',HO2,no,N,4,,215513,50386,PEP
5,,DOUB,C2,C3,no,N,5,,215513,50386,PEP
6,,SING,C2,O2,no,N,6,,215513,50386,PEP
7,,SING,C3,H31,no,N,7,,215513,50386,PEP
8,,SING,C3,H32,no,N,8,,215513,50386,PEP
9,,SING,O2,P,no,N,9,,215513,50386,PEP
10,,DOUB,P,O1P,no,N,10,,215513,50386,PEP
11,,SING,P,O2P,no,N,11,,215513,50386,PEP
12,,SING,P,O3P,no,N,12,,215513,50386,PEP
13,,SING,O2P,HOP2,no,N,13,,215513,50386,PEP
14,,SING,O3P,HOP3,no,N,14,,215513,50386,PEP
1,,SING,N,CA,no,N,1,,215514,50386,NEP
2,,SING,N,H,no,N,2,,215514,50386,NEP
3,,SING,N,H2,no,N,3,,215514,50386,NEP
4,,SING,CA,C,no,N,4,,215514,50386,NEP
5,,SING,CA,CB,no,N,5,,215514,50386,NEP
6,,SING,CA,HA,no,N,6,,215514,50386,NEP
7,,DOUB,C,O,no,N,7,,215514,50386,NEP
8,,SING,C,OXT,no,N,8,,215514,50386,NEP
9,,SING,CB,CG,no,N,9,,215514,50386,NEP
10,,SING,CB,HB2,no,N,10,,215514,50386,NEP
11,,SING,CB,HB3,no,N,11,,215514,50386,NEP
12,,SING,CG,ND1,yes,N,12,,215514,50386,NEP
13,,DOUB,CG,CD2,yes,N,13,,215514,50386,NEP
14,,DOUB,ND1,CE1,yes,N,14,,215514,50386,NEP
15,,SING,CD2,NE2,yes,N,15,,215514,50386,NEP
16,,SING,CD2,HD2,no,N,16,,215514,50386,NEP
17,,SING,CE1,NE2,yes,N,17,,215514,50386,NEP
18,,SING,CE1,HE1,no,N,18,,215514,50386,NEP
19,,SING,NE2,P,no,N,19,,215514,50386,NEP
20,,SING,P,O1P,no,N,20,,215514,50386,NEP
21,,SING,P,O2P,no,N,21,,215514,50386,NEP
22,,DOUB,P,O3P,no,N,22,,215514,50386,NEP
23,,SING,O1P,HOP1,no,N,23,,215514,50386,NEP
24,,SING,O2P,HOP2,no,N,24,,215514,50386,NEP
25,,SING,OXT,HXT,no,N,25,,215514,50386,NEP
1,,SING,N1,C2,yes,N,1,,215547,50388,APR
2,,DOUB,N1,C6,yes,N,2,,215547,50388,APR
3,,DOUB,C2,N3,yes,N,3,,215547,50388,APR
4,,SING,C2,H2,no,N,4,,215547,50388,APR
5,,SING,N3,C4,yes,N,5,,215547,50388,APR
6,,DOUB,C4,C5,yes,N,6,,215547,50388,APR
7,,SING,C4,N9,yes,N,7,,215547,50388,APR
8,,SING,C5,C6,yes,N,8,,215547,50388,APR
9,,SING,C5,N7,yes,N,9,,215547,50388,APR
10,,SING,C6,N6,no,N,10,,215547,50388,APR
11,,SING,N6,H61,no,N,11,,215547,50388,APR
12,,SING,N6,H62,no,N,12,,215547,50388,APR
13,,DOUB,N7,C8,yes,N,13,,215547,50388,APR
14,,SING,C8,N9,yes,N,14,,215547,50388,APR
15,,SING,C8,H8,no,N,15,,215547,50388,APR
16,,SING,N9,C1',no,N,16,,215547,50388,APR
17,,SING,C1',C2',no,N,17,,215547,50388,APR
18,,SING,C1',O4',no,N,18,,215547,50388,APR
19,,SING,C1',H'1,no,N,19,,215547,50388,APR
20,,SING,C2',O2',no,N,20,,215547,50388,APR
21,,SING,C2',C3',no,N,21,,215547,50388,APR
22,,SING,C2',H'2,no,N,22,,215547,50388,APR
23,,SING,O2',HO'2,no,N,23,,215547,50388,APR
24,,SING,C3',O3',no,N,24,,215547,50388,APR
25,,SING,C3',C4',no,N,25,,215547,50388,APR
26,,SING,C3',H'3,no,N,26,,215547,50388,APR
27,,SING,O3',HO'3,no,N,27,,215547,50388,APR
28,,SING,O4',C4',no,N,28,,215547,50388,APR
29,,SING,C4',C5',no,N,29,,215547,50388,APR
30,,SING,C4',H'4,no,N,30,,215547,50388,APR
31,,SING,C5',O5',no,N,31,,215547,50388,APR
32,,SING,C5',H5'1,no,N,32,,215547,50388,APR
33,,SING,C5',H5'2,no,N,33,,215547,50388,APR
34,,SING,O5',PA,no,N,34,,215547,50388,APR
35,,DOUB,PA,O1A,no,N,35,,215547,50388,APR
36,,SING,PA,O2A,no,N,36,,215547,50388,APR
37,,SING,PA,O3A,no,N,37,,215547,50388,APR
38,,SING,O2A,HOA2,no,N,38,,215547,50388,APR
39,,SING,O3A,PB,no,N,39,,215547,50388,APR
40,,DOUB,PB,O1B,no,N,40,,215547,50388,APR
41,,SING,PB,O2B,no,N,41,,215547,50388,APR
42,,SING,PB,O5D,no,N,42,,215547,50388,APR
43,,SING,O2B,HOB2,no,N,43,,215547,50388,APR
44,,SING,O5D,C5D,no,N,44,,215547,50388,APR
45,,SING,C5D,C4D,no,N,45,,215547,50388,APR
46,,SING,C5D,H5R1,no,N,46,,215547,50388,APR
47,,SING,C5D,H5R2,no,N,47,,215547,50388,APR
48,,SING,O4D,C1D,no,N,48,,215547,50388,APR
49,,SING,O4D,C4D,no,N,49,,215547,50388,APR
50,,SING,O1D,C1D,no,N,50,,215547,50388,APR
51,,SING,O1D,HOR1,no,N,51,,215547,50388,APR
52,,SING,C1D,C2D,no,N,52,,215547,50388,APR
53,,SING,C1D,HR'1,no,N,53,,215547,50388,APR
54,,SING,O2D,C2D,no,N,54,,215547,50388,APR
55,,SING,O2D,HOR2,no,N,55,,215547,50388,APR
56,,SING,C2D,C3D,no,N,56,,215547,50388,APR
57,,SING,C2D,HR'2,no,N,57,,215547,50388,APR
58,,SING,O3D,C3D,no,N,58,,215547,50388,APR
59,,SING,O3D,HOR3,no,N,59,,215547,50388,APR
60,,SING,C3D,C4D,no,N,60,,215547,50388,APR
61,,SING,C3D,HR'3,no,N,61,,215547,50388,APR
62,,SING,C4D,HR'4,no,N,62,,215547,50388,APR
1,,SING,C18,C13,no,N,1,,215847,50455,78P
2,,SING,C13,C17,no,N,2,,215847,50455,78P
3,,SING,C13,N14,no,N,3,,215847,50455,78P
4,,SING,C13,C8,no,N,4,,215847,50455,78P
5,,SING,C17,C16,no,N,5,,215847,50455,78P
6,,SING,N14,C15,no,N,6,,215847,50455,78P
7,,DOUB,N7,C8,yes,N,7,,215847,50455,78P
8,,SING,N7,C3,yes,N,8,,215847,50455,78P
9,,SING,C8,N9,yes,N,9,,215847,50455,78P
10,,SING,C15,C16,no,N,10,,215847,50455,78P
11,,SING,N9,C4,yes,N,11,,215847,50455,78P
12,,DOUB,C3,C2,yes,N,12,,215847,50455,78P
13,,SING,C3,C4,yes,N,13,,215847,50455,78P
14,,SING,C2,C1,yes,N,14,,215847,50455,78P
15,,DOUB,C4,C5,yes,N,15,,215847,50455,78P
16,,DOUB,C1,C6,yes,N,16,,215847,50455,78P
17,,SING,C5,C6,yes,N,17,,215847,50455,78P
18,,SING,C5,C10,no,N,18,,215847,50455,78P
19,,SING,N11,C10,no,N,19,,215847,50455,78P
20,,DOUB,C10,O12,no,N,20,,215847,50455,78P
21,,SING,C6,H6,no,N,21,,215847,50455,78P
22,,SING,C15,H151,no,N,22,,215847,50455,78P
23,,SING,C15,H152,no,N,23,,215847,50455,78P
24,,SING,C17,H171,no,N,24,,215847,50455,78P
25,,SING,C17,H172,no,N,25,,215847,50455,78P
26,,SING,C1,H1,no,N,26,,215847,50455,78P
27,,SING,C2,H2,no,N,27,,215847,50455,78P
28,,SING,N9,H9,no,N,28,,215847,50455,78P
29,,SING,N11,H111,no,N,29,,215847,50455,78P
30,,SING,N11,H112,no,N,30,,215847,50455,78P
31,,SING,N14,H141,no,N,31,,215847,50455,78P
32,,SING,C16,H161,no,N,32,,215847,50455,78P
33,,SING,C16,H162,no,N,33,,215847,50455,78P
34,,SING,C18,H181,no,N,34,,215847,50455,78P
35,,SING,C18,H182,no,N,35,,215847,50455,78P
36,,SING,C18,H183,no,N,36,,215847,50455,78P
1,,DOUB,CBF,CBD,yes,N,1,,215869,50456,09L
2,,SING,CBF,CBE,yes,N,2,,215869,50456,09L
3,,SING,CBD,CBA,yes,N,3,,215869,50456,09L
4,,DOUB,OAD,CBC,no,N,4,,215869,50456,09L
5,,DOUB,CBE,CBB,yes,N,5,,215869,50456,09L
6,,SING,CBA,CBC,no,N,6,,215869,50456,09L
7,,DOUB,CBA,CAZ,yes,N,7,,215869,50456,09L
8,,SING,CBC,NAH,no,N,8,,215869,50456,09L
9,,SING,CBB,CAZ,yes,N,9,,215869,50456,09L
10,,SING,CAZ,CAY,no,N,10,,215869,50456,09L
11,,SING,NAH,NAG,no,N,11,,215869,50456,09L
12,,DOUB,CAY,NAG,no,N,12,,215869,50456,09L
13,,SING,CAY,CAV,no,N,13,,215869,50456,09L
14,,SING,CAV,CAT,no,N,14,,215869,50456,09L
15,,DOUB,OAC,CAQ,no,N,15,,215869,50456,09L
16,,DOUB,CAS,CAT,yes,N,16,,215869,50456,09L
17,,SING,CAS,CAR,yes,N,17,,215869,50456,09L
18,,SING,CAT,CAW,yes,N,18,,215869,50456,09L
19,,SING,CAQ,CAR,no,N,19,,215869,50456,09L
20,,SING,CAQ,NAF,no,N,20,,215869,50456,09L
21,,SING,CAO,NAF,no,N,21,,215869,50456,09L
22,,SING,CAO,CAM,no,N,22,,215869,50456,09L
23,,DOUB,CAR,CAU,yes,N,23,,215869,50456,09L
24,,SING,NAF,CAP,no,N,24,,215869,50456,09L
25,,DOUB,CAW,CAX,yes,N,25,,215869,50456,09L
26,,SING,CAM,NAE,no,N,26,,215869,50456,09L
27,,SING,CAP,CAN,no,N,27,,215869,50456,09L
28,,SING,CAU,CAX,yes,N,28,,215869,50456,09L
29,,SING,CAU,FAA,no,N,29,,215869,50456,09L
30,,SING,NAE,CAN,no,N,30,,215869,50456,09L
31,,SING,NAE,CAL,no,N,31,,215869,50456,09L
32,,DOUB,OAB,CAL,no,N,32,,215869,50456,09L
33,,SING,CAL,CAI,no,N,33,,215869,50456,09L
34,,SING,CAI,CAJ,no,N,34,,215869,50456,09L
35,,SING,CAI,CAK,no,N,35,,215869,50456,09L
36,,SING,CAJ,CAK,no,N,36,,215869,50456,09L
37,,SING,CAJ,H1,no,N,37,,215869,50456,09L
38,,SING,CAJ,H2,no,N,38,,215869,50456,09L
39,,SING,CAK,H3,no,N,39,,215869,50456,09L
40,,SING,CAK,H4,no,N,40,,215869,50456,09L
41,,SING,CAI,H5,no,N,41,,215869,50456,09L
42,,SING,CAM,H6,no,N,42,,215869,50456,09L
43,,SING,CAM,H7,no,N,43,,215869,50456,09L
44,,SING,CAO,H8,no,N,44,,215869,50456,09L
45,,SING,CAO,H9,no,N,45,,215869,50456,09L
46,,SING,CAN,H10,no,N,46,,215869,50456,09L
47,,SING,CAN,H11,no,N,47,,215869,50456,09L
48,,SING,CAP,H12,no,N,48,,215869,50456,09L
49,,SING,CAP,H13,no,N,49,,215869,50456,09L
50,,SING,CAS,H14,no,N,50,,215869,50456,09L
51,,SING,CAX,H15,no,N,51,,215869,50456,09L
52,,SING,CAW,H16,no,N,52,,215869,50456,09L
53,,SING,CAV,H17,no,N,53,,215869,50456,09L
54,,SING,CAV,H18,no,N,54,,215869,50456,09L
55,,SING,CBB,H19,no,N,55,,215869,50456,09L
56,,SING,CBE,H20,no,N,56,,215869,50456,09L
57,,SING,CBF,H21,no,N,57,,215869,50456,09L
58,,SING,CBD,H22,no,N,58,,215869,50456,09L
59,,SING,NAH,H23,no,N,59,,215869,50456,09L
1,,DOUB,O,C4,no,N,1,,215891,50457,2YQ
2,,SING,C4,N2,no,N,2,,215891,50457,2YQ
3,,SING,C4,C1,no,N,3,,215891,50457,2YQ
4,,SING,N2,N1,no,N,4,,215891,50457,2YQ
5,,DOUB,C10,C1,yes,N,5,,215891,50457,2YQ
6,,SING,C10,C9,yes,N,6,,215891,50457,2YQ
7,,SING,C1,C2,yes,N,7,,215891,50457,2YQ
8,,SING,F1,C9,no,N,8,,215891,50457,2YQ
9,,DOUB,C9,C8,yes,N,9,,215891,50457,2YQ
10,,DOUB,N1,C3,no,N,10,,215891,50457,2YQ
11,,SING,C2,C3,no,N,11,,215891,50457,2YQ
12,,DOUB,C2,C7,yes,N,12,,215891,50457,2YQ
13,,SING,C3,C5,no,N,13,,215891,50457,2YQ
14,,SING,C8,C7,yes,N,14,,215891,50457,2YQ
15,,SING,C7,N3,no,N,15,,215891,50457,2YQ
16,,SING,C19,N4,no,N,16,,215891,50457,2YQ
17,,SING,C5,C17,no,N,17,,215891,50457,2YQ
18,,SING,C5,C6,no,N,18,,215891,50457,2YQ
19,,SING,N3,C6,no,N,19,,215891,50457,2YQ
20,,SING,N4,C17,yes,N,20,,215891,50457,2YQ
21,,SING,N4,N5,yes,N,21,,215891,50457,2YQ
22,,DOUB,C12,C13,yes,N,22,,215891,50457,2YQ
23,,SING,C12,C11,yes,N,23,,215891,50457,2YQ
24,,DOUB,C17,N6,yes,N,24,,215891,50457,2YQ
25,,SING,C6,C11,no,N,25,,215891,50457,2YQ
26,,SING,C13,C14,yes,N,26,,215891,50457,2YQ
27,,DOUB,N5,C18,yes,N,27,,215891,50457,2YQ
28,,DOUB,C11,C16,yes,N,28,,215891,50457,2YQ
29,,SING,N6,C18,yes,N,29,,215891,50457,2YQ
30,,SING,C14,F2,no,N,30,,215891,50457,2YQ
31,,DOUB,C14,C15,yes,N,31,,215891,50457,2YQ
32,,SING,C16,C15,yes,N,32,,215891,50457,2YQ
33,,SING,N3,H1,no,N,33,,215891,50457,2YQ
34,,SING,C5,H2,no,N,34,,215891,50457,2YQ
35,,SING,C6,H3,no,N,35,,215891,50457,2YQ
36,,SING,C8,H4,no,N,36,,215891,50457,2YQ
37,,SING,C10,H5,no,N,37,,215891,50457,2YQ
38,,SING,C13,H6,no,N,38,,215891,50457,2YQ
39,,SING,C15,H7,no,N,39,,215891,50457,2YQ
40,,SING,C12,H8,no,N,40,,215891,50457,2YQ
41,,SING,C16,H9,no,N,41,,215891,50457,2YQ
42,,SING,C18,H10,no,N,42,,215891,50457,2YQ
43,,SING,C19,H11,no,N,43,,215891,50457,2YQ
44,,SING,C19,H12,no,N,44,,215891,50457,2YQ
45,,SING,C19,H13,no,N,45,,215891,50457,2YQ
46,,SING,N2,H14,no,N,46,,215891,50457,2YQ
1,,DOUB,C01,C02,yes,N,1,,215913,50458,UHB
2,,SING,C01,C06,yes,N,2,,215913,50458,UHB
3,,SING,C02,C03,yes,N,3,,215913,50458,UHB
4,,DOUB,C03,C04,yes,N,4,,215913,50458,UHB
5,,SING,C04,C05,yes,N,5,,215913,50458,UHB
6,,SING,C04,N11,no,N,6,,215913,50458,UHB
7,,DOUB,C05,C06,yes,N,7,,215913,50458,UHB
8,,SING,C05,C08,no,N,8,,215913,50458,UHB
9,,SING,C06,C07,no,N,9,,215913,50458,UHB
10,,SING,C07,N09,no,N,10,,215913,50458,UHB
11,,DOUB,C07,O10,no,N,11,,215913,50458,UHB
12,,SING,C08,N09,no,N,12,,215913,50458,UHB
13,,SING,N11,C12,no,N,13,,215913,50458,UHB
14,,DOUB,C12,O13,no,N,14,,215913,50458,UHB
15,,SING,C12,C14,no,N,15,,215913,50458,UHB
16,,SING,C14,N15,no,N,16,,215913,50458,UHB
17,,SING,N15,C16,no,N,17,,215913,50458,UHB
18,,SING,N15,C20,no,N,18,,215913,50458,UHB
19,,SING,C16,C17,no,N,19,,215913,50458,UHB
20,,SING,C17,N18,no,N,20,,215913,50458,UHB
21,,SING,N18,C19,no,N,21,,215913,50458,UHB
22,,SING,N18,C21,no,N,22,,215913,50458,UHB
23,,SING,C19,C20,no,N,23,,215913,50458,UHB
24,,SING,C21,C22,no,N,24,,215913,50458,UHB
25,,DOUB,C21,O27,no,N,25,,215913,50458,UHB
26,,SING,C22,C23,no,N,26,,215913,50458,UHB
27,,SING,C22,O26,no,N,27,,215913,50458,UHB
28,,SING,C23,C24,no,N,28,,215913,50458,UHB
29,,SING,C23,O28,no,N,29,,215913,50458,UHB
30,,SING,C24,C25,no,N,30,,215913,50458,UHB
31,,SING,C24,O29,no,N,31,,215913,50458,UHB
32,,SING,C25,O26,no,N,32,,215913,50458,UHB
33,,SING,C25,N30,no,N,33,,215913,50458,UHB
34,,SING,N30,C32,yes,N,34,,215913,50458,UHB
35,,SING,N30,C33,yes,N,35,,215913,50458,UHB
36,,DOUB,C31,C32,yes,N,36,,215913,50458,UHB
37,,SING,C31,N34,yes,N,37,,215913,50458,UHB
38,,SING,C31,C38,yes,N,38,,215913,50458,UHB
39,,SING,C32,N37,yes,N,39,,215913,50458,UHB
40,,DOUB,C33,N34,yes,N,40,,215913,50458,UHB
41,,SING,N35,C36,yes,N,41,,215913,50458,UHB
42,,DOUB,N35,C38,yes,N,42,,215913,50458,UHB
43,,DOUB,C36,N37,yes,N,43,,215913,50458,UHB
44,,SING,C38,N39,no,N,44,,215913,50458,UHB
45,,SING,C01,H01,no,N,45,,215913,50458,UHB
46,,SING,C02,H02,no,N,46,,215913,50458,UHB
47,,SING,C03,H03,no,N,47,,215913,50458,UHB
48,,SING,C08,H081,no,N,48,,215913,50458,UHB
49,,SING,C08,H082,no,N,49,,215913,50458,UHB
50,,SING,N09,HN09,no,N,50,,215913,50458,UHB
51,,SING,C14,H14,no,N,51,,215913,50458,UHB
52,,SING,C14,H14A,no,N,52,,215913,50458,UHB
53,,SING,C16,H16,no,N,53,,215913,50458,UHB
54,,SING,C16,H16A,no,N,54,,215913,50458,UHB
55,,SING,C17,H17,no,N,55,,215913,50458,UHB
56,,SING,C17,H17A,no,N,56,,215913,50458,UHB
57,,SING,C19,H19,no,N,57,,215913,50458,UHB
58,,SING,C19,H19A,no,N,58,,215913,50458,UHB
59,,SING,C20,H20,no,N,59,,215913,50458,UHB
60,,SING,C20,H20A,no,N,60,,215913,50458,UHB
61,,SING,C22,H22,no,N,61,,215913,50458,UHB
62,,SING,C23,H23,no,N,62,,215913,50458,UHB
63,,SING,C24,H24,no,N,63,,215913,50458,UHB
64,,SING,C25,H25,no,N,64,,215913,50458,UHB
65,,SING,O28,HO28,no,N,65,,215913,50458,UHB
66,,SING,O29,HO29,no,N,66,,215913,50458,UHB
67,,SING,C33,H33,no,N,67,,215913,50458,UHB
68,,SING,C36,H36,no,N,68,,215913,50458,UHB
69,,SING,N39,HN39,no,N,69,,215913,50458,UHB
70,,SING,N39,HN3A,no,N,70,,215913,50458,UHB
71,,SING,N11,HN11,no,N,71,,215913,50458,UHB
1,,SING,N,HN1,no,N,1,,216017,50463,NH2
2,,SING,N,HN2,no,N,2,,216017,50463,NH2
1,,SING,N,CA,no,N,1,,216107,505,AYA
2,,SING,N,CT,no,N,2,,216107,505,AYA
3,,SING,N,H,no,N,3,,216107,505,AYA
4,,SING,CA,CB,no,N,4,,216107,505,AYA
5,,SING,CA,C,no,N,5,,216107,505,AYA
6,,SING,CA,HA,no,N,6,,216107,505,AYA
7,,SING,CB,HB1,no,N,7,,216107,505,AYA
8,,SING,CB,HB2,no,N,8,,216107,505,AYA
9,,SING,CB,HB3,no,N,9,,216107,505,AYA
10,,DOUB,C,O,no,N,10,,216107,505,AYA
11,,SING,C,OXT,no,N,11,,216107,505,AYA
12,,SING,OXT,HXT,no,N,12,,216107,505,AYA
13,,DOUB,CT,OT,no,N,13,,216107,505,AYA
14,,SING,CT,CM,no,N,14,,216107,505,AYA
15,,SING,CM,HM1,no,N,15,,216107,505,AYA
16,,SING,CM,HM2,no,N,16,,216107,505,AYA
17,,SING,CM,HM3,no,N,17,,216107,505,AYA
1,,SING,PG,O3B,,,,,216223,5054,ATP
2,,DOUB,PG,O1G,,,,,216223,5054,ATP
3,,SING,PG,O2G,,,,,216223,5054,ATP
4,,SING,PG,O3G,,,,,216223,5054,ATP
5,,SING,O2G,HO2G,,,,,216223,5054,ATP
6,,SING,O3G,HO3G,,,,,216223,5054,ATP
7,,DOUB,PB,O1B,,,,,216223,5054,ATP
8,,SING,PB,O2B,,,,,216223,5054,ATP
9,,SING,PB,O3B,,,,,216223,5054,ATP
10,,SING,PB,O3A,,,,,216223,5054,ATP
11,,SING,O2B,HO2B,,,,,216223,5054,ATP
12,,DOUB,PA,O1A,,,,,216223,5054,ATP
13,,SING,PA,O2A,,,,,216223,5054,ATP
14,,SING,PA,O3A,,,,,216223,5054,ATP
15,,SING,PA,O5',,,,,216223,5054,ATP
16,,SING,O2A,HO2A,,,,,216223,5054,ATP
17,,SING,O5',C5',,,,,216223,5054,ATP
18,,SING,C5',C4',,,,,216223,5054,ATP
19,,SING,C5',H51',,,,,216223,5054,ATP
20,,SING,C5',H52',,,,,216223,5054,ATP
21,,SING,C4',O4',,,,,216223,5054,ATP
22,,SING,C4',C3',,,,,216223,5054,ATP
23,,SING,C4',H4',,,,,216223,5054,ATP
24,,SING,O4',C1',,,,,216223,5054,ATP
28,,SING,O3',HO3',,,,,216223,5054,ATP
29,,SING,C2',O2',,,,,216223,5054,ATP
30,,SING,C2',C1',,,,,216223,5054,ATP
31,,SING,C2',H2',,,,,216223,5054,ATP
32,,SING,O2',HO2',,,,,216223,5054,ATP
33,,SING,C1',N9,,,,,216223,5054,ATP
34,,SING,C1',H1',,,,,216223,5054,ATP
35,,SING,N9,C8,,,,,216223,5054,ATP
36,,SING,N9,C4,,,,,216223,5054,ATP
37,,DOUB,C8,N7,,,,,216223,5054,ATP
38,,SING,C8,H8,,,,,216223,5054,ATP
39,,SING,N7,C5,,,,,216223,5054,ATP
40,,SING,C5,C6,,,,,216223,5054,ATP
41,,DOUB,C5,C4,,,,,216223,5054,ATP
42,,SING,C6,N6,,,,,216223,5054,ATP
43,,DOUB,C6,N1,,,,,216223,5054,ATP
44,,SING,N6,H61,,,,,216223,5054,ATP
45,,SING,N6,H62,,,,,216223,5054,ATP
46,,SING,N1,C2,,,,,216223,5054,ATP
47,,DOUB,C2,N3,,,,,216223,5054,ATP
48,,SING,C2,H2,,,,,216223,5054,ATP
49,,SING,N3,C4,,,,,216223,5054,ATP
1,,SING,N,CA,no,N,1,,216303,5057,SME
2,,SING,N,H,no,N,2,,216303,5057,SME
3,,SING,N,H2,no,N,3,,216303,5057,SME
4,,SING,CA,CB,no,N,4,,216303,5057,SME
5,,SING,CA,C,no,N,5,,216303,5057,SME
6,,SING,CA,HA,no,N,6,,216303,5057,SME
7,,SING,CB,CG,no,N,7,,216303,5057,SME
8,,SING,CB,HB2,no,N,8,,216303,5057,SME
9,,SING,CB,HB3,no,N,9,,216303,5057,SME
10,,SING,CG,S,no,N,10,,216303,5057,SME
11,,SING,CG,HG2,no,N,11,,216303,5057,SME
12,,SING,CG,HG3,no,N,12,,216303,5057,SME
13,,DOUB,S,OE,no,N,13,,216303,5057,SME
14,,SING,S,CE,no,N,14,,216303,5057,SME
15,,SING,CE,HE1,no,N,15,,216303,5057,SME
16,,SING,CE,HE2,no,N,16,,216303,5057,SME
17,,SING,CE,HE3,no,N,17,,216303,5057,SME
18,,DOUB,C,O,no,N,18,,216303,5057,SME
19,,SING,C,OXT,no,N,19,,216303,5057,SME
20,,SING,OXT,HXT,no,N,20,,216303,5057,SME
1,,SING,N,CA,no,N,1,,216366,506,AYA
2,,SING,N,CT,no,N,2,,216366,506,AYA
3,,SING,N,H,no,N,3,,216366,506,AYA
4,,SING,CA,CB,no,N,4,,216366,506,AYA
5,,SING,CA,C,no,N,5,,216366,506,AYA
6,,SING,CA,HA,no,N,6,,216366,506,AYA
7,,SING,CB,HB1,no,N,7,,216366,506,AYA
8,,SING,CB,HB2,no,N,8,,216366,506,AYA
9,,SING,CB,HB3,no,N,9,,216366,506,AYA
10,,DOUB,C,O,no,N,10,,216366,506,AYA
11,,SING,C,OXT,no,N,11,,216366,506,AYA
12,,SING,OXT,HXT,no,N,12,,216366,506,AYA
13,,DOUB,CT,OT,no,N,13,,216366,506,AYA
14,,SING,CT,CM,no,N,14,,216366,506,AYA
15,,SING,CM,HM1,no,N,15,,216366,506,AYA
16,,SING,CM,HM2,no,N,16,,216366,506,AYA
17,,SING,CM,HM3,no,N,17,,216366,506,AYA
1,,SING,CHA,C1A,yes,N,1,,216827,5079,HEM
2,,DOUB,CHA,C4D,yes,N,2,,216827,5079,HEM
3,,SING,CHA,HHA,no,N,3,,216827,5079,HEM
4,,SING,CHB,C4A,yes,N,4,,216827,5079,HEM
5,,DOUB,CHB,C1B,yes,N,5,,216827,5079,HEM
6,,SING,CHB,HHB,no,N,6,,216827,5079,HEM
7,,SING,CHC,C4B,yes,N,7,,216827,5079,HEM
8,,DOUB,CHC,C1C,yes,N,8,,216827,5079,HEM
9,,SING,CHC,HHC,no,N,9,,216827,5079,HEM
10,,DOUB,CHD,C4C,yes,N,10,,216827,5079,HEM
11,,SING,CHD,C1D,yes,N,11,,216827,5079,HEM
12,,SING,CHD,HHD,no,N,12,,216827,5079,HEM
13,,DOUB,C1A,C2A,yes,N,13,,216827,5079,HEM
14,,SING,C1A,NA,yes,N,14,,216827,5079,HEM
15,,SING,C2A,C3A,yes,N,15,,216827,5079,HEM
16,,SING,C2A,CAA,no,N,16,,216827,5079,HEM
17,,DOUB,C3A,C4A,yes,N,17,,216827,5079,HEM
18,,SING,C3A,CMA,no,N,18,,216827,5079,HEM
19,,SING,C4A,NA,yes,N,19,,216827,5079,HEM
20,,SING,CMA,HMA,no,N,20,,216827,5079,HEM
21,,SING,CMA,HMAA,no,N,21,,216827,5079,HEM
22,,SING,CMA,HMAB,no,N,22,,216827,5079,HEM
23,,SING,CAA,CBA,no,N,23,,216827,5079,HEM
24,,SING,CAA,HAA,no,N,24,,216827,5079,HEM
25,,SING,CAA,HAAA,no,N,25,,216827,5079,HEM
26,,SING,CBA,CGA,no,N,26,,216827,5079,HEM
27,,SING,CBA,HBA,no,N,27,,216827,5079,HEM
28,,SING,CBA,HBAA,no,N,28,,216827,5079,HEM
29,,DOUB,CGA,O1A,no,N,29,,216827,5079,HEM
30,,SING,CGA,O2A,no,N,30,,216827,5079,HEM
31,,SING,C1B,C2B,no,N,31,,216827,5079,HEM
32,,SING,C1B,NB,yes,N,32,,216827,5079,HEM
33,,DOUB,C2B,C3B,yes,N,33,,216827,5079,HEM
34,,SING,C2B,CMB,yes,N,34,,216827,5079,HEM
35,,SING,C3B,C4B,no,N,35,,216827,5079,HEM
36,,SING,C3B,CAB,yes,N,36,,216827,5079,HEM
37,,DOUB,C4B,NB,no,N,37,,216827,5079,HEM
38,,SING,CMB,HMB,yes,N,38,,216827,5079,HEM
39,,SING,CMB,HMBA,no,N,39,,216827,5079,HEM
40,,SING,CMB,HMBB,no,N,40,,216827,5079,HEM
41,,DOUB,CAB,CBB,no,N,41,,216827,5079,HEM
42,,SING,CAB,HAB,no,N,42,,216827,5079,HEM
43,,SING,CBB,HBB,no,N,43,,216827,5079,HEM
44,,SING,CBB,HBBA,no,N,44,,216827,5079,HEM
45,,SING,C1C,C2C,no,N,45,,216827,5079,HEM
46,,SING,C1C,NC,yes,N,46,,216827,5079,HEM
47,,DOUB,C2C,C3C,yes,N,47,,216827,5079,HEM
48,,SING,C2C,CMC,yes,N,48,,216827,5079,HEM
49,,SING,C3C,C4C,no,N,49,,216827,5079,HEM
50,,SING,C3C,CAC,yes,N,50,,216827,5079,HEM
51,,SING,C4C,NC,no,N,51,,216827,5079,HEM
52,,SING,CMC,HMC,yes,N,52,,216827,5079,HEM
53,,SING,CMC,HMCA,no,N,53,,216827,5079,HEM
54,,SING,CMC,HMCB,no,N,54,,216827,5079,HEM
55,,DOUB,CAC,CBC,no,N,55,,216827,5079,HEM
56,,SING,CAC,HAC,no,N,56,,216827,5079,HEM
57,,SING,CBC,HBC,no,N,57,,216827,5079,HEM
58,,SING,CBC,HBCA,no,N,58,,216827,5079,HEM
59,,SING,C1D,C2D,no,N,59,,216827,5079,HEM
60,,DOUB,C1D,ND,yes,N,60,,216827,5079,HEM
61,,DOUB,C2D,C3D,yes,N,61,,216827,5079,HEM
62,,SING,C2D,CMD,yes,N,62,,216827,5079,HEM
63,,SING,C3D,C4D,no,N,63,,216827,5079,HEM
64,,SING,C3D,CAD,yes,N,64,,216827,5079,HEM
65,,SING,C4D,ND,no,N,65,,216827,5079,HEM
66,,SING,CMD,HMD,yes,N,66,,216827,5079,HEM
67,,SING,CMD,HMDA,no,N,67,,216827,5079,HEM
68,,SING,CMD,HMDB,no,N,68,,216827,5079,HEM
69,,SING,CAD,CBD,no,N,69,,216827,5079,HEM
70,,SING,CAD,HAD,no,N,70,,216827,5079,HEM
71,,SING,CAD,HADA,no,N,71,,216827,5079,HEM
72,,SING,CBD,CGD,no,N,72,,216827,5079,HEM
73,,SING,CBD,HBD,no,N,73,,216827,5079,HEM
74,,SING,CBD,HBDA,no,N,74,,216827,5079,HEM
75,,DOUB,CGD,O1D,no,N,75,,216827,5079,HEM
76,,SING,CGD,O2D,no,N,76,,216827,5079,HEM
77,,SING,O2A,H2A,no,N,77,,216827,5079,HEM
78,,SING,O2D,H2D,no,N,78,,216827,5079,HEM
79,,SING,FE,NA,no,N,79,,216827,5079,HEM
80,,SING,FE,NB,no,N,80,,216827,5079,HEM
81,,SING,FE,NC,no,N,81,,216827,5079,HEM
82,,SING,FE,ND,no,N,82,,216827,5079,HEM
1,,SING,CHA,C1A,yes,N,1,,216870,5080,HEM
2,,DOUB,CHA,C4D,yes,N,2,,216870,5080,HEM
3,,SING,CHA,HHA,no,N,3,,216870,5080,HEM
4,,SING,CHB,C4A,yes,N,4,,216870,5080,HEM
5,,DOUB,CHB,C1B,yes,N,5,,216870,5080,HEM
6,,SING,CHB,HHB,no,N,6,,216870,5080,HEM
7,,SING,CHC,C4B,yes,N,7,,216870,5080,HEM
8,,DOUB,CHC,C1C,yes,N,8,,216870,5080,HEM
9,,SING,CHC,HHC,no,N,9,,216870,5080,HEM
10,,DOUB,CHD,C4C,yes,N,10,,216870,5080,HEM
11,,SING,CHD,C1D,yes,N,11,,216870,5080,HEM
12,,SING,CHD,HHD,no,N,12,,216870,5080,HEM
13,,DOUB,C1A,C2A,yes,N,13,,216870,5080,HEM
14,,SING,C1A,NA,yes,N,14,,216870,5080,HEM
15,,SING,C2A,C3A,yes,N,15,,216870,5080,HEM
16,,SING,C2A,CAA,no,N,16,,216870,5080,HEM
17,,DOUB,C3A,C4A,yes,N,17,,216870,5080,HEM
18,,SING,C3A,CMA,no,N,18,,216870,5080,HEM
19,,SING,C4A,NA,yes,N,19,,216870,5080,HEM
20,,SING,CMA,HMA,no,N,20,,216870,5080,HEM
21,,SING,CMA,HMAA,no,N,21,,216870,5080,HEM
22,,SING,CMA,HMAB,no,N,22,,216870,5080,HEM
23,,SING,CAA,CBA,no,N,23,,216870,5080,HEM
24,,SING,CAA,HAA,no,N,24,,216870,5080,HEM
25,,SING,CAA,HAAA,no,N,25,,216870,5080,HEM
26,,SING,CBA,CGA,no,N,26,,216870,5080,HEM
27,,SING,CBA,HBA,no,N,27,,216870,5080,HEM
28,,SING,CBA,HBAA,no,N,28,,216870,5080,HEM
29,,DOUB,CGA,O1A,no,N,29,,216870,5080,HEM
30,,SING,CGA,O2A,no,N,30,,216870,5080,HEM
31,,SING,C1B,C2B,no,N,31,,216870,5080,HEM
32,,SING,C1B,NB,yes,N,32,,216870,5080,HEM
33,,DOUB,C2B,C3B,yes,N,33,,216870,5080,HEM
34,,SING,C2B,CMB,yes,N,34,,216870,5080,HEM
35,,SING,C3B,C4B,no,N,35,,216870,5080,HEM
36,,SING,C3B,CAB,yes,N,36,,216870,5080,HEM
37,,DOUB,C4B,NB,no,N,37,,216870,5080,HEM
38,,SING,CMB,HMB,yes,N,38,,216870,5080,HEM
39,,SING,CMB,HMBA,no,N,39,,216870,5080,HEM
40,,SING,CMB,HMBB,no,N,40,,216870,5080,HEM
41,,DOUB,CAB,CBB,no,N,41,,216870,5080,HEM
42,,SING,CAB,HAB,no,N,42,,216870,5080,HEM
43,,SING,CBB,HBB,no,N,43,,216870,5080,HEM
44,,SING,CBB,HBBA,no,N,44,,216870,5080,HEM
45,,SING,C1C,C2C,no,N,45,,216870,5080,HEM
46,,SING,C1C,NC,yes,N,46,,216870,5080,HEM
47,,DOUB,C2C,C3C,yes,N,47,,216870,5080,HEM
48,,SING,C2C,CMC,yes,N,48,,216870,5080,HEM
49,,SING,C3C,C4C,no,N,49,,216870,5080,HEM
50,,SING,C3C,CAC,yes,N,50,,216870,5080,HEM
51,,SING,C4C,NC,no,N,51,,216870,5080,HEM
52,,SING,CMC,HMC,yes,N,52,,216870,5080,HEM
53,,SING,CMC,HMCA,no,N,53,,216870,5080,HEM
54,,SING,CMC,HMCB,no,N,54,,216870,5080,HEM
55,,DOUB,CAC,CBC,no,N,55,,216870,5080,HEM
56,,SING,CAC,HAC,no,N,56,,216870,5080,HEM
57,,SING,CBC,HBC,no,N,57,,216870,5080,HEM
58,,SING,CBC,HBCA,no,N,58,,216870,5080,HEM
59,,SING,C1D,C2D,no,N,59,,216870,5080,HEM
60,,DOUB,C1D,ND,yes,N,60,,216870,5080,HEM
61,,DOUB,C2D,C3D,yes,N,61,,216870,5080,HEM
62,,SING,C2D,CMD,yes,N,62,,216870,5080,HEM
63,,SING,C3D,C4D,no,N,63,,216870,5080,HEM
64,,SING,C3D,CAD,yes,N,64,,216870,5080,HEM
65,,SING,C4D,ND,no,N,65,,216870,5080,HEM
66,,SING,CMD,HMD,yes,N,66,,216870,5080,HEM
67,,SING,CMD,HMDA,no,N,67,,216870,5080,HEM
68,,SING,CMD,HMDB,no,N,68,,216870,5080,HEM
69,,SING,CAD,CBD,no,N,69,,216870,5080,HEM
70,,SING,CAD,HAD,no,N,70,,216870,5080,HEM
71,,SING,CAD,HADA,no,N,71,,216870,5080,HEM
72,,SING,CBD,CGD,no,N,72,,216870,5080,HEM
73,,SING,CBD,HBD,no,N,73,,216870,5080,HEM
74,,SING,CBD,HBDA,no,N,74,,216870,5080,HEM
75,,DOUB,CGD,O1D,no,N,75,,216870,5080,HEM
76,,SING,CGD,O2D,no,N,76,,216870,5080,HEM
77,,SING,O2A,H2A,no,N,77,,216870,5080,HEM
78,,SING,O2D,H2D,no,N,78,,216870,5080,HEM
79,,SING,FE,NA,no,N,79,,216870,5080,HEM
80,,SING,FE,NB,no,N,80,,216870,5080,HEM
81,,SING,FE,NC,no,N,81,,216870,5080,HEM
82,,SING,FE,ND,no,N,82,,216870,5080,HEM
1,,SING,GA,NA,no,N,1,,216899,5081,GIX
2,,SING,GA,NB,no,N,2,,216899,5081,GIX
3,,SING,GA,NC,no,N,3,,216899,5081,GIX
4,,SING,GA,ND,no,N,4,,216899,5081,GIX
5,,SING,NA,C1A,no,N,5,,216899,5081,GIX
6,,SING,NA,C4A,no,N,6,,216899,5081,GIX
7,,DOUB,NB,C1B,no,N,7,,216899,5081,GIX
8,,SING,NB,C4B,no,N,8,,216899,5081,GIX
9,,SING,NC,C1C,yes,N,9,,216899,5081,GIX
10,,SING,NC,C4C,yes,N,10,,216899,5081,GIX
11,,SING,ND,C1D,no,N,11,,216899,5081,GIX
12,,DOUB,ND,C4D,no,N,12,,216899,5081,GIX
13,,SING,C1A,C2A,no,N,13,,216899,5081,GIX
14,,DOUB,C1A,CHA,no,N,14,,216899,5081,GIX
15,,SING,O1A,CGA,no,N,15,,216899,5081,GIX
16,,SING,C1B,C2B,no,N,16,,216899,5081,GIX
17,,SING,C1B,CHB,no,N,17,,216899,5081,GIX
18,,DOUB,C1C,C2C,yes,N,18,,216899,5081,GIX
19,,SING,C1C,CHC,no,N,19,,216899,5081,GIX
20,,SING,C1D,C2D,no,N,20,,216899,5081,GIX
21,,DOUB,C1D,CHD,no,N,21,,216899,5081,GIX
22,,SING,O1D,CGD,no,N,22,,216899,5081,GIX
23,,DOUB,C2A,C3A,no,N,23,,216899,5081,GIX
24,,SING,C2A,CAA,no,N,24,,216899,5081,GIX
25,,DOUB,O2A,CGA,no,N,25,,216899,5081,GIX
26,,DOUB,C2B,C3B,no,N,26,,216899,5081,GIX
27,,SING,C2B,CMB,no,N,27,,216899,5081,GIX
28,,SING,C2C,C3C,yes,N,28,,216899,5081,GIX
29,,SING,C2C,CMC,no,N,29,,216899,5081,GIX
30,,DOUB,C2D,C3D,no,N,30,,216899,5081,GIX
31,,SING,C2D,CMD,no,N,31,,216899,5081,GIX
32,,DOUB,O2D,CGD,no,N,32,,216899,5081,GIX
33,,SING,C3A,C4A,no,N,33,,216899,5081,GIX
34,,SING,C3A,CMA,no,N,34,,216899,5081,GIX
35,,SING,C3B,C4B,no,N,35,,216899,5081,GIX
36,,SING,C3B,CAB,no,N,36,,216899,5081,GIX
37,,DOUB,C3C,C4C,yes,N,37,,216899,5081,GIX
38,,SING,C3C,CAC,no,N,38,,216899,5081,GIX
39,,SING,C3D,C4D,no,N,39,,216899,5081,GIX
40,,SING,C3D,CAD,no,N,40,,216899,5081,GIX
41,,DOUB,C4A,CHB,no,N,41,,216899,5081,GIX
42,,DOUB,C4B,CHC,no,N,42,,216899,5081,GIX
43,,SING,C4C,CHD,no,N,43,,216899,5081,GIX
44,,SING,C4D,CHA,no,N,44,,216899,5081,GIX
45,,SING,CAA,CBA,no,N,45,,216899,5081,GIX
46,,DOUB,CAB,CBB,no,N,46,,216899,5081,GIX
47,,DOUB,CAC,CBC,no,N,47,,216899,5081,GIX
48,,SING,CAD,CBD,no,N,48,,216899,5081,GIX
49,,SING,CBA,CGA,no,N,49,,216899,5081,GIX
50,,SING,CBD,CGD,no,N,50,,216899,5081,GIX
51,,SING,O1A,HO1A,no,N,51,,216899,5081,GIX
52,,SING,O1D,HO1D,no,N,52,,216899,5081,GIX
53,,SING,CAA,HAA,no,N,53,,216899,5081,GIX
54,,SING,CAA,HAAA,no,N,54,,216899,5081,GIX
55,,SING,CAB,HAB,no,N,55,,216899,5081,GIX
56,,SING,CAC,HAC,no,N,56,,216899,5081,GIX
57,,SING,CAD,HAD,no,N,57,,216899,5081,GIX
58,,SING,CAD,HADA,no,N,58,,216899,5081,GIX
59,,SING,CBA,HBA,no,N,59,,216899,5081,GIX
60,,SING,CBA,HBAA,no,N,60,,216899,5081,GIX
61,,SING,CBB,HBB,no,N,61,,216899,5081,GIX
62,,SING,CBB,HBBA,no,N,62,,216899,5081,GIX
63,,SING,CBC,HBC,no,N,63,,216899,5081,GIX
64,,SING,CBC,HBCA,no,N,64,,216899,5081,GIX
65,,SING,CBD,HBD,no,N,65,,216899,5081,GIX
66,,SING,CBD,HBDA,no,N,66,,216899,5081,GIX
67,,SING,CHA,HHA,no,N,67,,216899,5081,GIX
68,,SING,CHB,HHB,no,N,68,,216899,5081,GIX
69,,SING,CHC,HHC,no,N,69,,216899,5081,GIX
70,,SING,CHD,HHD,no,N,70,,216899,5081,GIX
71,,SING,CMA,HMA,no,N,71,,216899,5081,GIX
72,,SING,CMA,HMAA,no,N,72,,216899,5081,GIX
73,,SING,CMA,HMAB,no,N,73,,216899,5081,GIX
74,,SING,CMB,HMB,no,N,74,,216899,5081,GIX
75,,SING,CMB,HMBA,no,N,75,,216899,5081,GIX
76,,SING,CMB,HMBB,no,N,76,,216899,5081,GIX
77,,SING,CMC,HMC,no,N,77,,216899,5081,GIX
78,,SING,CMC,HMCA,no,N,78,,216899,5081,GIX
79,,SING,CMC,HMCB,no,N,79,,216899,5081,GIX
80,,SING,CMD,HMD,no,N,80,,216899,5081,GIX
81,,SING,CMD,HMDA,no,N,81,,216899,5081,GIX
82,,SING,CMD,HMDB,no,N,82,,216899,5081,GIX
1,,DOUB,C1,O1,no,N,1,,216931,5083,STE
2,,SING,C1,O2,no,N,2,,216931,5083,STE
3,,SING,C1,C2,no,N,3,,216931,5083,STE
4,,SING,O2,HO2,no,N,4,,216931,5083,STE
5,,SING,C2,C3,no,N,5,,216931,5083,STE
6,,SING,C2,H21,no,N,6,,216931,5083,STE
7,,SING,C2,H22,no,N,7,,216931,5083,STE
8,,SING,C3,C4,no,N,8,,216931,5083,STE
9,,SING,C3,H31,no,N,9,,216931,5083,STE
10,,SING,C3,H32,no,N,10,,216931,5083,STE
11,,SING,C4,C5,no,N,11,,216931,5083,STE
12,,SING,C4,H41,no,N,12,,216931,5083,STE
13,,SING,C4,H42,no,N,13,,216931,5083,STE
14,,SING,C5,C6,no,N,14,,216931,5083,STE
15,,SING,C5,H51,no,N,15,,216931,5083,STE
16,,SING,C5,H52,no,N,16,,216931,5083,STE
17,,SING,C6,C7,no,N,17,,216931,5083,STE
18,,SING,C6,H61,no,N,18,,216931,5083,STE
19,,SING,C6,H62,no,N,19,,216931,5083,STE
20,,SING,C7,C8,no,N,20,,216931,5083,STE
21,,SING,C7,H71,no,N,21,,216931,5083,STE
22,,SING,C7,H72,no,N,22,,216931,5083,STE
23,,SING,C8,C9,no,N,23,,216931,5083,STE
24,,SING,C8,H81,no,N,24,,216931,5083,STE
25,,SING,C8,H82,no,N,25,,216931,5083,STE
26,,SING,C9,C10,no,N,26,,216931,5083,STE
27,,SING,C9,H91,no,N,27,,216931,5083,STE
28,,SING,C9,H92,no,N,28,,216931,5083,STE
29,,SING,C10,C11,no,N,29,,216931,5083,STE
30,,SING,C10,H101,no,N,30,,216931,5083,STE
31,,SING,C10,H102,no,N,31,,216931,5083,STE
32,,SING,C11,C12,no,N,32,,216931,5083,STE
33,,SING,C11,H111,no,N,33,,216931,5083,STE
34,,SING,C11,H112,no,N,34,,216931,5083,STE
35,,SING,C12,C13,no,N,35,,216931,5083,STE
36,,SING,C12,H121,no,N,36,,216931,5083,STE
37,,SING,C12,H122,no,N,37,,216931,5083,STE
38,,SING,C13,C14,no,N,38,,216931,5083,STE
39,,SING,C13,H131,no,N,39,,216931,5083,STE
40,,SING,C13,H132,no,N,40,,216931,5083,STE
41,,SING,C14,C15,no,N,41,,216931,5083,STE
42,,SING,C14,H141,no,N,42,,216931,5083,STE
43,,SING,C14,H142,no,N,43,,216931,5083,STE
44,,SING,C15,C16,no,N,44,,216931,5083,STE
45,,SING,C15,H151,no,N,45,,216931,5083,STE
46,,SING,C15,H152,no,N,46,,216931,5083,STE
47,,SING,C16,C17,no,N,47,,216931,5083,STE
48,,SING,C16,H161,no,N,48,,216931,5083,STE
49,,SING,C16,H162,no,N,49,,216931,5083,STE
50,,SING,C17,C18,no,N,50,,216931,5083,STE
51,,SING,C17,H171,no,N,51,,216931,5083,STE
52,,SING,C17,H172,no,N,52,,216931,5083,STE
53,,SING,C18,H181,no,N,53,,216931,5083,STE
54,,SING,C18,H182,no,N,54,,216931,5083,STE
55,,SING,C18,H183,no,N,55,,216931,5083,STE
1,,SING,FE,NA,no,N,1,,217007,5086,HEC
2,,SING,FE,NB,no,N,2,,217007,5086,HEC
3,,SING,FE,NC,no,N,3,,217007,5086,HEC
4,,SING,FE,ND,no,N,4,,217007,5086,HEC
5,,DOUB,CHA,C1A,no,N,5,,217007,5086,HEC
6,,SING,CHA,C4D,no,N,6,,217007,5086,HEC
7,,SING,CHA,HHA,no,N,7,,217007,5086,HEC
8,,DOUB,CHB,C4A,no,N,8,,217007,5086,HEC
9,,SING,CHB,C1B,no,N,9,,217007,5086,HEC
10,,SING,CHB,HHB,no,N,10,,217007,5086,HEC
11,,DOUB,CHC,C4B,no,N,11,,217007,5086,HEC
12,,SING,CHC,C1C,no,N,12,,217007,5086,HEC
13,,SING,CHC,HHC,no,N,13,,217007,5086,HEC
14,,DOUB,CHD,C4C,no,N,14,,217007,5086,HEC
15,,SING,CHD,C1D,no,N,15,,217007,5086,HEC
16,,SING,CHD,HHD,no,N,16,,217007,5086,HEC
17,,SING,NA,C1A,yes,N,17,,217007,5086,HEC
18,,SING,NA,C4A,yes,N,18,,217007,5086,HEC
19,,SING,C1A,C2A,yes,N,19,,217007,5086,HEC
20,,DOUB,C2A,C3A,yes,N,20,,217007,5086,HEC
21,,SING,C2A,CAA,no,N,21,,217007,5086,HEC
22,,SING,C3A,C4A,yes,N,22,,217007,5086,HEC
23,,SING,C3A,CMA,no,N,23,,217007,5086,HEC
24,,SING,CMA,HMA1,no,N,24,,217007,5086,HEC
25,,SING,CMA,HMA2,no,N,25,,217007,5086,HEC
26,,SING,CMA,HMA3,no,N,26,,217007,5086,HEC
27,,SING,CAA,CBA,no,N,27,,217007,5086,HEC
28,,SING,CAA,HAA1,no,N,28,,217007,5086,HEC
29,,SING,CAA,HAA2,no,N,29,,217007,5086,HEC
30,,SING,CBA,CGA,no,N,30,,217007,5086,HEC
31,,SING,CBA,HBA1,no,N,31,,217007,5086,HEC
32,,SING,CBA,HBA2,no,N,32,,217007,5086,HEC
33,,DOUB,CGA,O1A,no,N,33,,217007,5086,HEC
34,,SING,CGA,O2A,no,N,34,,217007,5086,HEC
35,,SING,O2A,H2A,no,N,35,,217007,5086,HEC
36,,SING,NB,C1B,yes,N,36,,217007,5086,HEC
37,,SING,NB,C4B,yes,N,37,,217007,5086,HEC
38,,DOUB,C1B,C2B,yes,N,38,,217007,5086,HEC
39,,SING,C2B,C3B,yes,N,39,,217007,5086,HEC
40,,SING,C2B,CMB,no,N,40,,217007,5086,HEC
41,,SING,C3B,C4B,yes,N,41,,217007,5086,HEC
42,,DOUB,C3B,CAB,no,E,42,,217007,5086,HEC
43,,SING,CMB,HMB1,no,N,43,,217007,5086,HEC
44,,SING,CMB,HMB2,no,N,44,,217007,5086,HEC
45,,SING,CMB,HMB3,no,N,45,,217007,5086,HEC
46,,SING,CAB,CBB,no,N,46,,217007,5086,HEC
47,,SING,CAB,HAB,no,N,47,,217007,5086,HEC
48,,SING,CBB,HBB1,no,N,48,,217007,5086,HEC
49,,SING,CBB,HBB2,no,N,49,,217007,5086,HEC
50,,SING,CBB,HBB3,no,N,50,,217007,5086,HEC
51,,SING,NC,C1C,yes,N,51,,217007,5086,HEC
52,,SING,NC,C4C,yes,N,52,,217007,5086,HEC
53,,DOUB,C1C,C2C,yes,N,53,,217007,5086,HEC
54,,SING,C2C,C3C,yes,N,54,,217007,5086,HEC
55,,SING,C2C,CMC,no,N,55,,217007,5086,HEC
56,,SING,C3C,C4C,yes,N,56,,217007,5086,HEC
57,,DOUB,C3C,CAC,no,E,57,,217007,5086,HEC
58,,SING,CMC,HMC1,no,N,58,,217007,5086,HEC
59,,SING,CMC,HMC2,no,N,59,,217007,5086,HEC
60,,SING,CMC,HMC3,no,N,60,,217007,5086,HEC
61,,SING,CAC,CBC,no,N,61,,217007,5086,HEC
62,,SING,CAC,HAC,no,N,62,,217007,5086,HEC
63,,SING,CBC,HBC1,no,N,63,,217007,5086,HEC
64,,SING,CBC,HBC2,no,N,64,,217007,5086,HEC
65,,SING,CBC,HBC3,no,N,65,,217007,5086,HEC
66,,SING,ND,C1D,yes,N,66,,217007,5086,HEC
67,,SING,ND,C4D,yes,N,67,,217007,5086,HEC
68,,DOUB,C1D,C2D,yes,N,68,,217007,5086,HEC
69,,SING,C2D,C3D,yes,N,69,,217007,5086,HEC
70,,SING,C2D,CMD,no,N,70,,217007,5086,HEC
71,,DOUB,C3D,C4D,yes,N,71,,217007,5086,HEC
72,,SING,C3D,CAD,no,N,72,,217007,5086,HEC
73,,SING,CMD,HMD1,no,N,73,,217007,5086,HEC
74,,SING,CMD,HMD2,no,N,74,,217007,5086,HEC
75,,SING,CMD,HMD3,no,N,75,,217007,5086,HEC
76,,SING,CAD,CBD,no,N,76,,217007,5086,HEC
77,,SING,CAD,HAD1,no,N,77,,217007,5086,HEC
78,,SING,CAD,HAD2,no,N,78,,217007,5086,HEC
79,,SING,CBD,CGD,no,N,79,,217007,5086,HEC
80,,SING,CBD,HBD1,no,N,80,,217007,5086,HEC
81,,SING,CBD,HBD2,no,N,81,,217007,5086,HEC
82,,DOUB,CGD,O1D,no,N,82,,217007,5086,HEC
83,,SING,CGD,O2D,no,N,83,,217007,5086,HEC
84,,SING,O2D,H2D,no,N,84,,217007,5086,HEC
1,,SING,FE,NA,no,N,1,,217026,5087,HEC
2,,SING,FE,NB,no,N,2,,217026,5087,HEC
3,,SING,FE,NC,no,N,3,,217026,5087,HEC
4,,SING,FE,ND,no,N,4,,217026,5087,HEC
5,,DOUB,CHA,C1A,no,N,5,,217026,5087,HEC
6,,SING,CHA,C4D,no,N,6,,217026,5087,HEC
7,,SING,CHA,HHA,no,N,7,,217026,5087,HEC
8,,DOUB,CHB,C4A,no,N,8,,217026,5087,HEC
9,,SING,CHB,C1B,no,N,9,,217026,5087,HEC
10,,SING,CHB,HHB,no,N,10,,217026,5087,HEC
11,,DOUB,CHC,C4B,no,N,11,,217026,5087,HEC
12,,SING,CHC,C1C,no,N,12,,217026,5087,HEC
13,,SING,CHC,HHC,no,N,13,,217026,5087,HEC
14,,DOUB,CHD,C4C,no,N,14,,217026,5087,HEC
15,,SING,CHD,C1D,no,N,15,,217026,5087,HEC
16,,SING,CHD,HHD,no,N,16,,217026,5087,HEC
17,,SING,NA,C1A,yes,N,17,,217026,5087,HEC
18,,SING,NA,C4A,yes,N,18,,217026,5087,HEC
19,,SING,C1A,C2A,yes,N,19,,217026,5087,HEC
20,,DOUB,C2A,C3A,yes,N,20,,217026,5087,HEC
21,,SING,C2A,CAA,no,N,21,,217026,5087,HEC
22,,SING,C3A,C4A,yes,N,22,,217026,5087,HEC
23,,SING,C3A,CMA,no,N,23,,217026,5087,HEC
24,,SING,CMA,HMA1,no,N,24,,217026,5087,HEC
25,,SING,CMA,HMA2,no,N,25,,217026,5087,HEC
26,,SING,CMA,HMA3,no,N,26,,217026,5087,HEC
27,,SING,CAA,CBA,no,N,27,,217026,5087,HEC
28,,SING,CAA,HAA1,no,N,28,,217026,5087,HEC
29,,SING,CAA,HAA2,no,N,29,,217026,5087,HEC
30,,SING,CBA,CGA,no,N,30,,217026,5087,HEC
31,,SING,CBA,HBA1,no,N,31,,217026,5087,HEC
32,,SING,CBA,HBA2,no,N,32,,217026,5087,HEC
33,,DOUB,CGA,O1A,no,N,33,,217026,5087,HEC
34,,SING,CGA,O2A,no,N,34,,217026,5087,HEC
35,,SING,O2A,H2A,no,N,35,,217026,5087,HEC
36,,SING,NB,C1B,yes,N,36,,217026,5087,HEC
37,,SING,NB,C4B,yes,N,37,,217026,5087,HEC
38,,DOUB,C1B,C2B,yes,N,38,,217026,5087,HEC
39,,SING,C2B,C3B,yes,N,39,,217026,5087,HEC
40,,SING,C2B,CMB,no,N,40,,217026,5087,HEC
41,,SING,C3B,C4B,yes,N,41,,217026,5087,HEC
42,,DOUB,C3B,CAB,no,E,42,,217026,5087,HEC
43,,SING,CMB,HMB1,no,N,43,,217026,5087,HEC
44,,SING,CMB,HMB2,no,N,44,,217026,5087,HEC
45,,SING,CMB,HMB3,no,N,45,,217026,5087,HEC
46,,SING,CAB,CBB,no,N,46,,217026,5087,HEC
47,,SING,CAB,HAB,no,N,47,,217026,5087,HEC
48,,SING,CBB,HBB1,no,N,48,,217026,5087,HEC
49,,SING,CBB,HBB2,no,N,49,,217026,5087,HEC
50,,SING,CBB,HBB3,no,N,50,,217026,5087,HEC
51,,SING,NC,C1C,yes,N,51,,217026,5087,HEC
52,,SING,NC,C4C,yes,N,52,,217026,5087,HEC
53,,DOUB,C1C,C2C,yes,N,53,,217026,5087,HEC
54,,SING,C2C,C3C,yes,N,54,,217026,5087,HEC
55,,SING,C2C,CMC,no,N,55,,217026,5087,HEC
56,,SING,C3C,C4C,yes,N,56,,217026,5087,HEC
57,,DOUB,C3C,CAC,no,E,57,,217026,5087,HEC
58,,SING,CMC,HMC1,no,N,58,,217026,5087,HEC
59,,SING,CMC,HMC2,no,N,59,,217026,5087,HEC
60,,SING,CMC,HMC3,no,N,60,,217026,5087,HEC
61,,SING,CAC,CBC,no,N,61,,217026,5087,HEC
62,,SING,CAC,HAC,no,N,62,,217026,5087,HEC
63,,SING,CBC,HBC1,no,N,63,,217026,5087,HEC
64,,SING,CBC,HBC2,no,N,64,,217026,5087,HEC
65,,SING,CBC,HBC3,no,N,65,,217026,5087,HEC
66,,SING,ND,C1D,yes,N,66,,217026,5087,HEC
67,,SING,ND,C4D,yes,N,67,,217026,5087,HEC
68,,DOUB,C1D,C2D,yes,N,68,,217026,5087,HEC
69,,SING,C2D,C3D,yes,N,69,,217026,5087,HEC
70,,SING,C2D,CMD,no,N,70,,217026,5087,HEC
71,,DOUB,C3D,C4D,yes,N,71,,217026,5087,HEC
72,,SING,C3D,CAD,no,N,72,,217026,5087,HEC
73,,SING,CMD,HMD1,no,N,73,,217026,5087,HEC
74,,SING,CMD,HMD2,no,N,74,,217026,5087,HEC
75,,SING,CMD,HMD3,no,N,75,,217026,5087,HEC
76,,SING,CAD,CBD,no,N,76,,217026,5087,HEC
77,,SING,CAD,HAD1,no,N,77,,217026,5087,HEC
78,,SING,CAD,HAD2,no,N,78,,217026,5087,HEC
79,,SING,CBD,CGD,no,N,79,,217026,5087,HEC
80,,SING,CBD,HBD1,no,N,80,,217026,5087,HEC
81,,SING,CBD,HBD2,no,N,81,,217026,5087,HEC
82,,DOUB,CGD,O1D,no,N,82,,217026,5087,HEC
83,,SING,CGD,O2D,no,N,83,,217026,5087,HEC
84,,SING,O2D,H2D,no,N,84,,217026,5087,HEC
1,,SING,FE,NA,no,N,1,,217044,5088,HEC
2,,SING,FE,NB,no,N,2,,217044,5088,HEC
3,,SING,FE,NC,no,N,3,,217044,5088,HEC
4,,SING,FE,ND,no,N,4,,217044,5088,HEC
5,,DOUB,CHA,C1A,no,N,5,,217044,5088,HEC
6,,SING,CHA,C4D,no,N,6,,217044,5088,HEC
7,,SING,CHA,HHA,no,N,7,,217044,5088,HEC
8,,DOUB,CHB,C4A,no,N,8,,217044,5088,HEC
9,,SING,CHB,C1B,no,N,9,,217044,5088,HEC
10,,SING,CHB,HHB,no,N,10,,217044,5088,HEC
11,,DOUB,CHC,C4B,no,N,11,,217044,5088,HEC
12,,SING,CHC,C1C,no,N,12,,217044,5088,HEC
13,,SING,CHC,HHC,no,N,13,,217044,5088,HEC
14,,DOUB,CHD,C4C,no,N,14,,217044,5088,HEC
15,,SING,CHD,C1D,no,N,15,,217044,5088,HEC
16,,SING,CHD,HHD,no,N,16,,217044,5088,HEC
17,,SING,NA,C1A,yes,N,17,,217044,5088,HEC
18,,SING,NA,C4A,yes,N,18,,217044,5088,HEC
19,,SING,C1A,C2A,yes,N,19,,217044,5088,HEC
20,,DOUB,C2A,C3A,yes,N,20,,217044,5088,HEC
21,,SING,C2A,CAA,no,N,21,,217044,5088,HEC
22,,SING,C3A,C4A,yes,N,22,,217044,5088,HEC
23,,SING,C3A,CMA,no,N,23,,217044,5088,HEC
24,,SING,CMA,HMA1,no,N,24,,217044,5088,HEC
25,,SING,CMA,HMA2,no,N,25,,217044,5088,HEC
26,,SING,CMA,HMA3,no,N,26,,217044,5088,HEC
27,,SING,CAA,CBA,no,N,27,,217044,5088,HEC
28,,SING,CAA,HAA1,no,N,28,,217044,5088,HEC
29,,SING,CAA,HAA2,no,N,29,,217044,5088,HEC
30,,SING,CBA,CGA,no,N,30,,217044,5088,HEC
31,,SING,CBA,HBA1,no,N,31,,217044,5088,HEC
32,,SING,CBA,HBA2,no,N,32,,217044,5088,HEC
33,,DOUB,CGA,O1A,no,N,33,,217044,5088,HEC
34,,SING,CGA,O2A,no,N,34,,217044,5088,HEC
35,,SING,O2A,H2A,no,N,35,,217044,5088,HEC
36,,SING,NB,C1B,yes,N,36,,217044,5088,HEC
37,,SING,NB,C4B,yes,N,37,,217044,5088,HEC
38,,DOUB,C1B,C2B,yes,N,38,,217044,5088,HEC
39,,SING,C2B,C3B,yes,N,39,,217044,5088,HEC
40,,SING,C2B,CMB,no,N,40,,217044,5088,HEC
41,,SING,C3B,C4B,yes,N,41,,217044,5088,HEC
42,,DOUB,C3B,CAB,no,E,42,,217044,5088,HEC
43,,SING,CMB,HMB1,no,N,43,,217044,5088,HEC
44,,SING,CMB,HMB2,no,N,44,,217044,5088,HEC
45,,SING,CMB,HMB3,no,N,45,,217044,5088,HEC
46,,SING,CAB,CBB,no,N,46,,217044,5088,HEC
47,,SING,CAB,HAB,no,N,47,,217044,5088,HEC
48,,SING,CBB,HBB1,no,N,48,,217044,5088,HEC
49,,SING,CBB,HBB2,no,N,49,,217044,5088,HEC
50,,SING,CBB,HBB3,no,N,50,,217044,5088,HEC
51,,SING,NC,C1C,yes,N,51,,217044,5088,HEC
52,,SING,NC,C4C,yes,N,52,,217044,5088,HEC
53,,DOUB,C1C,C2C,yes,N,53,,217044,5088,HEC
54,,SING,C2C,C3C,yes,N,54,,217044,5088,HEC
55,,SING,C2C,CMC,no,N,55,,217044,5088,HEC
56,,SING,C3C,C4C,yes,N,56,,217044,5088,HEC
57,,DOUB,C3C,CAC,no,E,57,,217044,5088,HEC
58,,SING,CMC,HMC1,no,N,58,,217044,5088,HEC
59,,SING,CMC,HMC2,no,N,59,,217044,5088,HEC
60,,SING,CMC,HMC3,no,N,60,,217044,5088,HEC
61,,SING,CAC,CBC,no,N,61,,217044,5088,HEC
62,,SING,CAC,HAC,no,N,62,,217044,5088,HEC
63,,SING,CBC,HBC1,no,N,63,,217044,5088,HEC
64,,SING,CBC,HBC2,no,N,64,,217044,5088,HEC
65,,SING,CBC,HBC3,no,N,65,,217044,5088,HEC
66,,SING,ND,C1D,yes,N,66,,217044,5088,HEC
67,,SING,ND,C4D,yes,N,67,,217044,5088,HEC
68,,DOUB,C1D,C2D,yes,N,68,,217044,5088,HEC
69,,SING,C2D,C3D,yes,N,69,,217044,5088,HEC
70,,SING,C2D,CMD,no,N,70,,217044,5088,HEC
71,,DOUB,C3D,C4D,yes,N,71,,217044,5088,HEC
72,,SING,C3D,CAD,no,N,72,,217044,5088,HEC
73,,SING,CMD,HMD1,no,N,73,,217044,5088,HEC
74,,SING,CMD,HMD2,no,N,74,,217044,5088,HEC
75,,SING,CMD,HMD3,no,N,75,,217044,5088,HEC
76,,SING,CAD,CBD,no,N,76,,217044,5088,HEC
77,,SING,CAD,HAD1,no,N,77,,217044,5088,HEC
78,,SING,CAD,HAD2,no,N,78,,217044,5088,HEC
79,,SING,CBD,CGD,no,N,79,,217044,5088,HEC
80,,SING,CBD,HBD1,no,N,80,,217044,5088,HEC
81,,SING,CBD,HBD2,no,N,81,,217044,5088,HEC
82,,DOUB,CGD,O1D,no,N,82,,217044,5088,HEC
83,,SING,CGD,O2D,no,N,83,,217044,5088,HEC
84,,SING,O2D,H2D,no,N,84,,217044,5088,HEC
1,,SING,FE,NA,no,N,1,,217063,5089,HEC
2,,SING,FE,NB,no,N,2,,217063,5089,HEC
3,,SING,FE,NC,no,N,3,,217063,5089,HEC
4,,SING,FE,ND,no,N,4,,217063,5089,HEC
5,,DOUB,CHA,C1A,no,N,5,,217063,5089,HEC
6,,SING,CHA,C4D,no,N,6,,217063,5089,HEC
7,,SING,CHA,HHA,no,N,7,,217063,5089,HEC
8,,DOUB,CHB,C4A,no,N,8,,217063,5089,HEC
9,,SING,CHB,C1B,no,N,9,,217063,5089,HEC
10,,SING,CHB,HHB,no,N,10,,217063,5089,HEC
11,,DOUB,CHC,C4B,no,N,11,,217063,5089,HEC
12,,SING,CHC,C1C,no,N,12,,217063,5089,HEC
13,,SING,CHC,HHC,no,N,13,,217063,5089,HEC
14,,DOUB,CHD,C4C,no,N,14,,217063,5089,HEC
15,,SING,CHD,C1D,no,N,15,,217063,5089,HEC
16,,SING,CHD,HHD,no,N,16,,217063,5089,HEC
17,,SING,NA,C1A,yes,N,17,,217063,5089,HEC
18,,SING,NA,C4A,yes,N,18,,217063,5089,HEC
19,,SING,C1A,C2A,yes,N,19,,217063,5089,HEC
20,,DOUB,C2A,C3A,yes,N,20,,217063,5089,HEC
21,,SING,C2A,CAA,no,N,21,,217063,5089,HEC
22,,SING,C3A,C4A,yes,N,22,,217063,5089,HEC
23,,SING,C3A,CMA,no,N,23,,217063,5089,HEC
24,,SING,CMA,HMA1,no,N,24,,217063,5089,HEC
25,,SING,CMA,HMA2,no,N,25,,217063,5089,HEC
26,,SING,CMA,HMA3,no,N,26,,217063,5089,HEC
27,,SING,CAA,CBA,no,N,27,,217063,5089,HEC
28,,SING,CAA,HAA1,no,N,28,,217063,5089,HEC
29,,SING,CAA,HAA2,no,N,29,,217063,5089,HEC
30,,SING,CBA,CGA,no,N,30,,217063,5089,HEC
31,,SING,CBA,HBA1,no,N,31,,217063,5089,HEC
32,,SING,CBA,HBA2,no,N,32,,217063,5089,HEC
33,,DOUB,CGA,O1A,no,N,33,,217063,5089,HEC
34,,SING,CGA,O2A,no,N,34,,217063,5089,HEC
35,,SING,O2A,H2A,no,N,35,,217063,5089,HEC
36,,SING,NB,C1B,yes,N,36,,217063,5089,HEC
37,,SING,NB,C4B,yes,N,37,,217063,5089,HEC
38,,DOUB,C1B,C2B,yes,N,38,,217063,5089,HEC
39,,SING,C2B,C3B,yes,N,39,,217063,5089,HEC
40,,SING,C2B,CMB,no,N,40,,217063,5089,HEC
41,,SING,C3B,C4B,yes,N,41,,217063,5089,HEC
42,,DOUB,C3B,CAB,no,E,42,,217063,5089,HEC
43,,SING,CMB,HMB1,no,N,43,,217063,5089,HEC
44,,SING,CMB,HMB2,no,N,44,,217063,5089,HEC
45,,SING,CMB,HMB3,no,N,45,,217063,5089,HEC
46,,SING,CAB,CBB,no,N,46,,217063,5089,HEC
47,,SING,CAB,HAB,no,N,47,,217063,5089,HEC
48,,SING,CBB,HBB1,no,N,48,,217063,5089,HEC
49,,SING,CBB,HBB2,no,N,49,,217063,5089,HEC
50,,SING,CBB,HBB3,no,N,50,,217063,5089,HEC
51,,SING,NC,C1C,yes,N,51,,217063,5089,HEC
52,,SING,NC,C4C,yes,N,52,,217063,5089,HEC
53,,DOUB,C1C,C2C,yes,N,53,,217063,5089,HEC
54,,SING,C2C,C3C,yes,N,54,,217063,5089,HEC
55,,SING,C2C,CMC,no,N,55,,217063,5089,HEC
56,,SING,C3C,C4C,yes,N,56,,217063,5089,HEC
57,,DOUB,C3C,CAC,no,E,57,,217063,5089,HEC
58,,SING,CMC,HMC1,no,N,58,,217063,5089,HEC
59,,SING,CMC,HMC2,no,N,59,,217063,5089,HEC
60,,SING,CMC,HMC3,no,N,60,,217063,5089,HEC
61,,SING,CAC,CBC,no,N,61,,217063,5089,HEC
62,,SING,CAC,HAC,no,N,62,,217063,5089,HEC
63,,SING,CBC,HBC1,no,N,63,,217063,5089,HEC
64,,SING,CBC,HBC2,no,N,64,,217063,5089,HEC
65,,SING,CBC,HBC3,no,N,65,,217063,5089,HEC
66,,SING,ND,C1D,yes,N,66,,217063,5089,HEC
67,,SING,ND,C4D,yes,N,67,,217063,5089,HEC
68,,DOUB,C1D,C2D,yes,N,68,,217063,5089,HEC
69,,SING,C2D,C3D,yes,N,69,,217063,5089,HEC
70,,SING,C2D,CMD,no,N,70,,217063,5089,HEC
71,,DOUB,C3D,C4D,yes,N,71,,217063,5089,HEC
72,,SING,C3D,CAD,no,N,72,,217063,5089,HEC
73,,SING,CMD,HMD1,no,N,73,,217063,5089,HEC
74,,SING,CMD,HMD2,no,N,74,,217063,5089,HEC
75,,SING,CMD,HMD3,no,N,75,,217063,5089,HEC
76,,SING,CAD,CBD,no,N,76,,217063,5089,HEC
77,,SING,CAD,HAD1,no,N,77,,217063,5089,HEC
78,,SING,CAD,HAD2,no,N,78,,217063,5089,HEC
79,,SING,CBD,CGD,no,N,79,,217063,5089,HEC
80,,SING,CBD,HBD1,no,N,80,,217063,5089,HEC
81,,SING,CBD,HBD2,no,N,81,,217063,5089,HEC
82,,DOUB,CGD,O1D,no,N,82,,217063,5089,HEC
83,,SING,CGD,O2D,no,N,83,,217063,5089,HEC
84,,SING,O2D,H2D,no,N,84,,217063,5089,HEC
1,,SING,N,HN1,no,N,1,,217080,509,NH2
2,,SING,N,HN2,no,N,2,,217080,509,NH2
1,,SING,CHA,C1A,yes,N,1,,217108,5091,HEM
2,,DOUB,CHA,C4D,yes,N,2,,217108,5091,HEM
3,,SING,CHA,HHA,no,N,3,,217108,5091,HEM
4,,SING,CHB,C4A,yes,N,4,,217108,5091,HEM
5,,DOUB,CHB,C1B,yes,N,5,,217108,5091,HEM
6,,SING,CHB,HHB,no,N,6,,217108,5091,HEM
7,,SING,CHC,C4B,yes,N,7,,217108,5091,HEM
8,,DOUB,CHC,C1C,yes,N,8,,217108,5091,HEM
9,,SING,CHC,HHC,no,N,9,,217108,5091,HEM
10,,DOUB,CHD,C4C,yes,N,10,,217108,5091,HEM
11,,SING,CHD,C1D,yes,N,11,,217108,5091,HEM
12,,SING,CHD,HHD,no,N,12,,217108,5091,HEM
13,,DOUB,C1A,C2A,yes,N,13,,217108,5091,HEM
14,,SING,C1A,NA,yes,N,14,,217108,5091,HEM
15,,SING,C2A,C3A,yes,N,15,,217108,5091,HEM
16,,SING,C2A,CAA,no,N,16,,217108,5091,HEM
17,,DOUB,C3A,C4A,yes,N,17,,217108,5091,HEM
18,,SING,C3A,CMA,no,N,18,,217108,5091,HEM
19,,SING,C4A,NA,yes,N,19,,217108,5091,HEM
20,,SING,CMA,HMA,no,N,20,,217108,5091,HEM
21,,SING,CMA,HMAA,no,N,21,,217108,5091,HEM
22,,SING,CMA,HMAB,no,N,22,,217108,5091,HEM
23,,SING,CAA,CBA,no,N,23,,217108,5091,HEM
24,,SING,CAA,HAA,no,N,24,,217108,5091,HEM
25,,SING,CAA,HAAA,no,N,25,,217108,5091,HEM
26,,SING,CBA,CGA,no,N,26,,217108,5091,HEM
27,,SING,CBA,HBA,no,N,27,,217108,5091,HEM
28,,SING,CBA,HBAA,no,N,28,,217108,5091,HEM
29,,DOUB,CGA,O1A,no,N,29,,217108,5091,HEM
30,,SING,CGA,O2A,no,N,30,,217108,5091,HEM
31,,SING,C1B,C2B,no,N,31,,217108,5091,HEM
32,,SING,C1B,NB,yes,N,32,,217108,5091,HEM
33,,DOUB,C2B,C3B,yes,N,33,,217108,5091,HEM
34,,SING,C2B,CMB,yes,N,34,,217108,5091,HEM
35,,SING,C3B,C4B,no,N,35,,217108,5091,HEM
36,,SING,C3B,CAB,yes,N,36,,217108,5091,HEM
37,,DOUB,C4B,NB,no,N,37,,217108,5091,HEM
38,,SING,CMB,HMB,yes,N,38,,217108,5091,HEM
39,,SING,CMB,HMBA,no,N,39,,217108,5091,HEM
40,,SING,CMB,HMBB,no,N,40,,217108,5091,HEM
41,,DOUB,CAB,CBB,no,N,41,,217108,5091,HEM
42,,SING,CAB,HAB,no,N,42,,217108,5091,HEM
43,,SING,CBB,HBB,no,N,43,,217108,5091,HEM
44,,SING,CBB,HBBA,no,N,44,,217108,5091,HEM
45,,SING,C1C,C2C,no,N,45,,217108,5091,HEM
46,,SING,C1C,NC,yes,N,46,,217108,5091,HEM
47,,DOUB,C2C,C3C,yes,N,47,,217108,5091,HEM
48,,SING,C2C,CMC,yes,N,48,,217108,5091,HEM
49,,SING,C3C,C4C,no,N,49,,217108,5091,HEM
50,,SING,C3C,CAC,yes,N,50,,217108,5091,HEM
51,,SING,C4C,NC,no,N,51,,217108,5091,HEM
52,,SING,CMC,HMC,yes,N,52,,217108,5091,HEM
53,,SING,CMC,HMCA,no,N,53,,217108,5091,HEM
54,,SING,CMC,HMCB,no,N,54,,217108,5091,HEM
55,,DOUB,CAC,CBC,no,N,55,,217108,5091,HEM
56,,SING,CAC,HAC,no,N,56,,217108,5091,HEM
57,,SING,CBC,HBC,no,N,57,,217108,5091,HEM
58,,SING,CBC,HBCA,no,N,58,,217108,5091,HEM
59,,SING,C1D,C2D,no,N,59,,217108,5091,HEM
60,,DOUB,C1D,ND,yes,N,60,,217108,5091,HEM
61,,DOUB,C2D,C3D,yes,N,61,,217108,5091,HEM
62,,SING,C2D,CMD,yes,N,62,,217108,5091,HEM
63,,SING,C3D,C4D,no,N,63,,217108,5091,HEM
64,,SING,C3D,CAD,yes,N,64,,217108,5091,HEM
65,,SING,C4D,ND,no,N,65,,217108,5091,HEM
66,,SING,CMD,HMD,yes,N,66,,217108,5091,HEM
67,,SING,CMD,HMDA,no,N,67,,217108,5091,HEM
68,,SING,CMD,HMDB,no,N,68,,217108,5091,HEM
69,,SING,CAD,CBD,no,N,69,,217108,5091,HEM
70,,SING,CAD,HAD,no,N,70,,217108,5091,HEM
71,,SING,CAD,HADA,no,N,71,,217108,5091,HEM
72,,SING,CBD,CGD,no,N,72,,217108,5091,HEM
73,,SING,CBD,HBD,no,N,73,,217108,5091,HEM
74,,SING,CBD,HBDA,no,N,74,,217108,5091,HEM
75,,DOUB,CGD,O1D,no,N,75,,217108,5091,HEM
76,,SING,CGD,O2D,no,N,76,,217108,5091,HEM
77,,SING,O2A,H2A,no,N,77,,217108,5091,HEM
78,,SING,O2D,H2D,no,N,78,,217108,5091,HEM
79,,SING,FE,NA,no,N,79,,217108,5091,HEM
80,,SING,FE,NB,no,N,80,,217108,5091,HEM
81,,SING,FE,NC,no,N,81,,217108,5091,HEM
82,,SING,FE,ND,no,N,82,,217108,5091,HEM
1,,SING,N,HN1,no,N,1,,217297,510,NH2
2,,SING,N,HN2,no,N,2,,217297,510,NH2
1,,DOUB,C,O,no,N,1,,217487,5108,ACE
2,,SING,C,CH3,no,N,2,,217487,5108,ACE
3,,SING,C,H,no,N,3,,217487,5108,ACE
4,,SING,CH3,H1,no,N,4,,217487,5108,ACE
5,,SING,CH3,H2,no,N,5,,217487,5108,ACE
6,,SING,CH3,H3,no,N,6,,217487,5108,ACE
1,,SING,N,CA,no,N,1,,217488,5108,DNP
2,,SING,N,H,no,N,2,,217488,5108,DNP
3,,SING,N,H2,no,N,3,,217488,5108,DNP
4,,SING,CA,CB,no,N,4,,217488,5108,DNP
5,,SING,CA,C,no,N,5,,217488,5108,DNP
6,,SING,CA,HA,no,N,6,,217488,5108,DNP
7,,SING,CB,NG,no,N,7,,217488,5108,DNP
8,,SING,CB,HB2,no,N,8,,217488,5108,DNP
9,,SING,CB,HB3,no,N,9,,217488,5108,DNP
10,,SING,NG,HG1,no,N,10,,217488,5108,DNP
11,,SING,NG,HG2,no,N,11,,217488,5108,DNP
12,,SING,NG,HG3,no,N,12,,217488,5108,DNP
13,,DOUB,C,O,no,N,13,,217488,5108,DNP
14,,SING,C,OXT,no,N,14,,217488,5108,DNP
15,,SING,OXT,HXT,no,N,15,,217488,5108,DNP
1,,DOUB,C,O,no,N,1,,217506,5109,ACE
2,,SING,C,CH3,no,N,2,,217506,5109,ACE
3,,SING,C,H,no,N,3,,217506,5109,ACE
4,,SING,CH3,H1,no,N,4,,217506,5109,ACE
5,,SING,CH3,H2,no,N,5,,217506,5109,ACE
6,,SING,CH3,H3,no,N,6,,217506,5109,ACE
1,,SING,N,CA,no,N,1,,217507,5109,DAB
2,,SING,N,H,no,N,2,,217507,5109,DAB
3,,SING,N,H2,no,N,3,,217507,5109,DAB
4,,SING,CA,C,no,N,4,,217507,5109,DAB
5,,SING,CA,CB,no,N,5,,217507,5109,DAB
6,,SING,CA,HA,no,N,6,,217507,5109,DAB
7,,DOUB,C,O,no,N,7,,217507,5109,DAB
8,,SING,C,OXT,no,N,8,,217507,5109,DAB
9,,SING,CB,CG,no,N,9,,217507,5109,DAB
10,,SING,CB,HB2,no,N,10,,217507,5109,DAB
11,,SING,CB,HB3,no,N,11,,217507,5109,DAB
12,,SING,CG,ND,no,N,12,,217507,5109,DAB
13,,SING,CG,HG2,no,N,13,,217507,5109,DAB
14,,SING,CG,HG3,no,N,14,,217507,5109,DAB
15,,SING,ND,HD1,no,N,15,,217507,5109,DAB
16,,SING,ND,HD2,no,N,16,,217507,5109,DAB
17,,SING,OXT,HXT,no,N,17,,217507,5109,DAB
1,,SING,N,HN1,no,N,1,,217525,511,NH2
2,,SING,N,HN2,no,N,2,,217525,511,NH2
1,,DOUB,C,O,no,N,1,,217540,5110,ACE
2,,SING,C,CH3,no,N,2,,217540,5110,ACE
3,,SING,C,H,no,N,3,,217540,5110,ACE
4,,SING,CH3,H1,no,N,4,,217540,5110,ACE
5,,SING,CH3,H2,no,N,5,,217540,5110,ACE
6,,SING,CH3,H3,no,N,6,,217540,5110,ACE
1,,SING,N,CC,no,N,1,,217541,5110,BCX
2,,SING,N,H,no,N,2,,217541,5110,BCX
3,,SING,N,H2,no,N,3,,217541,5110,BCX
4,,SING,CC,CA,no,N,4,,217541,5110,BCX
5,,SING,CC,HC1,no,N,5,,217541,5110,BCX
6,,SING,CC,HC2,no,N,6,,217541,5110,BCX
7,,SING,CA,C,no,N,7,,217541,5110,BCX
8,,SING,CA,CB,no,N,8,,217541,5110,BCX
9,,SING,CA,HA,no,N,9,,217541,5110,BCX
10,,DOUB,C,O,no,N,10,,217541,5110,BCX
11,,SING,C,OXT,no,N,11,,217541,5110,BCX
12,,SING,CB,SG,no,N,12,,217541,5110,BCX
13,,SING,CB,HB2,no,N,13,,217541,5110,BCX
14,,SING,CB,HB3,no,N,14,,217541,5110,BCX
15,,SING,SG,HG,no,N,15,,217541,5110,BCX
16,,SING,OXT,HXT,no,N,16,,217541,5110,BCX
1,,DOUB,C,O,no,N,1,,217560,5111,ACE
2,,SING,C,CH3,no,N,2,,217560,5111,ACE
3,,SING,C,H,no,N,3,,217560,5111,ACE
4,,SING,CH3,H1,no,N,4,,217560,5111,ACE
5,,SING,CH3,H2,no,N,5,,217560,5111,ACE
6,,SING,CH3,H3,no,N,6,,217560,5111,ACE
1,,SING,N,CC,no,N,1,,217561,5111,BSE
2,,SING,N,H,no,N,2,,217561,5111,BSE
3,,SING,N,H2,no,N,3,,217561,5111,BSE
4,,SING,CC,CA,no,N,4,,217561,5111,BSE
5,,SING,CC,HC1,no,N,5,,217561,5111,BSE
6,,SING,CC,HC2,no,N,6,,217561,5111,BSE
7,,SING,CA,C,no,N,7,,217561,5111,BSE
8,,SING,CA,CB,no,N,8,,217561,5111,BSE
9,,SING,CA,HA,no,N,9,,217561,5111,BSE
10,,DOUB,C,O,no,N,10,,217561,5111,BSE
11,,SING,C,OXT,no,N,11,,217561,5111,BSE
12,,SING,CB,OG,no,N,12,,217561,5111,BSE
13,,SING,CB,HB2,no,N,13,,217561,5111,BSE
14,,SING,CB,HB3,no,N,14,,217561,5111,BSE
15,,SING,OG,HG,no,N,15,,217561,5111,BSE
16,,SING,OXT,HXT,no,N,16,,217561,5111,BSE
1,,SING,N,CA,no,N,1,,217580,5112,HYP
2,,SING,N,CD,no,N,2,,217580,5112,HYP
3,,SING,N,H,no,N,3,,217580,5112,HYP
4,,SING,CA,C,no,N,4,,217580,5112,HYP
5,,SING,CA,CB,no,N,5,,217580,5112,HYP
6,,SING,CA,HA,no,N,6,,217580,5112,HYP
7,,DOUB,C,O,no,N,7,,217580,5112,HYP
8,,SING,C,OXT,no,N,8,,217580,5112,HYP
9,,SING,CB,CG,no,N,9,,217580,5112,HYP
10,,SING,CB,HB2,no,N,10,,217580,5112,HYP
11,,SING,CB,HB3,no,N,11,,217580,5112,HYP
12,,SING,CG,CD,no,N,12,,217580,5112,HYP
13,,SING,CG,OD1,no,N,13,,217580,5112,HYP
14,,SING,CG,HG,no,N,14,,217580,5112,HYP
15,,SING,CD,HD22,no,N,15,,217580,5112,HYP
16,,SING,CD,HD23,no,N,16,,217580,5112,HYP
17,,SING,OD1,HD1,no,N,17,,217580,5112,HYP
18,,SING,OXT,HXT,no,N,18,,217580,5112,HYP
1,,SING,N,HN1,no,N,1,,217581,5112,NH2
2,,SING,N,HN2,no,N,2,,217581,5112,NH2
1,,SING,N,CA,no,N,1,,217605,5113,HYP
2,,SING,N,CD,no,N,2,,217605,5113,HYP
3,,SING,N,H,no,N,3,,217605,5113,HYP
4,,SING,CA,C,no,N,4,,217605,5113,HYP
5,,SING,CA,CB,no,N,5,,217605,5113,HYP
6,,SING,CA,HA,no,N,6,,217605,5113,HYP
7,,DOUB,C,O,no,N,7,,217605,5113,HYP
8,,SING,C,OXT,no,N,8,,217605,5113,HYP
9,,SING,CB,CG,no,N,9,,217605,5113,HYP
10,,SING,CB,HB2,no,N,10,,217605,5113,HYP
11,,SING,CB,HB3,no,N,11,,217605,5113,HYP
12,,SING,CG,CD,no,N,12,,217605,5113,HYP
13,,SING,CG,OD1,no,N,13,,217605,5113,HYP
14,,SING,CG,HG,no,N,14,,217605,5113,HYP
15,,SING,CD,HD22,no,N,15,,217605,5113,HYP
16,,SING,CD,HD23,no,N,16,,217605,5113,HYP
17,,SING,OD1,HD1,no,N,17,,217605,5113,HYP
18,,SING,OXT,HXT,no,N,18,,217605,5113,HYP
1,,SING,N,CA,no,N,1,,217606,5113,AAR
2,,SING,N,H,no,N,2,,217606,5113,AAR
3,,SING,N,H2,no,N,3,,217606,5113,AAR
4,,SING,CA,CB,no,N,4,,217606,5113,AAR
5,,SING,CA,C,no,N,5,,217606,5113,AAR
6,,SING,CA,HA,no,N,6,,217606,5113,AAR
7,,SING,CB,CG,no,N,7,,217606,5113,AAR
8,,SING,CB,HB2,no,N,8,,217606,5113,AAR
9,,SING,CB,HB3,no,N,9,,217606,5113,AAR
10,,SING,CG,CD,no,N,10,,217606,5113,AAR
11,,SING,CG,HG2,no,N,11,,217606,5113,AAR
12,,SING,CG,HG3,no,N,12,,217606,5113,AAR
13,,SING,CD,NE,no,N,13,,217606,5113,AAR
14,,SING,CD,HD2,no,N,14,,217606,5113,AAR
15,,SING,CD,HD3,no,N,15,,217606,5113,AAR
16,,SING,NE,CZ,no,N,16,,217606,5113,AAR
17,,SING,NE,HE,no,N,17,,217606,5113,AAR
18,,SING,CZ,NH1,no,N,18,,217606,5113,AAR
19,,DOUB,CZ,NH2,no,N,19,,217606,5113,AAR
20,,SING,NH1,HH11,no,N,20,,217606,5113,AAR
21,,SING,NH1,HH12,no,N,21,,217606,5113,AAR
22,,SING,NH2,HH21,no,N,22,,217606,5113,AAR
23,,SING,NH2,HH22,no,N,23,,217606,5113,AAR
24,,DOUB,C,O,no,N,24,,217606,5113,AAR
25,,SING,C,NT,no,N,25,,217606,5113,AAR
26,,SING,NT,HNT1,no,N,26,,217606,5113,AAR
27,,SING,NT,HNT2,no,N,27,,217606,5113,AAR
1,,SING,N,HN1,no,N,1,,217759,512,NH2
2,,SING,N,HN2,no,N,2,,217759,512,NH2
1,,SING,N,HN1,no,N,1,,217962,513,NH2
2,,SING,N,HN2,no,N,2,,217962,513,NH2
1,,DOUB,C,O,no,N,1,,218101,5136,ACE
2,,SING,C,CH3,no,N,2,,218101,5136,ACE
3,,SING,C,H,no,N,3,,218101,5136,ACE
4,,SING,CH3,H1,no,N,4,,218101,5136,ACE
5,,SING,CH3,H2,no,N,5,,218101,5136,ACE
6,,SING,CH3,H3,no,N,6,,218101,5136,ACE
1,,SING,N,CA,no,N,1,,218102,5136,DAB
2,,SING,N,H,no,N,2,,218102,5136,DAB
3,,SING,N,H2,no,N,3,,218102,5136,DAB
4,,SING,CA,C,no,N,4,,218102,5136,DAB
5,,SING,CA,CB,no,N,5,,218102,5136,DAB
6,,SING,CA,HA,no,N,6,,218102,5136,DAB
7,,DOUB,C,O,no,N,7,,218102,5136,DAB
8,,SING,C,OXT,no,N,8,,218102,5136,DAB
9,,SING,CB,CG,no,N,9,,218102,5136,DAB
10,,SING,CB,HB2,no,N,10,,218102,5136,DAB
11,,SING,CB,HB3,no,N,11,,218102,5136,DAB
12,,SING,CG,ND,no,N,12,,218102,5136,DAB
13,,SING,CG,HG2,no,N,13,,218102,5136,DAB
14,,SING,CG,HG3,no,N,14,,218102,5136,DAB
15,,SING,ND,HD1,no,N,15,,218102,5136,DAB
16,,SING,ND,HD2,no,N,16,,218102,5136,DAB
17,,SING,OXT,HXT,no,N,17,,218102,5136,DAB
1,,DOUB,C,O,no,N,1,,218120,5137,ACE
2,,SING,C,CH3,no,N,2,,218120,5137,ACE
3,,SING,C,H,no,N,3,,218120,5137,ACE
4,,SING,CH3,H1,no,N,4,,218120,5137,ACE
5,,SING,CH3,H2,no,N,5,,218120,5137,ACE
6,,SING,CH3,H3,no,N,6,,218120,5137,ACE
1,,SING,N1,C2,yes,N,1,,218121,5137,DAP
2,,SING,N1,C8,yes,N,2,,218121,5137,DAP
3,,SING,N1,HN1,no,N,3,,218121,5137,DAP
4,,DOUB,C2,C3,yes,N,4,,218121,5137,DAP
5,,SING,C2,C1',yes,N,5,,218121,5137,DAP
6,,SING,C3,C9,yes,N,6,,218121,5137,DAP
7,,SING,C3,H3,no,N,7,,218121,5137,DAP
8,,DOUB,C4,C5,yes,N,8,,218121,5137,DAP
9,,SING,C4,C9,yes,N,9,,218121,5137,DAP
10,,SING,C4,H4,no,N,10,,218121,5137,DAP
11,,SING,C5,C6,yes,N,11,,218121,5137,DAP
12,,SING,C5,H5,no,N,12,,218121,5137,DAP
13,,DOUB,C6,C7,yes,N,13,,218121,5137,DAP
14,,SING,C6,C10,no,N,14,,218121,5137,DAP
15,,SING,C7,C8,yes,N,15,,218121,5137,DAP
16,,SING,C7,H7,no,N,16,,218121,5137,DAP
17,,DOUB,C8,C9,yes,N,17,,218121,5137,DAP
18,,DOUB,C10,N2,no,N,18,,218121,5137,DAP
19,,SING,C10,N3,no,N,19,,218121,5137,DAP
20,,SING,N2,HN2,no,N,20,,218121,5137,DAP
21,,SING,N3,HN31,no,N,21,,218121,5137,DAP
22,,SING,N3,HN32,no,N,22,,218121,5137,DAP
23,,DOUB,C1',C2',yes,N,23,,218121,5137,DAP
24,,SING,C1',C6',yes,N,24,,218121,5137,DAP
25,,SING,C2',C3',yes,N,25,,218121,5137,DAP
26,,SING,C2',H2',no,N,26,,218121,5137,DAP
27,,DOUB,C3',C4',yes,N,27,,218121,5137,DAP
28,,SING,C3',H3',no,N,28,,218121,5137,DAP
29,,SING,C4',C5',yes,N,29,,218121,5137,DAP
30,,SING,C4',C11,no,N,30,,218121,5137,DAP
31,,DOUB,C5',C6',yes,N,31,,218121,5137,DAP
32,,SING,C5',H5',no,N,32,,218121,5137,DAP
33,,SING,C6',H6',no,N,33,,218121,5137,DAP
34,,DOUB,C11,N4,no,N,34,,218121,5137,DAP
35,,SING,C11,N5,no,N,35,,218121,5137,DAP
36,,SING,N4,HN4,no,N,36,,218121,5137,DAP
37,,SING,N5,HN51,no,N,37,,218121,5137,DAP
38,,SING,N5,HN52,no,N,38,,218121,5137,DAP
1,,DOUB,C,O,no,N,1,,218139,5138,ACE
2,,SING,C,CH3,no,N,2,,218139,5138,ACE
3,,SING,C,H,no,N,3,,218139,5138,ACE
4,,SING,CH3,H1,no,N,4,,218139,5138,ACE
5,,SING,CH3,H2,no,N,5,,218139,5138,ACE
6,,SING,CH3,H3,no,N,6,,218139,5138,ACE
1,,SING,N,CA,no,N,1,,218140,5138,DNP
2,,SING,N,H,no,N,2,,218140,5138,DNP
3,,SING,N,H2,no,N,3,,218140,5138,DNP
4,,SING,CA,CB,no,N,4,,218140,5138,DNP
5,,SING,CA,C,no,N,5,,218140,5138,DNP
6,,SING,CA,HA,no,N,6,,218140,5138,DNP
7,,SING,CB,NG,no,N,7,,218140,5138,DNP
8,,SING,CB,HB2,no,N,8,,218140,5138,DNP
9,,SING,CB,HB3,no,N,9,,218140,5138,DNP
10,,SING,NG,HG1,no,N,10,,218140,5138,DNP
11,,SING,NG,HG2,no,N,11,,218140,5138,DNP
12,,SING,NG,HG3,no,N,12,,218140,5138,DNP
13,,DOUB,C,O,no,N,13,,218140,5138,DNP
14,,SING,C,OXT,no,N,14,,218140,5138,DNP
15,,SING,OXT,HXT,no,N,15,,218140,5138,DNP
1,,DOUB,C,O,no,N,1,,218158,5139,ACE
2,,SING,C,CH3,no,N,2,,218158,5139,ACE
3,,SING,C,H,no,N,3,,218158,5139,ACE
4,,SING,CH3,H1,no,N,4,,218158,5139,ACE
5,,SING,CH3,H2,no,N,5,,218158,5139,ACE
6,,SING,CH3,H3,no,N,6,,218158,5139,ACE
1,,SING,N,CA,no,N,1,,218159,5139,DNP
2,,SING,N,H,no,N,2,,218159,5139,DNP
3,,SING,N,H2,no,N,3,,218159,5139,DNP
4,,SING,CA,CB,no,N,4,,218159,5139,DNP
5,,SING,CA,C,no,N,5,,218159,5139,DNP
6,,SING,CA,HA,no,N,6,,218159,5139,DNP
7,,SING,CB,NG,no,N,7,,218159,5139,DNP
8,,SING,CB,HB2,no,N,8,,218159,5139,DNP
9,,SING,CB,HB3,no,N,9,,218159,5139,DNP
10,,SING,NG,HG1,no,N,10,,218159,5139,DNP
11,,SING,NG,HG2,no,N,11,,218159,5139,DNP
12,,SING,NG,HG3,no,N,12,,218159,5139,DNP
13,,DOUB,C,O,no,N,13,,218159,5139,DNP
14,,SING,C,OXT,no,N,14,,218159,5139,DNP
15,,SING,OXT,HXT,no,N,15,,218159,5139,DNP
1,,SING,N,HN1,no,N,1,,218177,514,NH2
2,,SING,N,HN2,no,N,2,,218177,514,NH2
1,,DOUB,C,O,no,N,1,,218191,5140,ACE
2,,SING,C,CH3,no,N,2,,218191,5140,ACE
3,,SING,C,H,no,N,3,,218191,5140,ACE
4,,SING,CH3,H1,no,N,4,,218191,5140,ACE
5,,SING,CH3,H2,no,N,5,,218191,5140,ACE
6,,SING,CH3,H3,no,N,6,,218191,5140,ACE
1,,SING,N,CA,no,N,1,,218192,5140,DAB
2,,SING,N,H,no,N,2,,218192,5140,DAB
3,,SING,N,H2,no,N,3,,218192,5140,DAB
4,,SING,CA,C,no,N,4,,218192,5140,DAB
5,,SING,CA,CB,no,N,5,,218192,5140,DAB
6,,SING,CA,HA,no,N,6,,218192,5140,DAB
7,,DOUB,C,O,no,N,7,,218192,5140,DAB
8,,SING,C,OXT,no,N,8,,218192,5140,DAB
9,,SING,CB,CG,no,N,9,,218192,5140,DAB
10,,SING,CB,HB2,no,N,10,,218192,5140,DAB
11,,SING,CB,HB3,no,N,11,,218192,5140,DAB
12,,SING,CG,ND,no,N,12,,218192,5140,DAB
13,,SING,CG,HG2,no,N,13,,218192,5140,DAB
14,,SING,CG,HG3,no,N,14,,218192,5140,DAB
15,,SING,ND,HD1,no,N,15,,218192,5140,DAB
16,,SING,ND,HD2,no,N,16,,218192,5140,DAB
17,,SING,OXT,HXT,no,N,17,,218192,5140,DAB
1,,SING,FE1,S1,no,N,1,,218329,5148,FES
2,,SING,FE1,S2,no,N,2,,218329,5148,FES
3,,SING,FE2,S1,no,N,3,,218329,5148,FES
4,,SING,FE2,S2,no,N,4,,218329,5148,FES
1,,SING,N,HN1,no,N,1,,218383,515,NH2
2,,SING,N,HN2,no,N,2,,218383,515,NH2
1,,SING,N,CA,no,N,1,,218563,5157,AAR
2,,SING,N,H,no,N,2,,218563,5157,AAR
3,,SING,N,H2,no,N,3,,218563,5157,AAR
4,,SING,CA,CB,no,N,4,,218563,5157,AAR
5,,SING,CA,C,no,N,5,,218563,5157,AAR
6,,SING,CA,HA,no,N,6,,218563,5157,AAR
7,,SING,CB,CG,no,N,7,,218563,5157,AAR
8,,SING,CB,HB2,no,N,8,,218563,5157,AAR
9,,SING,CB,HB3,no,N,9,,218563,5157,AAR
10,,SING,CG,CD,no,N,10,,218563,5157,AAR
11,,SING,CG,HG2,no,N,11,,218563,5157,AAR
12,,SING,CG,HG3,no,N,12,,218563,5157,AAR
13,,SING,CD,NE,no,N,13,,218563,5157,AAR
14,,SING,CD,HD2,no,N,14,,218563,5157,AAR
15,,SING,CD,HD3,no,N,15,,218563,5157,AAR
16,,SING,NE,CZ,no,N,16,,218563,5157,AAR
17,,SING,NE,HE,no,N,17,,218563,5157,AAR
18,,SING,CZ,NH1,no,N,18,,218563,5157,AAR
19,,DOUB,CZ,NH2,no,N,19,,218563,5157,AAR
20,,SING,NH1,HH11,no,N,20,,218563,5157,AAR
21,,SING,NH1,HH12,no,N,21,,218563,5157,AAR
22,,SING,NH2,HH21,no,N,22,,218563,5157,AAR
23,,SING,NH2,HH22,no,N,23,,218563,5157,AAR
24,,DOUB,C,O,no,N,24,,218563,5157,AAR
25,,SING,C,NT,no,N,25,,218563,5157,AAR
26,,SING,NT,HNT1,no,N,26,,218563,5157,AAR
27,,SING,NT,HNT2,no,N,27,,218563,5157,AAR
1,,SING,FE,NA,,,,,218885,5172,HEM_ox
2,,SING,FE,NB,,,,,218885,5172,HEM_ox
3,,SING,FE,NC,,,,,218885,5172,HEM_ox
4,,SING,FE,ND,,,,,218885,5172,HEM_ox
5,,DOUB,CHA,C1A,,,,,218885,5172,HEM_ox
6,,SING,CHA,C4D,,,,,218885,5172,HEM_ox
7,,SING,CHA,HHA,,,,,218885,5172,HEM_ox
8,,DOUB,CHB,C4A,,,,,218885,5172,HEM_ox
9,,SING,CHB,C1B,,,,,218885,5172,HEM_ox
10,,SING,CHB,HHB,,,,,218885,5172,HEM_ox
11,,DOUB,CHC,C4B,,,,,218885,5172,HEM_ox
12,,SING,CHC,C1C,,,,,218885,5172,HEM_ox
13,,SING,CHC,HHC,,,,,218885,5172,HEM_ox
14,,SING,CHD,C4C,,,,,218885,5172,HEM_ox
15,,DOUB,CHD,C1D,,,,,218885,5172,HEM_ox
16,,SING,CHD,HHD,,,,,218885,5172,HEM_ox
17,,SING,NA,C1A,,,,,218885,5172,HEM_ox
18,,SING,NA,C4A,,,,,218885,5172,HEM_ox
19,,SING,C1A,C2A,,,,,218885,5172,HEM_ox
20,,DOUB,C2A,C3A,,,,,218885,5172,HEM_ox
21,,SING,C2A,CAA,,,,,218885,5172,HEM_ox
22,,SING,C3A,C4A,,,,,218885,5172,HEM_ox
23,,SING,C3A,CMA,,,,,218885,5172,HEM_ox
24,,SING,CMA,1HMA,,,,,218885,5172,HEM_ox
25,,SING,CMA,2HMA,,,,,218885,5172,HEM_ox
26,,SING,CMA,3HMA,,,,,218885,5172,HEM_ox
27,,SING,CAA,CBA,,,,,218885,5172,HEM_ox
28,,SING,CAA,1HAA,,,,,218885,5172,HEM_ox
29,,SING,CAA,2HAA,,,,,218885,5172,HEM_ox
30,,SING,CBA,CGA,,,,,218885,5172,HEM_ox
31,,SING,CBA,1HBA,,,,,218885,5172,HEM_ox
32,,SING,CBA,2HBA,,,,,218885,5172,HEM_ox
33,,DOUB,CGA,O1A,,,,,218885,5172,HEM_ox
34,,SING,CGA,O2A,,,,,218885,5172,HEM_ox
35,,SING,O2A,H2A,,,,,218885,5172,HEM_ox
36,,DOUB,NB,C1B,,,,,218885,5172,HEM_ox
37,,SING,NB,C4B,,,,,218885,5172,HEM_ox
38,,SING,C1B,C2B,,,,,218885,5172,HEM_ox
39,,DOUB,C2B,C3B,,,,,218885,5172,HEM_ox
40,,SING,C2B,CMB,,,,,218885,5172,HEM_ox
41,,SING,C3B,C4B,,,,,218885,5172,HEM_ox
42,,SING,C3B,CAB,,,,,218885,5172,HEM_ox
43,,SING,CMB,1HMB,,,,,218885,5172,HEM_ox
44,,SING,CMB,2HMB,,,,,218885,5172,HEM_ox
45,,SING,CMB,3HMB,,,,,218885,5172,HEM_ox
46,,DOUB,CAB,CBB,,,,,218885,5172,HEM_ox
47,,SING,CAB,HAB,,,,,218885,5172,HEM_ox
48,,SING,CBB,1HBB,,,,,218885,5172,HEM_ox
49,,SING,CBB,2HBB,,,,,218885,5172,HEM_ox
50,,SING,NC,C1C,,,,,218885,5172,HEM_ox
51,,SING,NC,C4C,,,,,218885,5172,HEM_ox
52,,DOUB,C1C,C2C,,,,,218885,5172,HEM_ox
53,,SING,C2C,C3C,,,,,218885,5172,HEM_ox
54,,SING,C2C,CMC,,,,,218885,5172,HEM_ox
55,,DOUB,C3C,C4C,,,,,218885,5172,HEM_ox
56,,SING,C3C,CAC,,,,,218885,5172,HEM_ox
57,,SING,CMC,1HMC,,,,,218885,5172,HEM_ox
58,,SING,CMC,2HMC,,,,,218885,5172,HEM_ox
59,,SING,CMC,3HMC,,,,,218885,5172,HEM_ox
60,,DOUB,CAC,CBC,,,,,218885,5172,HEM_ox
61,,SING,CAC,HAC,,,,,218885,5172,HEM_ox
62,,SING,CBC,1HBC,,,,,218885,5172,HEM_ox
63,,SING,CBC,2HBC,,,,,218885,5172,HEM_ox
64,,SING,ND,C1D,,,,,218885,5172,HEM_ox
65,,DOUB,ND,C4D,,,,,218885,5172,HEM_ox
66,,SING,C1D,C2D,,,,,218885,5172,HEM_ox
67,,DOUB,C2D,C3D,,,,,218885,5172,HEM_ox
68,,SING,C2D,CMD,,,,,218885,5172,HEM_ox
69,,SING,C3D,C4D,,,,,218885,5172,HEM_ox
70,,SING,C3D,CAD,,,,,218885,5172,HEM_ox
71,,SING,CMD,1HMD,,,,,218885,5172,HEM_ox
72,,SING,CMD,2HMD,,,,,218885,5172,HEM_ox
73,,SING,CMD,3HMD,,,,,218885,5172,HEM_ox
74,,SING,CAD,CBD,,,,,218885,5172,HEM_ox
75,,SING,CAD,1HAD,,,,,218885,5172,HEM_ox
76,,SING,CAD,2HAD,,,,,218885,5172,HEM_ox
77,,SING,CBD,CGD,,,,,218885,5172,HEM_ox
78,,SING,CBD,1HBD,,,,,218885,5172,HEM_ox
79,,SING,CBD,2HBD,,,,,218885,5172,HEM_ox
80,,DOUB,CGD,O1D,,,,,218885,5172,HEM_ox
81,,SING,CGD,O2D,,,,,218885,5172,HEM_ox
82,,SING,O2D,H2D,,,,,218885,5172,HEM_ox
1,,SING,N,HN1,no,N,1,,219017,5179,NH2
2,,SING,N,HN2,no,N,2,,219017,5179,NH2
1,,SING,N,CA,no,N,1,,219112,5183,CLG
2,,SING,N,H,no,N,2,,219112,5183,CLG
3,,SING,N,H2,no,N,3,,219112,5183,CLG
4,,SING,CA,CB,no,N,4,,219112,5183,CLG
5,,SING,CA,C,no,N,5,,219112,5183,CLG
6,,SING,CA,HA,no,N,6,,219112,5183,CLG
7,,SING,CB,CG,no,N,7,,219112,5183,CLG
8,,SING,CB,HB2,no,N,8,,219112,5183,CLG
9,,SING,CB,HB3,no,N,9,,219112,5183,CLG
10,,SING,CG,CD,no,N,10,,219112,5183,CLG
11,,SING,CG,HG2,no,N,11,,219112,5183,CLG
12,,SING,CG,HG3,no,N,12,,219112,5183,CLG
13,,SING,CD,CE,no,N,13,,219112,5183,CLG
14,,SING,CD,HD2,no,N,14,,219112,5183,CLG
15,,SING,CD,HD3,no,N,15,,219112,5183,CLG
16,,SING,CE,NZ,no,N,16,,219112,5183,CLG
17,,SING,CE,HE2,no,N,17,,219112,5183,CLG
18,,SING,CE,HE3,no,N,18,,219112,5183,CLG
19,,SING,NZ,CH,no,N,19,,219112,5183,CLG
20,,SING,NZ,HZ,no,N,20,,219112,5183,CLG
21,,DOUB,CH,OI,no,N,21,,219112,5183,CLG
22,,SING,CH,CI,no,N,22,,219112,5183,CLG
23,,SING,CI,NJ,no,N,23,,219112,5183,CLG
24,,SING,CI,HI1,no,N,24,,219112,5183,CLG
25,,SING,CI,HI2,no,N,25,,219112,5183,CLG
26,,SING,NJ,CK,no,N,26,,219112,5183,CLG
27,,SING,NJ,HNJ,no,N,27,,219112,5183,CLG
28,,DOUB,CK,OL,no,N,28,,219112,5183,CLG
29,,SING,CK,CL,no,N,29,,219112,5183,CLG
30,,DOUB,C,O,no,N,30,,219112,5183,CLG
31,,SING,C,OXT,no,N,31,,219112,5183,CLG
32,,SING,CL,OM,no,N,32,,219112,5183,CLG
33,,SING,CL,HL1,no,N,33,,219112,5183,CLG
34,,SING,CL,HL2,no,N,34,,219112,5183,CLG
35,,SING,OM,NM,no,N,35,,219112,5183,CLG
36,,SING,NM,HNM1,no,N,36,,219112,5183,CLG
37,,SING,NM,HNM2,no,N,37,,219112,5183,CLG
38,,SING,OXT,HXT,no,N,38,,219112,5183,CLG
1,,SING,N,CA,no,N,1,,219113,5183,CLH
2,,SING,N,H,no,N,2,,219113,5183,CLH
3,,SING,N,H2,no,N,3,,219113,5183,CLH
4,,SING,CA,CB,no,N,4,,219113,5183,CLH
5,,SING,CA,C,no,N,5,,219113,5183,CLH
6,,SING,CA,HA,no,N,6,,219113,5183,CLH
7,,SING,CB,CG,no,N,7,,219113,5183,CLH
8,,SING,CB,HB2,no,N,8,,219113,5183,CLH
9,,SING,CB,HB3,no,N,9,,219113,5183,CLH
10,,SING,CG,CD,no,N,10,,219113,5183,CLH
11,,SING,CG,HG2,no,N,11,,219113,5183,CLH
12,,SING,CG,HG3,no,N,12,,219113,5183,CLH
13,,SING,CD,CE,no,N,13,,219113,5183,CLH
14,,SING,CD,HD2,no,N,14,,219113,5183,CLH
15,,SING,CD,HD3,no,N,15,,219113,5183,CLH
16,,SING,CE,NZ,no,N,16,,219113,5183,CLH
17,,SING,CE,HE2,no,N,17,,219113,5183,CLH
18,,SING,CE,HE3,no,N,18,,219113,5183,CLH
19,,SING,NZ,CH,no,N,19,,219113,5183,CLH
20,,SING,NZ,HZ,no,N,20,,219113,5183,CLH
21,,DOUB,CH,OI,no,N,21,,219113,5183,CLH
22,,SING,CH,CI,no,N,22,,219113,5183,CLH
23,,SING,CI,NJ,no,N,23,,219113,5183,CLH
24,,SING,CI,HI1,no,N,24,,219113,5183,CLH
25,,SING,CI,HI2,no,N,25,,219113,5183,CLH
26,,SING,NJ,CK,no,N,26,,219113,5183,CLH
27,,SING,NJ,HNJ,no,N,27,,219113,5183,CLH
28,,DOUB,CK,OL,no,N,28,,219113,5183,CLH
29,,SING,CK,CL,no,N,29,,219113,5183,CLH
30,,DOUB,C,O,no,N,30,,219113,5183,CLH
31,,SING,C,OXT,no,N,31,,219113,5183,CLH
32,,DOUB,CL,OM,no,N,32,,219113,5183,CLH
33,,SING,CL,HL,no,N,33,,219113,5183,CLH
34,,SING,OXT,HXT,no,N,34,,219113,5183,CLH
1,,SING,CA,C,no,N,1,,219114,5183,MPT
2,,SING,CA,CB,no,N,2,,219114,5183,MPT
3,,SING,CA,HA1,no,N,3,,219114,5183,MPT
4,,SING,CA,HA2,no,N,4,,219114,5183,MPT
5,,DOUB,C,O,no,N,5,,219114,5183,MPT
6,,SING,C,OXT,no,N,6,,219114,5183,MPT
7,,SING,CB,SG,no,N,7,,219114,5183,MPT
8,,SING,CB,HB1,no,N,8,,219114,5183,MPT
9,,SING,CB,HB2,no,N,9,,219114,5183,MPT
10,,SING,SG,HG,no,N,10,,219114,5183,MPT
11,,SING,OXT,HXT,no,N,11,,219114,5183,MPT
1,,SING,N,CA,no,N,1,,219115,5183,ABA
2,,SING,N,H,no,N,2,,219115,5183,ABA
3,,SING,N,HN2,no,N,3,,219115,5183,ABA
4,,SING,CA,C,no,N,4,,219115,5183,ABA
5,,SING,CA,CB,no,N,5,,219115,5183,ABA
6,,SING,CA,HA,no,N,6,,219115,5183,ABA
7,,DOUB,C,O,no,N,7,,219115,5183,ABA
8,,SING,C,OXT,no,N,8,,219115,5183,ABA
9,,SING,CB,CG,no,N,9,,219115,5183,ABA
10,,SING,CB,HB3,no,N,10,,219115,5183,ABA
11,,SING,CB,HB2,no,N,11,,219115,5183,ABA
12,,SING,CG,HG1,no,N,12,,219115,5183,ABA
13,,SING,CG,HG3,no,N,13,,219115,5183,ABA
14,,SING,CG,HG2,no,N,14,,219115,5183,ABA
15,,SING,OXT,HXT,no,N,15,,219115,5183,ABA
1,,SING,N,HN1,no,N,1,,219116,5183,NH2
2,,SING,N,HN2,no,N,2,,219116,5183,NH2
1,,SING,N,HN1,no,N,1,,219293,5192,NH2
2,,SING,N,HN2,no,N,2,,219293,5192,NH2
1,,SING,N,CA,no,N,1,,219356,5196,DAR
2,,SING,N,H,no,N,2,,219356,5196,DAR
3,,SING,N,H2,no,N,3,,219356,5196,DAR
4,,SING,CA,CB,no,N,4,,219356,5196,DAR
5,,SING,CA,C,no,N,5,,219356,5196,DAR
6,,SING,CA,HA,no,N,6,,219356,5196,DAR
7,,SING,CB,CG,no,N,7,,219356,5196,DAR
8,,SING,CB,HB2,no,N,8,,219356,5196,DAR
9,,SING,CB,HB3,no,N,9,,219356,5196,DAR
10,,SING,CG,CD,no,N,10,,219356,5196,DAR
11,,SING,CG,HG2,no,N,11,,219356,5196,DAR
12,,SING,CG,HG3,no,N,12,,219356,5196,DAR
13,,SING,CD,NE,no,N,13,,219356,5196,DAR
14,,SING,CD,HD2,no,N,14,,219356,5196,DAR
15,,SING,CD,HD3,no,N,15,,219356,5196,DAR
16,,SING,NE,CZ,no,N,16,,219356,5196,DAR
17,,SING,NE,HE,no,N,17,,219356,5196,DAR
18,,SING,CZ,NH1,no,N,18,,219356,5196,DAR
19,,DOUB,CZ,NH2,no,N,19,,219356,5196,DAR
20,,SING,NH1,HH11,no,N,20,,219356,5196,DAR
21,,SING,NH1,HH12,no,N,21,,219356,5196,DAR
22,,SING,NH2,HH21,no,N,22,,219356,5196,DAR
23,,SING,NH2,HH22,no,N,23,,219356,5196,DAR
24,,DOUB,C,O,no,N,24,,219356,5196,DAR
25,,SING,C,OXT,no,N,25,,219356,5196,DAR
26,,SING,OXT,HXT,no,N,26,,219356,5196,DAR
1,,SING,N,HN1,no,N,1,,219357,5196,NH2
2,,SING,N,HN2,no,N,2,,219357,5196,NH2
1,,DOUB,C,O,no,N,1,,219453,5201,ACE
2,,SING,C,CH3,no,N,2,,219453,5201,ACE
3,,SING,C,H,no,N,3,,219453,5201,ACE
4,,SING,CH3,H1,no,N,4,,219453,5201,ACE
5,,SING,CH3,H2,no,N,5,,219453,5201,ACE
6,,SING,CH3,H3,no,N,6,,219453,5201,ACE
1,,SING,N,HN1,no,N,1,,219454,5201,NH2
2,,SING,N,HN2,no,N,2,,219454,5201,NH2
1,,SING,N,CA,no,N,1,,219705,5212,PTR
2,,SING,N,H,no,N,2,,219705,5212,PTR
3,,SING,N,HN2,no,N,3,,219705,5212,PTR
4,,SING,CA,C,no,N,4,,219705,5212,PTR
5,,SING,CA,CB,no,N,5,,219705,5212,PTR
6,,SING,CA,HA,no,N,6,,219705,5212,PTR
7,,DOUB,C,O,no,N,7,,219705,5212,PTR
8,,SING,C,OXT,no,N,8,,219705,5212,PTR
9,,SING,OXT,HXT,no,N,9,,219705,5212,PTR
10,,SING,CB,CG,no,N,10,,219705,5212,PTR
11,,SING,CB,HB2,no,N,11,,219705,5212,PTR
12,,SING,CB,HB3,no,N,12,,219705,5212,PTR
13,,DOUB,CG,CD1,yes,N,13,,219705,5212,PTR
14,,SING,CG,CD2,yes,N,14,,219705,5212,PTR
15,,SING,CD1,CE1,yes,N,15,,219705,5212,PTR
16,,SING,CD1,HD1,no,N,16,,219705,5212,PTR
17,,DOUB,CD2,CE2,yes,N,17,,219705,5212,PTR
18,,SING,CD2,HD2,no,N,18,,219705,5212,PTR
19,,DOUB,CE1,CZ,yes,N,19,,219705,5212,PTR
20,,SING,CE1,HE1,no,N,20,,219705,5212,PTR
21,,SING,CE2,CZ,yes,N,21,,219705,5212,PTR
22,,SING,CE2,HE2,no,N,22,,219705,5212,PTR
23,,SING,CZ,OH,no,N,23,,219705,5212,PTR
24,,SING,OH,P,no,N,24,,219705,5212,PTR
25,,DOUB,P,O1P,no,N,25,,219705,5212,PTR
26,,SING,P,O2P,no,N,26,,219705,5212,PTR
27,,SING,P,O3P,no,N,27,,219705,5212,PTR
28,,SING,O2P,HO2P,no,N,28,,219705,5212,PTR
29,,SING,O3P,HO3P,no,N,29,,219705,5212,PTR
1,,SING,N,HN1,no,N,1,,219706,5212,NH2
2,,SING,N,HN2,no,N,2,,219706,5212,NH2
1,,DOUB,C,O,no,N,1,,219750,5214,ACE
2,,SING,C,CH3,no,N,2,,219750,5214,ACE
3,,SING,C,H,no,N,3,,219750,5214,ACE
4,,SING,CH3,H1,no,N,4,,219750,5214,ACE
5,,SING,CH3,H2,no,N,5,,219750,5214,ACE
6,,SING,CH3,H3,no,N,6,,219750,5214,ACE
1,,SING,N,HN1,no,N,1,,219751,5214,NH2
2,,SING,N,HN2,no,N,2,,219751,5214,NH2
1,,DOUB,C,O,no,N,1,,219776,5215,ACE
2,,SING,C,CH3,no,N,2,,219776,5215,ACE
3,,SING,C,H,no,N,3,,219776,5215,ACE
4,,SING,CH3,H1,no,N,4,,219776,5215,ACE
5,,SING,CH3,H2,no,N,5,,219776,5215,ACE
6,,SING,CH3,H3,no,N,6,,219776,5215,ACE
1,,SING,N,HN1,no,N,1,,219777,5215,NH2
2,,SING,N,HN2,no,N,2,,219777,5215,NH2
1,,DOUB,C,O,no,N,1,,219797,5216,ACE
2,,SING,C,CH3,no,N,2,,219797,5216,ACE
3,,SING,C,H,no,N,3,,219797,5216,ACE
4,,SING,CH3,H1,no,N,4,,219797,5216,ACE
5,,SING,CH3,H2,no,N,5,,219797,5216,ACE
6,,SING,CH3,H3,no,N,6,,219797,5216,ACE
1,,SING,N,HN1,no,N,1,,219798,5216,NH2
2,,SING,N,HN2,no,N,2,,219798,5216,NH2
1,,SING,HO,O1,,,,,220127,5231,HYIN
2,,SING,O1,N1,,,,,220127,5231,HYIN
3,,SING,N1,HN,,,,,220127,5231,HYIN
4,,SING,N1,C1,,,,,220127,5231,HYIN
5,,SING,C1,C2,,,,,220127,5231,HYIN
6,,SING,C2,C3,,,,,220127,5231,HYIN
7,,SING,C2,C4,,,,,220127,5231,HYIN
8,,SING,C2,H2,,,,,220127,5231,HYIN
9,,SING,C3,H3A,,,,,220127,5231,HYIN
10,,SING,C3,H3B,,,,,220127,5231,HYIN
11,,SING,C3,S1,,,,,220127,5231,HYIN
12,,SING,S1,C5,,,,,220127,5231,HYIN
13,,SING,C5,C6,,,,,220127,5231,HYIN
14,,SING,C6,H6,,,,,220127,5231,HYIN
15,,SING,C7,H7,,,,,220127,5231,HYIN
16,,SING,C7,C8,,,,,220127,5231,HYIN
17,,SING,C8,O5,,,,,220127,5231,HYIN
18,,SING,C9,H9,,,,,220127,5231,HYIN
19,,SING,C9,C10,,,,,220127,5231,HYIN
20,,SING,C10,H10,,,,,220127,5231,HYIN
21,,SING,O5,C11,,,,,220127,5231,HYIN
22,,SING,C11,H11A,,,,,220127,5231,HYIN
23,,SING,C11,H11B,,,,,220127,5231,HYIN
24,,SING,C11,H11C,,,,,220127,5231,HYIN
25,,SING,C4,H4A,,,,,220127,5231,HYIN
26,,SING,C4,H4B,,,,,220127,5231,HYIN
27,,SING,C4,S2,,,,,220127,5231,HYIN
28,,SING,S2,C12,,,,,220127,5231,HYIN
29,,SING,C12,C13,,,,,220127,5231,HYIN
30,,SING,C13,H13,,,,,220127,5231,HYIN
31,,SING,C14,H14,,,,,220127,5231,HYIN
32,,SING,C14,C15,,,,,220127,5231,HYIN
33,,SING,C15,O8,,,,,220127,5231,HYIN
34,,SING,C16,H16,,,,,220127,5231,HYIN
35,,SING,C16,C17,,,,,220127,5231,HYIN
36,,SING,C17,H17,,,,,220127,5231,HYIN
37,,SING,O8,C18,,,,,220127,5231,HYIN
38,,SING,C18,H18A,,,,,220127,5231,HYIN
39,,SING,C18,H18B,,,,,220127,5231,HYIN
40,,SING,C18,H18C,,,,,220127,5231,HYIN
41,,DOUB,C1,O2,,,,,220127,5231,HYIN
42,,DOUB,S1,O3,,,,,220127,5231,HYIN
43,,DOUB,S1,O4,,,,,220127,5231,HYIN
44,,DOUB,C5,C6,,,,,220127,5231,HYIN
45,,DOUB,C7,C8,,,,,220127,5231,HYIN
46,,DOUB,C9,C10,,,,,220127,5231,HYIN
47,,DOUB,S2,O6,,,,,220127,5231,HYIN
48,,DOUB,S2,O7,,,,,220127,5231,HYIN
49,,DOUB,C12,C13,,,,,220127,5231,HYIN
50,,DOUB,C14,C15,,,,,220127,5231,HYIN
51,,DOUB,C16,C17,,,,,220127,5231,HYIN
1,,SING,CHA,C1A,yes,N,1,,220303,5239,HEM
2,,DOUB,CHA,C4D,yes,N,2,,220303,5239,HEM
3,,SING,CHA,HHA,no,N,3,,220303,5239,HEM
4,,SING,CHB,C4A,yes,N,4,,220303,5239,HEM
5,,DOUB,CHB,C1B,yes,N,5,,220303,5239,HEM
6,,SING,CHB,HHB,no,N,6,,220303,5239,HEM
7,,SING,CHC,C4B,yes,N,7,,220303,5239,HEM
8,,DOUB,CHC,C1C,yes,N,8,,220303,5239,HEM
9,,SING,CHC,HHC,no,N,9,,220303,5239,HEM
10,,DOUB,CHD,C4C,yes,N,10,,220303,5239,HEM
11,,SING,CHD,C1D,yes,N,11,,220303,5239,HEM
12,,SING,CHD,HHD,no,N,12,,220303,5239,HEM
13,,DOUB,C1A,C2A,yes,N,13,,220303,5239,HEM
14,,SING,C1A,NA,yes,N,14,,220303,5239,HEM
15,,SING,C2A,C3A,yes,N,15,,220303,5239,HEM
16,,SING,C2A,CAA,no,N,16,,220303,5239,HEM
17,,DOUB,C3A,C4A,yes,N,17,,220303,5239,HEM
18,,SING,C3A,CMA,no,N,18,,220303,5239,HEM
19,,SING,C4A,NA,yes,N,19,,220303,5239,HEM
20,,SING,CMA,HMA,no,N,20,,220303,5239,HEM
21,,SING,CMA,HMAA,no,N,21,,220303,5239,HEM
22,,SING,CMA,HMAB,no,N,22,,220303,5239,HEM
23,,SING,CAA,CBA,no,N,23,,220303,5239,HEM
24,,SING,CAA,HAA,no,N,24,,220303,5239,HEM
25,,SING,CAA,HAAA,no,N,25,,220303,5239,HEM
26,,SING,CBA,CGA,no,N,26,,220303,5239,HEM
27,,SING,CBA,HBA,no,N,27,,220303,5239,HEM
28,,SING,CBA,HBAA,no,N,28,,220303,5239,HEM
29,,DOUB,CGA,O1A,no,N,29,,220303,5239,HEM
30,,SING,CGA,O2A,no,N,30,,220303,5239,HEM
31,,SING,C1B,C2B,no,N,31,,220303,5239,HEM
32,,SING,C1B,NB,yes,N,32,,220303,5239,HEM
33,,DOUB,C2B,C3B,yes,N,33,,220303,5239,HEM
34,,SING,C2B,CMB,yes,N,34,,220303,5239,HEM
35,,SING,C3B,C4B,no,N,35,,220303,5239,HEM
36,,SING,C3B,CAB,yes,N,36,,220303,5239,HEM
37,,DOUB,C4B,NB,no,N,37,,220303,5239,HEM
38,,SING,CMB,HMB,yes,N,38,,220303,5239,HEM
39,,SING,CMB,HMBA,no,N,39,,220303,5239,HEM
40,,SING,CMB,HMBB,no,N,40,,220303,5239,HEM
41,,DOUB,CAB,CBB,no,N,41,,220303,5239,HEM
42,,SING,CAB,HAB,no,N,42,,220303,5239,HEM
43,,SING,CBB,HBB,no,N,43,,220303,5239,HEM
44,,SING,CBB,HBBA,no,N,44,,220303,5239,HEM
45,,SING,C1C,C2C,no,N,45,,220303,5239,HEM
46,,SING,C1C,NC,yes,N,46,,220303,5239,HEM
47,,DOUB,C2C,C3C,yes,N,47,,220303,5239,HEM
48,,SING,C2C,CMC,yes,N,48,,220303,5239,HEM
49,,SING,C3C,C4C,no,N,49,,220303,5239,HEM
50,,SING,C3C,CAC,yes,N,50,,220303,5239,HEM
51,,SING,C4C,NC,no,N,51,,220303,5239,HEM
52,,SING,CMC,HMC,yes,N,52,,220303,5239,HEM
53,,SING,CMC,HMCA,no,N,53,,220303,5239,HEM
54,,SING,CMC,HMCB,no,N,54,,220303,5239,HEM
55,,DOUB,CAC,CBC,no,N,55,,220303,5239,HEM
56,,SING,CAC,HAC,no,N,56,,220303,5239,HEM
57,,SING,CBC,HBC,no,N,57,,220303,5239,HEM
58,,SING,CBC,HBCA,no,N,58,,220303,5239,HEM
59,,SING,C1D,C2D,no,N,59,,220303,5239,HEM
60,,DOUB,C1D,ND,yes,N,60,,220303,5239,HEM
61,,DOUB,C2D,C3D,yes,N,61,,220303,5239,HEM
62,,SING,C2D,CMD,yes,N,62,,220303,5239,HEM
63,,SING,C3D,C4D,no,N,63,,220303,5239,HEM
64,,SING,C3D,CAD,yes,N,64,,220303,5239,HEM
65,,SING,C4D,ND,no,N,65,,220303,5239,HEM
66,,SING,CMD,HMD,yes,N,66,,220303,5239,HEM
67,,SING,CMD,HMDA,no,N,67,,220303,5239,HEM
68,,SING,CMD,HMDB,no,N,68,,220303,5239,HEM
69,,SING,CAD,CBD,no,N,69,,220303,5239,HEM
70,,SING,CAD,HAD,no,N,70,,220303,5239,HEM
71,,SING,CAD,HADA,no,N,71,,220303,5239,HEM
72,,SING,CBD,CGD,no,N,72,,220303,5239,HEM
73,,SING,CBD,HBD,no,N,73,,220303,5239,HEM
74,,SING,CBD,HBDA,no,N,74,,220303,5239,HEM
75,,DOUB,CGD,O1D,no,N,75,,220303,5239,HEM
76,,SING,CGD,O2D,no,N,76,,220303,5239,HEM
77,,SING,O2A,H2A,no,N,77,,220303,5239,HEM
78,,SING,O2D,H2D,no,N,78,,220303,5239,HEM
79,,SING,FE,NA,no,N,79,,220303,5239,HEM
80,,SING,FE,NB,no,N,80,,220303,5239,HEM
81,,SING,FE,NC,no,N,81,,220303,5239,HEM
82,,SING,FE,ND,no,N,82,,220303,5239,HEM
1,,SING,P,CMP,no,N,1,,220442,5245,CMR
2,,DOUB,P,OP1,no,N,2,,220442,5245,CMR
3,,SING,P,O5',no,N,3,,220442,5245,CMR
4,,SING,P,OP3,no,N,4,,220442,5245,CMR
5,,SING,CMP,HMP1,no,N,5,,220442,5245,CMR
6,,SING,CMP,HMP2,no,N,6,,220442,5245,CMR
7,,SING,CMP,HMP3,no,N,7,,220442,5245,CMR
8,,SING,O5',C5',no,N,8,,220442,5245,CMR
9,,SING,C5',C4',no,N,9,,220442,5245,CMR
10,,SING,C5',H5',no,N,10,,220442,5245,CMR
11,,SING,C5',H5'',no,N,11,,220442,5245,CMR
12,,SING,C4',O4',no,N,12,,220442,5245,CMR
13,,SING,C4',C3',no,N,13,,220442,5245,CMR
14,,SING,C4',H4',no,N,14,,220442,5245,CMR
15,,SING,O4',C1',no,N,15,,220442,5245,CMR
16,,SING,C1',N1,no,N,16,,220442,5245,CMR
17,,SING,C1',C2',no,N,17,,220442,5245,CMR
18,,SING,C1',H1',no,N,18,,220442,5245,CMR
19,,SING,N1,C6,no,N,19,,220442,5245,CMR
20,,SING,N1,C2,no,N,20,,220442,5245,CMR
21,,DOUB,C6,C5,no,N,21,,220442,5245,CMR
22,,SING,C6,H6,no,N,22,,220442,5245,CMR
23,,SING,C5,C4,no,N,23,,220442,5245,CMR
24,,SING,C5,H5,no,N,24,,220442,5245,CMR
25,,SING,C4,N4,no,N,25,,220442,5245,CMR
26,,DOUB,C4,N3,no,N,26,,220442,5245,CMR
27,,SING,N4,H41,no,N,27,,220442,5245,CMR
28,,SING,N4,H42,no,N,28,,220442,5245,CMR
29,,SING,N3,C2,no,N,29,,220442,5245,CMR
30,,DOUB,C2,O2,no,N,30,,220442,5245,CMR
31,,SING,C3',C2',no,N,31,,220442,5245,CMR
32,,SING,C3',O3',no,N,32,,220442,5245,CMR
33,,SING,C3',H3',no,N,33,,220442,5245,CMR
34,,SING,C2',H2',no,N,34,,220442,5245,CMR
35,,SING,C2',H2'',no,N,35,,220442,5245,CMR
36,,SING,O3',HO3',no,N,36,,220442,5245,CMR
37,,SING,OP3,HOP3,no,N,37,,220442,5245,CMR
1,,SING,P,CMP,no,N,1,,220443,5245,RMP
2,,DOUB,P,OP1,no,N,2,,220443,5245,RMP
3,,SING,P,O5',no,N,3,,220443,5245,RMP
4,,SING,P,OP3,no,N,4,,220443,5245,RMP
5,,SING,CMP,HMP1,no,N,5,,220443,5245,RMP
6,,SING,CMP,HMP2,no,N,6,,220443,5245,RMP
7,,SING,CMP,HMP3,no,N,7,,220443,5245,RMP
8,,SING,O5',C5',no,N,8,,220443,5245,RMP
9,,SING,C5',C4',no,N,9,,220443,5245,RMP
10,,SING,C5',H5',no,N,10,,220443,5245,RMP
11,,SING,C5',H5'',no,N,11,,220443,5245,RMP
12,,SING,C4',O4',no,N,12,,220443,5245,RMP
13,,SING,C4',C3',no,N,13,,220443,5245,RMP
14,,SING,C4',H4',no,N,14,,220443,5245,RMP
15,,SING,O4',C1',no,N,15,,220443,5245,RMP
16,,SING,C1',N9,no,N,16,,220443,5245,RMP
17,,SING,C1',C2',no,N,17,,220443,5245,RMP
18,,SING,C1',H1',no,N,18,,220443,5245,RMP
19,,SING,N9,C8,yes,N,19,,220443,5245,RMP
20,,SING,N9,C4,yes,N,20,,220443,5245,RMP
21,,DOUB,C8,N7,yes,N,21,,220443,5245,RMP
22,,SING,C8,H8,no,N,22,,220443,5245,RMP
23,,SING,N7,C5,yes,N,23,,220443,5245,RMP
24,,DOUB,C5,C6,yes,N,24,,220443,5245,RMP
25,,SING,C5,C4,yes,N,25,,220443,5245,RMP
26,,SING,C6,N6,no,N,26,,220443,5245,RMP
27,,SING,C6,N1,yes,N,27,,220443,5245,RMP
28,,SING,N6,H61,no,N,28,,220443,5245,RMP
29,,SING,N6,H62,no,N,29,,220443,5245,RMP
30,,DOUB,N1,C2,yes,N,30,,220443,5245,RMP
31,,SING,C2,N3,yes,N,31,,220443,5245,RMP
32,,SING,C2,H2,no,N,32,,220443,5245,RMP
33,,DOUB,N3,C4,yes,N,33,,220443,5245,RMP
34,,SING,C3',C2',no,N,34,,220443,5245,RMP
35,,SING,C3',O3',no,N,35,,220443,5245,RMP
36,,SING,C3',H3',no,N,36,,220443,5245,RMP
37,,SING,C2',H2',no,N,37,,220443,5245,RMP
38,,SING,C2',H2'',no,N,38,,220443,5245,RMP
39,,SING,O3',HO3',no,N,39,,220443,5245,RMP
40,,SING,OP3,HOP3,no,N,40,,220443,5245,RMP
1,,SING,N,CA,no,N,1,,220467,5246,IIL
2,,SING,N,H,no,N,2,,220467,5246,IIL
3,,SING,N,H2,no,N,3,,220467,5246,IIL
4,,SING,CA,C,no,N,4,,220467,5246,IIL
5,,SING,CA,CB,no,N,5,,220467,5246,IIL
6,,SING,CA,HA,no,N,6,,220467,5246,IIL
7,,DOUB,C,O,no,N,7,,220467,5246,IIL
8,,SING,C,OXT,no,N,8,,220467,5246,IIL
9,,SING,CB,CG2,no,N,9,,220467,5246,IIL
10,,SING,CB,CG1,no,N,10,,220467,5246,IIL
11,,SING,CB,HB,no,N,11,,220467,5246,IIL
12,,SING,CG2,HG21,no,N,12,,220467,5246,IIL
13,,SING,CG2,HG22,no,N,13,,220467,5246,IIL
14,,SING,CG2,HG23,no,N,14,,220467,5246,IIL
15,,SING,CG1,CD1,no,N,15,,220467,5246,IIL
16,,SING,CG1,HG12,no,N,16,,220467,5246,IIL
17,,SING,CG1,HG13,no,N,17,,220467,5246,IIL
18,,SING,CD1,HD11,no,N,18,,220467,5246,IIL
19,,SING,CD1,HD12,no,N,19,,220467,5246,IIL
20,,SING,CD1,HD13,no,N,20,,220467,5246,IIL
21,,SING,OXT,HXT,no,N,21,,220467,5246,IIL
1,,SING,OP3,P,no,N,1,,220689,5259,6IA
2,,SING,OP3,HOP3,no,N,2,,220689,5259,6IA
3,,DOUB,P,OP1,no,N,3,,220689,5259,6IA
4,,SING,P,OP2,no,N,4,,220689,5259,6IA
5,,SING,P,O5',no,N,5,,220689,5259,6IA
6,,SING,OP2,HOP2,no,N,6,,220689,5259,6IA
7,,SING,O5',C5',no,N,7,,220689,5259,6IA
8,,SING,C5',C4',no,N,8,,220689,5259,6IA
9,,SING,C5',H5',no,N,9,,220689,5259,6IA
10,,SING,C5',H5'',no,N,10,,220689,5259,6IA
11,,SING,C4',O4',no,N,11,,220689,5259,6IA
12,,SING,C4',C3',no,N,12,,220689,5259,6IA
13,,SING,C4',H4',no,N,13,,220689,5259,6IA
14,,SING,O4',C1',no,N,14,,220689,5259,6IA
15,,SING,C3',O3',no,N,15,,220689,5259,6IA
16,,SING,C3',C2',no,N,16,,220689,5259,6IA
17,,SING,C3',H3',no,N,17,,220689,5259,6IA
18,,SING,O3',HO3',no,N,18,,220689,5259,6IA
19,,SING,C2',O2',no,N,19,,220689,5259,6IA
20,,SING,C2',C1',no,N,20,,220689,5259,6IA
21,,SING,C2',H2',no,N,21,,220689,5259,6IA
22,,SING,O2',HO2',no,N,22,,220689,5259,6IA
23,,SING,C1',N9,no,N,23,,220689,5259,6IA
24,,SING,C1',H1',no,N,24,,220689,5259,6IA
25,,SING,N9,C8,yes,N,25,,220689,5259,6IA
26,,SING,N9,C4,yes,N,26,,220689,5259,6IA
27,,DOUB,C8,N7,yes,N,27,,220689,5259,6IA
28,,SING,C8,H8,no,N,28,,220689,5259,6IA
29,,SING,N7,C5,yes,N,29,,220689,5259,6IA
30,,SING,C5,C6,yes,N,30,,220689,5259,6IA
31,,DOUB,C5,C4,yes,N,31,,220689,5259,6IA
32,,SING,C6,N6,no,N,32,,220689,5259,6IA
33,,DOUB,C6,N1,yes,N,33,,220689,5259,6IA
34,,SING,N6,C12,no,N,34,,220689,5259,6IA
35,,SING,N6,HN6,no,N,35,,220689,5259,6IA
36,,SING,N1,C2,yes,N,36,,220689,5259,6IA
37,,DOUB,C2,N3,yes,N,37,,220689,5259,6IA
38,,SING,C2,H2,no,N,38,,220689,5259,6IA
39,,SING,N3,C4,yes,N,39,,220689,5259,6IA
40,,SING,C12,C13,no,N,40,,220689,5259,6IA
41,,SING,C12,H121,no,N,41,,220689,5259,6IA
42,,SING,C12,H122,no,N,42,,220689,5259,6IA
43,,SING,C13,C14,no,N,43,,220689,5259,6IA
44,,SING,C13,H131,no,N,44,,220689,5259,6IA
45,,SING,C13,H132,no,N,45,,220689,5259,6IA
46,,SING,C14,C15,no,N,46,,220689,5259,6IA
47,,SING,C14,C16,no,N,47,,220689,5259,6IA
48,,SING,C14,H14,no,N,48,,220689,5259,6IA
49,,SING,C15,H151,no,N,49,,220689,5259,6IA
50,,SING,C15,H152,no,N,50,,220689,5259,6IA
51,,SING,C15,H153,no,N,51,,220689,5259,6IA
52,,SING,C16,H161,no,N,52,,220689,5259,6IA
53,,SING,C16,H162,no,N,53,,220689,5259,6IA
54,,SING,C16,H163,no,N,54,,220689,5259,6IA
1,,SING,CHA,C1A,yes,N,1,,220893,5269,HEM
2,,DOUB,CHA,C4D,yes,N,2,,220893,5269,HEM
3,,SING,CHA,HHA,no,N,3,,220893,5269,HEM
4,,SING,CHB,C4A,yes,N,4,,220893,5269,HEM
5,,DOUB,CHB,C1B,yes,N,5,,220893,5269,HEM
6,,SING,CHB,HHB,no,N,6,,220893,5269,HEM
7,,SING,CHC,C4B,yes,N,7,,220893,5269,HEM
8,,DOUB,CHC,C1C,yes,N,8,,220893,5269,HEM
9,,SING,CHC,HHC,no,N,9,,220893,5269,HEM
10,,DOUB,CHD,C4C,yes,N,10,,220893,5269,HEM
11,,SING,CHD,C1D,yes,N,11,,220893,5269,HEM
12,,SING,CHD,HHD,no,N,12,,220893,5269,HEM
13,,DOUB,C1A,C2A,yes,N,13,,220893,5269,HEM
14,,SING,C1A,NA,yes,N,14,,220893,5269,HEM
15,,SING,C2A,C3A,yes,N,15,,220893,5269,HEM
16,,SING,C2A,CAA,no,N,16,,220893,5269,HEM
17,,DOUB,C3A,C4A,yes,N,17,,220893,5269,HEM
18,,SING,C3A,CMA,no,N,18,,220893,5269,HEM
19,,SING,C4A,NA,yes,N,19,,220893,5269,HEM
20,,SING,CMA,HMA,no,N,20,,220893,5269,HEM
21,,SING,CMA,HMAA,no,N,21,,220893,5269,HEM
22,,SING,CMA,HMAB,no,N,22,,220893,5269,HEM
23,,SING,CAA,CBA,no,N,23,,220893,5269,HEM
24,,SING,CAA,HAA,no,N,24,,220893,5269,HEM
25,,SING,CAA,HAAA,no,N,25,,220893,5269,HEM
26,,SING,CBA,CGA,no,N,26,,220893,5269,HEM
27,,SING,CBA,HBA,no,N,27,,220893,5269,HEM
28,,SING,CBA,HBAA,no,N,28,,220893,5269,HEM
29,,DOUB,CGA,O1A,no,N,29,,220893,5269,HEM
30,,SING,CGA,O2A,no,N,30,,220893,5269,HEM
31,,SING,C1B,C2B,no,N,31,,220893,5269,HEM
32,,SING,C1B,NB,yes,N,32,,220893,5269,HEM
33,,DOUB,C2B,C3B,yes,N,33,,220893,5269,HEM
34,,SING,C2B,CMB,yes,N,34,,220893,5269,HEM
35,,SING,C3B,C4B,no,N,35,,220893,5269,HEM
36,,SING,C3B,CAB,yes,N,36,,220893,5269,HEM
37,,DOUB,C4B,NB,no,N,37,,220893,5269,HEM
38,,SING,CMB,HMB,yes,N,38,,220893,5269,HEM
39,,SING,CMB,HMBA,no,N,39,,220893,5269,HEM
40,,SING,CMB,HMBB,no,N,40,,220893,5269,HEM
41,,DOUB,CAB,CBB,no,N,41,,220893,5269,HEM
42,,SING,CAB,HAB,no,N,42,,220893,5269,HEM
43,,SING,CBB,HBB,no,N,43,,220893,5269,HEM
44,,SING,CBB,HBBA,no,N,44,,220893,5269,HEM
45,,SING,C1C,C2C,no,N,45,,220893,5269,HEM
46,,SING,C1C,NC,yes,N,46,,220893,5269,HEM
47,,DOUB,C2C,C3C,yes,N,47,,220893,5269,HEM
48,,SING,C2C,CMC,yes,N,48,,220893,5269,HEM
49,,SING,C3C,C4C,no,N,49,,220893,5269,HEM
50,,SING,C3C,CAC,yes,N,50,,220893,5269,HEM
51,,SING,C4C,NC,no,N,51,,220893,5269,HEM
52,,SING,CMC,HMC,yes,N,52,,220893,5269,HEM
53,,SING,CMC,HMCA,no,N,53,,220893,5269,HEM
54,,SING,CMC,HMCB,no,N,54,,220893,5269,HEM
55,,DOUB,CAC,CBC,no,N,55,,220893,5269,HEM
56,,SING,CAC,HAC,no,N,56,,220893,5269,HEM
57,,SING,CBC,HBC,no,N,57,,220893,5269,HEM
58,,SING,CBC,HBCA,no,N,58,,220893,5269,HEM
59,,SING,C1D,C2D,no,N,59,,220893,5269,HEM
60,,DOUB,C1D,ND,yes,N,60,,220893,5269,HEM
61,,DOUB,C2D,C3D,yes,N,61,,220893,5269,HEM
62,,SING,C2D,CMD,yes,N,62,,220893,5269,HEM
63,,SING,C3D,C4D,no,N,63,,220893,5269,HEM
64,,SING,C3D,CAD,yes,N,64,,220893,5269,HEM
65,,SING,C4D,ND,no,N,65,,220893,5269,HEM
66,,SING,CMD,HMD,yes,N,66,,220893,5269,HEM
67,,SING,CMD,HMDA,no,N,67,,220893,5269,HEM
68,,SING,CMD,HMDB,no,N,68,,220893,5269,HEM
69,,SING,CAD,CBD,no,N,69,,220893,5269,HEM
70,,SING,CAD,HAD,no,N,70,,220893,5269,HEM
71,,SING,CAD,HADA,no,N,71,,220893,5269,HEM
72,,SING,CBD,CGD,no,N,72,,220893,5269,HEM
73,,SING,CBD,HBD,no,N,73,,220893,5269,HEM
74,,SING,CBD,HBDA,no,N,74,,220893,5269,HEM
75,,DOUB,CGD,O1D,no,N,75,,220893,5269,HEM
76,,SING,CGD,O2D,no,N,76,,220893,5269,HEM
77,,SING,O2A,H2A,no,N,77,,220893,5269,HEM
78,,SING,O2D,H2D,no,N,78,,220893,5269,HEM
79,,SING,FE,NA,no,N,79,,220893,5269,HEM
80,,SING,FE,NB,no,N,80,,220893,5269,HEM
81,,SING,FE,NC,no,N,81,,220893,5269,HEM
82,,SING,FE,ND,no,N,82,,220893,5269,HEM
1,,SING,OP3,P,no,N,1,,221107,5278,CH
2,,SING,OP3,HOP3,no,N,2,,221107,5278,CH
3,,DOUB,P,OP1,no,N,3,,221107,5278,CH
4,,SING,P,OP2,no,N,4,,221107,5278,CH
5,,SING,P,O5',no,N,5,,221107,5278,CH
6,,SING,OP2,HOP2,no,N,6,,221107,5278,CH
7,,SING,O5',C5',no,N,7,,221107,5278,CH
8,,SING,C5',C4',no,N,8,,221107,5278,CH
9,,SING,C5',H5',no,N,9,,221107,5278,CH
10,,SING,C5',H5'',no,N,10,,221107,5278,CH
11,,SING,C4',O4',no,N,11,,221107,5278,CH
12,,SING,C4',C3',no,N,12,,221107,5278,CH
13,,SING,C4',H4',no,N,13,,221107,5278,CH
14,,SING,O4',C1',no,N,14,,221107,5278,CH
15,,SING,C3',O3',no,N,15,,221107,5278,CH
16,,SING,C3',C2',no,N,16,,221107,5278,CH
17,,SING,C3',H3',no,N,17,,221107,5278,CH
18,,SING,O3',HO3',no,N,18,,221107,5278,CH
19,,SING,C2',O2',no,N,19,,221107,5278,CH
20,,SING,C2',C1',no,N,20,,221107,5278,CH
21,,SING,C2',H2',no,N,21,,221107,5278,CH
22,,SING,O2',HO2',no,N,22,,221107,5278,CH
23,,SING,C1',N1,no,N,23,,221107,5278,CH
24,,SING,C1',H1',no,N,24,,221107,5278,CH
25,,SING,N1,C2,no,N,25,,221107,5278,CH
26,,DOUB,N1,C6,no,N,26,,221107,5278,CH
27,,DOUB,C2,O2,no,N,27,,221107,5278,CH
28,,SING,C2,N3,no,N,28,,221107,5278,CH
29,,SING,N3,C4,no,N,29,,221107,5278,CH
30,,SING,N3,HN3,no,N,30,,221107,5278,CH
31,,SING,C4,N4,no,N,31,,221107,5278,CH
32,,DOUB,C4,C5,no,N,32,,221107,5278,CH
33,,SING,N4,H41,no,N,33,,221107,5278,CH
34,,SING,N4,H42,no,N,34,,221107,5278,CH
35,,SING,C5,C6,no,N,35,,221107,5278,CH
36,,SING,C5,H5,no,N,36,,221107,5278,CH
37,,SING,C6,H6,no,N,37,,221107,5278,CH
1,,SING,FE,NA,no,N,1,,221129,5279,HEC
2,,SING,FE,NB,no,N,2,,221129,5279,HEC
3,,SING,FE,NC,no,N,3,,221129,5279,HEC
4,,SING,FE,ND,no,N,4,,221129,5279,HEC
5,,DOUB,CHA,C1A,no,N,5,,221129,5279,HEC
6,,SING,CHA,C4D,no,N,6,,221129,5279,HEC
7,,SING,CHA,HHA,no,N,7,,221129,5279,HEC
8,,DOUB,CHB,C4A,no,N,8,,221129,5279,HEC
9,,SING,CHB,C1B,no,N,9,,221129,5279,HEC
10,,SING,CHB,HHB,no,N,10,,221129,5279,HEC
11,,DOUB,CHC,C4B,no,N,11,,221129,5279,HEC
12,,SING,CHC,C1C,no,N,12,,221129,5279,HEC
13,,SING,CHC,HHC,no,N,13,,221129,5279,HEC
14,,DOUB,CHD,C4C,no,N,14,,221129,5279,HEC
15,,SING,CHD,C1D,no,N,15,,221129,5279,HEC
16,,SING,CHD,HHD,no,N,16,,221129,5279,HEC
17,,SING,NA,C1A,yes,N,17,,221129,5279,HEC
18,,SING,NA,C4A,yes,N,18,,221129,5279,HEC
19,,SING,C1A,C2A,yes,N,19,,221129,5279,HEC
20,,DOUB,C2A,C3A,yes,N,20,,221129,5279,HEC
21,,SING,C2A,CAA,no,N,21,,221129,5279,HEC
22,,SING,C3A,C4A,yes,N,22,,221129,5279,HEC
23,,SING,C3A,CMA,no,N,23,,221129,5279,HEC
24,,SING,CMA,HMA1,no,N,24,,221129,5279,HEC
25,,SING,CMA,HMA2,no,N,25,,221129,5279,HEC
26,,SING,CMA,HMA3,no,N,26,,221129,5279,HEC
27,,SING,CAA,CBA,no,N,27,,221129,5279,HEC
28,,SING,CAA,HAA1,no,N,28,,221129,5279,HEC
29,,SING,CAA,HAA2,no,N,29,,221129,5279,HEC
30,,SING,CBA,CGA,no,N,30,,221129,5279,HEC
31,,SING,CBA,HBA1,no,N,31,,221129,5279,HEC
32,,SING,CBA,HBA2,no,N,32,,221129,5279,HEC
33,,DOUB,CGA,O1A,no,N,33,,221129,5279,HEC
34,,SING,CGA,O2A,no,N,34,,221129,5279,HEC
35,,SING,O2A,H2A,no,N,35,,221129,5279,HEC
36,,SING,NB,C1B,yes,N,36,,221129,5279,HEC
37,,SING,NB,C4B,yes,N,37,,221129,5279,HEC
38,,DOUB,C1B,C2B,yes,N,38,,221129,5279,HEC
39,,SING,C2B,C3B,yes,N,39,,221129,5279,HEC
40,,SING,C2B,CMB,no,N,40,,221129,5279,HEC
41,,SING,C3B,C4B,yes,N,41,,221129,5279,HEC
42,,DOUB,C3B,CAB,no,E,42,,221129,5279,HEC
43,,SING,CMB,HMB1,no,N,43,,221129,5279,HEC
44,,SING,CMB,HMB2,no,N,44,,221129,5279,HEC
45,,SING,CMB,HMB3,no,N,45,,221129,5279,HEC
46,,SING,CAB,CBB,no,N,46,,221129,5279,HEC
47,,SING,CAB,HAB,no,N,47,,221129,5279,HEC
48,,SING,CBB,HBB1,no,N,48,,221129,5279,HEC
49,,SING,CBB,HBB2,no,N,49,,221129,5279,HEC
50,,SING,CBB,HBB3,no,N,50,,221129,5279,HEC
51,,SING,NC,C1C,yes,N,51,,221129,5279,HEC
52,,SING,NC,C4C,yes,N,52,,221129,5279,HEC
53,,DOUB,C1C,C2C,yes,N,53,,221129,5279,HEC
54,,SING,C2C,C3C,yes,N,54,,221129,5279,HEC
55,,SING,C2C,CMC,no,N,55,,221129,5279,HEC
56,,SING,C3C,C4C,yes,N,56,,221129,5279,HEC
57,,DOUB,C3C,CAC,no,E,57,,221129,5279,HEC
58,,SING,CMC,HMC1,no,N,58,,221129,5279,HEC
59,,SING,CMC,HMC2,no,N,59,,221129,5279,HEC
60,,SING,CMC,HMC3,no,N,60,,221129,5279,HEC
61,,SING,CAC,CBC,no,N,61,,221129,5279,HEC
62,,SING,CAC,HAC,no,N,62,,221129,5279,HEC
63,,SING,CBC,HBC1,no,N,63,,221129,5279,HEC
64,,SING,CBC,HBC2,no,N,64,,221129,5279,HEC
65,,SING,CBC,HBC3,no,N,65,,221129,5279,HEC
66,,SING,ND,C1D,yes,N,66,,221129,5279,HEC
67,,SING,ND,C4D,yes,N,67,,221129,5279,HEC
68,,DOUB,C1D,C2D,yes,N,68,,221129,5279,HEC
69,,SING,C2D,C3D,yes,N,69,,221129,5279,HEC
70,,SING,C2D,CMD,no,N,70,,221129,5279,HEC
71,,DOUB,C3D,C4D,yes,N,71,,221129,5279,HEC
72,,SING,C3D,CAD,no,N,72,,221129,5279,HEC
73,,SING,CMD,HMD1,no,N,73,,221129,5279,HEC
74,,SING,CMD,HMD2,no,N,74,,221129,5279,HEC
75,,SING,CMD,HMD3,no,N,75,,221129,5279,HEC
76,,SING,CAD,CBD,no,N,76,,221129,5279,HEC
77,,SING,CAD,HAD1,no,N,77,,221129,5279,HEC
78,,SING,CAD,HAD2,no,N,78,,221129,5279,HEC
79,,SING,CBD,CGD,no,N,79,,221129,5279,HEC
80,,SING,CBD,HBD1,no,N,80,,221129,5279,HEC
81,,SING,CBD,HBD2,no,N,81,,221129,5279,HEC
82,,DOUB,CGD,O1D,no,N,82,,221129,5279,HEC
83,,SING,CGD,O2D,no,N,83,,221129,5279,HEC
84,,SING,O2D,H2D,no,N,84,,221129,5279,HEC
1,,DOUB,C,O,no,N,1,,221223,5283,ACE
2,,SING,C,CH3,no,N,2,,221223,5283,ACE
3,,SING,C,H,no,N,3,,221223,5283,ACE
4,,SING,CH3,H1,no,N,4,,221223,5283,ACE
5,,SING,CH3,H2,no,N,5,,221223,5283,ACE
6,,SING,CH3,H3,no,N,6,,221223,5283,ACE
1,,SING,N,HN1,no,N,1,,221224,5283,NH2
2,,SING,N,HN2,no,N,2,,221224,5283,NH2
1,,SING,N,CA,no,N,1,,221288,5286,AYA
2,,SING,N,CT,no,N,2,,221288,5286,AYA
3,,SING,N,H,no,N,3,,221288,5286,AYA
4,,SING,CA,CB,no,N,4,,221288,5286,AYA
5,,SING,CA,C,no,N,5,,221288,5286,AYA
6,,SING,CA,HA,no,N,6,,221288,5286,AYA
7,,SING,CB,HB1,no,N,7,,221288,5286,AYA
8,,SING,CB,HB2,no,N,8,,221288,5286,AYA
9,,SING,CB,HB3,no,N,9,,221288,5286,AYA
10,,DOUB,C,O,no,N,10,,221288,5286,AYA
11,,SING,C,OXT,no,N,11,,221288,5286,AYA
12,,SING,OXT,HXT,no,N,12,,221288,5286,AYA
13,,DOUB,CT,OT,no,N,13,,221288,5286,AYA
14,,SING,CT,CM,no,N,14,,221288,5286,AYA
15,,SING,CM,HM1,no,N,15,,221288,5286,AYA
16,,SING,CM,HM2,no,N,16,,221288,5286,AYA
17,,SING,CM,HM3,no,N,17,,221288,5286,AYA
1,,SING,N,HN1,no,N,1,,221289,5286,NH2
2,,SING,N,HN2,no,N,2,,221289,5286,NH2
1,,SING,N,CA,no,N,1,,221326,5288,PTR
2,,SING,N,H,no,N,2,,221326,5288,PTR
3,,SING,N,HN2,no,N,3,,221326,5288,PTR
4,,SING,CA,C,no,N,4,,221326,5288,PTR
5,,SING,CA,CB,no,N,5,,221326,5288,PTR
6,,SING,CA,HA,no,N,6,,221326,5288,PTR
7,,DOUB,C,O,no,N,7,,221326,5288,PTR
8,,SING,C,OXT,no,N,8,,221326,5288,PTR
9,,SING,OXT,HXT,no,N,9,,221326,5288,PTR
10,,SING,CB,CG,no,N,10,,221326,5288,PTR
11,,SING,CB,HB2,no,N,11,,221326,5288,PTR
12,,SING,CB,HB3,no,N,12,,221326,5288,PTR
13,,DOUB,CG,CD1,yes,N,13,,221326,5288,PTR
14,,SING,CG,CD2,yes,N,14,,221326,5288,PTR
15,,SING,CD1,CE1,yes,N,15,,221326,5288,PTR
16,,SING,CD1,HD1,no,N,16,,221326,5288,PTR
17,,DOUB,CD2,CE2,yes,N,17,,221326,5288,PTR
18,,SING,CD2,HD2,no,N,18,,221326,5288,PTR
19,,DOUB,CE1,CZ,yes,N,19,,221326,5288,PTR
20,,SING,CE1,HE1,no,N,20,,221326,5288,PTR
21,,SING,CE2,CZ,yes,N,21,,221326,5288,PTR
22,,SING,CE2,HE2,no,N,22,,221326,5288,PTR
23,,SING,CZ,OH,no,N,23,,221326,5288,PTR
24,,SING,OH,P,no,N,24,,221326,5288,PTR
25,,DOUB,P,O1P,no,N,25,,221326,5288,PTR
26,,SING,P,O2P,no,N,26,,221326,5288,PTR
27,,SING,P,O3P,no,N,27,,221326,5288,PTR
28,,SING,O2P,HO2P,no,N,28,,221326,5288,PTR
29,,SING,O3P,HO3P,no,N,29,,221326,5288,PTR
1,,SING,N,CA,no,N,1,,221599,53,PCA
2,,SING,N,CD,no,N,2,,221599,53,PCA
3,,SING,N,H,no,N,3,,221599,53,PCA
4,,SING,CA,CB,no,N,4,,221599,53,PCA
5,,SING,CA,C,no,N,5,,221599,53,PCA
6,,SING,CA,HA,no,N,6,,221599,53,PCA
7,,SING,CB,CG,no,N,7,,221599,53,PCA
8,,SING,CB,HB2,no,N,8,,221599,53,PCA
9,,SING,CB,HB3,no,N,9,,221599,53,PCA
10,,SING,CG,CD,no,N,10,,221599,53,PCA
11,,SING,CG,HG2,no,N,11,,221599,53,PCA
12,,SING,CG,HG3,no,N,12,,221599,53,PCA
13,,DOUB,CD,OE,no,N,13,,221599,53,PCA
14,,DOUB,C,O,no,N,14,,221599,53,PCA
15,,SING,C,OXT,no,N,15,,221599,53,PCA
16,,SING,OXT,HXT,no,N,16,,221599,53,PCA
1,,SING,O,C5,no,N,1,,221664,5301,A2G
2,,SING,C1,O,no,N,2,,221664,5301,A2G
3,,SING,C1,C2,no,N,3,,221664,5301,A2G
4,,SING,C1,H1,no,N,4,,221664,5301,A2G
5,,SING,O1,C1,no,N,5,,221664,5301,A2G
6,,SING,O1,HO1,no,N,6,,221664,5301,A2G
7,,SING,C2,C3,no,N,7,,221664,5301,A2G
8,,SING,C2,H2,no,N,8,,221664,5301,A2G
9,,SING,N2,C2,no,N,9,,221664,5301,A2G
10,,SING,N2,HN2,no,N,10,,221664,5301,A2G
11,,SING,C3,C4,no,N,11,,221664,5301,A2G
12,,SING,C3,O3,no,N,12,,221664,5301,A2G
13,,SING,C3,H3,no,N,13,,221664,5301,A2G
14,,SING,O3,HO3,no,N,14,,221664,5301,A2G
15,,SING,C4,O4,no,N,15,,221664,5301,A2G
16,,SING,C4,H4,no,N,16,,221664,5301,A2G
17,,SING,O4,HO4,no,N,17,,221664,5301,A2G
18,,SING,C5,C4,no,N,18,,221664,5301,A2G
19,,SING,C5,C6,no,N,19,,221664,5301,A2G
20,,SING,C5,H5,no,N,20,,221664,5301,A2G
21,,SING,C6,O6,no,N,21,,221664,5301,A2G
22,,SING,C6,H6,no,N,22,,221664,5301,A2G
23,,SING,C7,N2,no,N,23,,221664,5301,A2G
24,,DOUB,O7,C7,no,N,24,,221664,5301,A2G
25,,SING,C8,C7,no,N,25,,221664,5301,A2G
26,,SING,C8,H8,no,N,26,,221664,5301,A2G
27,,SING,C8,H8A,no,N,27,,221664,5301,A2G
28,,SING,C8,H8B,no,N,28,,221664,5301,A2G
29,,SING,C6,H14,no,N,29,,221664,5301,A2G
30,,SING,O6,H15,no,N,30,,221664,5301,A2G
1,,DOUB,C,O,no,N,1,,221665,5301,ACE
2,,SING,C,CH3,no,N,2,,221665,5301,ACE
3,,SING,C,H,no,N,3,,221665,5301,ACE
4,,SING,CH3,H1,no,N,4,,221665,5301,ACE
5,,SING,CH3,H2,no,N,5,,221665,5301,ACE
6,,SING,CH3,H3,no,N,6,,221665,5301,ACE
1,,SING,CHA,C1A,yes,N,1,,221732,5304,HEM
2,,DOUB,CHA,C4D,yes,N,2,,221732,5304,HEM
3,,SING,CHA,HHA,no,N,3,,221732,5304,HEM
4,,SING,CHB,C4A,yes,N,4,,221732,5304,HEM
5,,DOUB,CHB,C1B,yes,N,5,,221732,5304,HEM
6,,SING,CHB,HHB,no,N,6,,221732,5304,HEM
7,,SING,CHC,C4B,yes,N,7,,221732,5304,HEM
8,,DOUB,CHC,C1C,yes,N,8,,221732,5304,HEM
9,,SING,CHC,HHC,no,N,9,,221732,5304,HEM
10,,DOUB,CHD,C4C,yes,N,10,,221732,5304,HEM
11,,SING,CHD,C1D,yes,N,11,,221732,5304,HEM
12,,SING,CHD,HHD,no,N,12,,221732,5304,HEM
13,,DOUB,C1A,C2A,yes,N,13,,221732,5304,HEM
14,,SING,C1A,NA,yes,N,14,,221732,5304,HEM
15,,SING,C2A,C3A,yes,N,15,,221732,5304,HEM
16,,SING,C2A,CAA,no,N,16,,221732,5304,HEM
17,,DOUB,C3A,C4A,yes,N,17,,221732,5304,HEM
18,,SING,C3A,CMA,no,N,18,,221732,5304,HEM
19,,SING,C4A,NA,yes,N,19,,221732,5304,HEM
20,,SING,CMA,HMA,no,N,20,,221732,5304,HEM
21,,SING,CMA,HMAA,no,N,21,,221732,5304,HEM
22,,SING,CMA,HMAB,no,N,22,,221732,5304,HEM
23,,SING,CAA,CBA,no,N,23,,221732,5304,HEM
24,,SING,CAA,HAA,no,N,24,,221732,5304,HEM
25,,SING,CAA,HAAA,no,N,25,,221732,5304,HEM
26,,SING,CBA,CGA,no,N,26,,221732,5304,HEM
27,,SING,CBA,HBA,no,N,27,,221732,5304,HEM
28,,SING,CBA,HBAA,no,N,28,,221732,5304,HEM
29,,DOUB,CGA,O1A,no,N,29,,221732,5304,HEM
30,,SING,CGA,O2A,no,N,30,,221732,5304,HEM
31,,SING,C1B,C2B,no,N,31,,221732,5304,HEM
32,,SING,C1B,NB,yes,N,32,,221732,5304,HEM
33,,DOUB,C2B,C3B,yes,N,33,,221732,5304,HEM
34,,SING,C2B,CMB,yes,N,34,,221732,5304,HEM
35,,SING,C3B,C4B,no,N,35,,221732,5304,HEM
36,,SING,C3B,CAB,yes,N,36,,221732,5304,HEM
37,,DOUB,C4B,NB,no,N,37,,221732,5304,HEM
38,,SING,CMB,HMB,yes,N,38,,221732,5304,HEM
39,,SING,CMB,HMBA,no,N,39,,221732,5304,HEM
40,,SING,CMB,HMBB,no,N,40,,221732,5304,HEM
41,,DOUB,CAB,CBB,no,N,41,,221732,5304,HEM
42,,SING,CAB,HAB,no,N,42,,221732,5304,HEM
43,,SING,CBB,HBB,no,N,43,,221732,5304,HEM
44,,SING,CBB,HBBA,no,N,44,,221732,5304,HEM
45,,SING,C1C,C2C,no,N,45,,221732,5304,HEM
46,,SING,C1C,NC,yes,N,46,,221732,5304,HEM
47,,DOUB,C2C,C3C,yes,N,47,,221732,5304,HEM
48,,SING,C2C,CMC,yes,N,48,,221732,5304,HEM
49,,SING,C3C,C4C,no,N,49,,221732,5304,HEM
50,,SING,C3C,CAC,yes,N,50,,221732,5304,HEM
51,,SING,C4C,NC,no,N,51,,221732,5304,HEM
52,,SING,CMC,HMC,yes,N,52,,221732,5304,HEM
53,,SING,CMC,HMCA,no,N,53,,221732,5304,HEM
54,,SING,CMC,HMCB,no,N,54,,221732,5304,HEM
55,,DOUB,CAC,CBC,no,N,55,,221732,5304,HEM
56,,SING,CAC,HAC,no,N,56,,221732,5304,HEM
57,,SING,CBC,HBC,no,N,57,,221732,5304,HEM
58,,SING,CBC,HBCA,no,N,58,,221732,5304,HEM
59,,SING,C1D,C2D,no,N,59,,221732,5304,HEM
60,,DOUB,C1D,ND,yes,N,60,,221732,5304,HEM
61,,DOUB,C2D,C3D,yes,N,61,,221732,5304,HEM
62,,SING,C2D,CMD,yes,N,62,,221732,5304,HEM
63,,SING,C3D,C4D,no,N,63,,221732,5304,HEM
64,,SING,C3D,CAD,yes,N,64,,221732,5304,HEM
65,,SING,C4D,ND,no,N,65,,221732,5304,HEM
66,,SING,CMD,HMD,yes,N,66,,221732,5304,HEM
67,,SING,CMD,HMDA,no,N,67,,221732,5304,HEM
68,,SING,CMD,HMDB,no,N,68,,221732,5304,HEM
69,,SING,CAD,CBD,no,N,69,,221732,5304,HEM
70,,SING,CAD,HAD,no,N,70,,221732,5304,HEM
71,,SING,CAD,HADA,no,N,71,,221732,5304,HEM
72,,SING,CBD,CGD,no,N,72,,221732,5304,HEM
73,,SING,CBD,HBD,no,N,73,,221732,5304,HEM
74,,SING,CBD,HBDA,no,N,74,,221732,5304,HEM
75,,DOUB,CGD,O1D,no,N,75,,221732,5304,HEM
76,,SING,CGD,O2D,no,N,76,,221732,5304,HEM
77,,SING,O2A,H2A,no,N,77,,221732,5304,HEM
78,,SING,O2D,H2D,no,N,78,,221732,5304,HEM
79,,SING,FE,NA,no,N,79,,221732,5304,HEM
80,,SING,FE,NB,no,N,80,,221732,5304,HEM
81,,SING,FE,NC,no,N,81,,221732,5304,HEM
82,,SING,FE,ND,no,N,82,,221732,5304,HEM
1,,SING,N,CA,no,N,1,,221890,5310,PTR
2,,SING,N,H,no,N,2,,221890,5310,PTR
3,,SING,N,HN2,no,N,3,,221890,5310,PTR
4,,SING,CA,C,no,N,4,,221890,5310,PTR
5,,SING,CA,CB,no,N,5,,221890,5310,PTR
6,,SING,CA,HA,no,N,6,,221890,5310,PTR
7,,DOUB,C,O,no,N,7,,221890,5310,PTR
8,,SING,C,OXT,no,N,8,,221890,5310,PTR
9,,SING,OXT,HXT,no,N,9,,221890,5310,PTR
10,,SING,CB,CG,no,N,10,,221890,5310,PTR
11,,SING,CB,HB2,no,N,11,,221890,5310,PTR
12,,SING,CB,HB3,no,N,12,,221890,5310,PTR
13,,DOUB,CG,CD1,yes,N,13,,221890,5310,PTR
14,,SING,CG,CD2,yes,N,14,,221890,5310,PTR
15,,SING,CD1,CE1,yes,N,15,,221890,5310,PTR
16,,SING,CD1,HD1,no,N,16,,221890,5310,PTR
17,,DOUB,CD2,CE2,yes,N,17,,221890,5310,PTR
18,,SING,CD2,HD2,no,N,18,,221890,5310,PTR
19,,DOUB,CE1,CZ,yes,N,19,,221890,5310,PTR
20,,SING,CE1,HE1,no,N,20,,221890,5310,PTR
21,,SING,CE2,CZ,yes,N,21,,221890,5310,PTR
22,,SING,CE2,HE2,no,N,22,,221890,5310,PTR
23,,SING,CZ,OH,no,N,23,,221890,5310,PTR
24,,SING,OH,P,no,N,24,,221890,5310,PTR
25,,DOUB,P,O1P,no,N,25,,221890,5310,PTR
26,,SING,P,O2P,no,N,26,,221890,5310,PTR
27,,SING,P,O3P,no,N,27,,221890,5310,PTR
28,,SING,O2P,HO2P,no,N,28,,221890,5310,PTR
29,,SING,O3P,HO3P,no,N,29,,221890,5310,PTR
1,,SING,N,CA,no,N,1,,221974,5314,PTR
2,,SING,N,H,no,N,2,,221974,5314,PTR
3,,SING,N,HN2,no,N,3,,221974,5314,PTR
4,,SING,CA,C,no,N,4,,221974,5314,PTR
5,,SING,CA,CB,no,N,5,,221974,5314,PTR
6,,SING,CA,HA,no,N,6,,221974,5314,PTR
7,,DOUB,C,O,no,N,7,,221974,5314,PTR
8,,SING,C,OXT,no,N,8,,221974,5314,PTR
9,,SING,OXT,HXT,no,N,9,,221974,5314,PTR
10,,SING,CB,CG,no,N,10,,221974,5314,PTR
11,,SING,CB,HB2,no,N,11,,221974,5314,PTR
12,,SING,CB,HB3,no,N,12,,221974,5314,PTR
13,,DOUB,CG,CD1,yes,N,13,,221974,5314,PTR
14,,SING,CG,CD2,yes,N,14,,221974,5314,PTR
15,,SING,CD1,CE1,yes,N,15,,221974,5314,PTR
16,,SING,CD1,HD1,no,N,16,,221974,5314,PTR
17,,DOUB,CD2,CE2,yes,N,17,,221974,5314,PTR
18,,SING,CD2,HD2,no,N,18,,221974,5314,PTR
19,,DOUB,CE1,CZ,yes,N,19,,221974,5314,PTR
20,,SING,CE1,HE1,no,N,20,,221974,5314,PTR
21,,SING,CE2,CZ,yes,N,21,,221974,5314,PTR
22,,SING,CE2,HE2,no,N,22,,221974,5314,PTR
23,,SING,CZ,OH,no,N,23,,221974,5314,PTR
24,,SING,OH,P,no,N,24,,221974,5314,PTR
25,,DOUB,P,O1P,no,N,25,,221974,5314,PTR
26,,SING,P,O2P,no,N,26,,221974,5314,PTR
27,,SING,P,O3P,no,N,27,,221974,5314,PTR
28,,SING,O2P,HO2P,no,N,28,,221974,5314,PTR
29,,SING,O3P,HO3P,no,N,29,,221974,5314,PTR
1,,SING,C1,C2,no,N,1,,222091,5319,RTL
2,,SING,C1,C6,no,N,2,,222091,5319,RTL
3,,SING,C1,C16,no,N,3,,222091,5319,RTL
4,,SING,C1,C17,no,N,4,,222091,5319,RTL
5,,SING,C2,C3,no,N,5,,222091,5319,RTL
6,,SING,C2,H21,no,N,6,,222091,5319,RTL
7,,SING,C2,H22,no,N,7,,222091,5319,RTL
8,,SING,C3,C4,no,N,8,,222091,5319,RTL
9,,SING,C3,H31,no,N,9,,222091,5319,RTL
10,,SING,C3,H32,no,N,10,,222091,5319,RTL
11,,SING,C4,C5,no,N,11,,222091,5319,RTL
12,,SING,C4,H41,no,N,12,,222091,5319,RTL
13,,SING,C4,H42,no,N,13,,222091,5319,RTL
14,,DOUB,C5,C6,no,N,14,,222091,5319,RTL
15,,SING,C5,C18,no,N,15,,222091,5319,RTL
16,,SING,C6,C7,no,N,16,,222091,5319,RTL
17,,DOUB,C7,C8,no,E,17,,222091,5319,RTL
18,,SING,C7,H7,no,N,18,,222091,5319,RTL
19,,SING,C8,C9,no,N,19,,222091,5319,RTL
20,,SING,C8,H8,no,N,20,,222091,5319,RTL
21,,DOUB,C9,C10,no,E,21,,222091,5319,RTL
22,,SING,C9,C19,no,N,22,,222091,5319,RTL
23,,SING,C10,C11,no,N,23,,222091,5319,RTL
24,,SING,C10,H10,no,N,24,,222091,5319,RTL
25,,DOUB,C11,C12,no,E,25,,222091,5319,RTL
26,,SING,C11,H11,no,N,26,,222091,5319,RTL
27,,SING,C12,C13,no,N,27,,222091,5319,RTL
28,,SING,C12,H12,no,N,28,,222091,5319,RTL
29,,DOUB,C13,C14,no,E,29,,222091,5319,RTL
30,,SING,C13,C20,no,N,30,,222091,5319,RTL
31,,SING,C14,C15,no,N,31,,222091,5319,RTL
32,,SING,C14,H14,no,N,32,,222091,5319,RTL
33,,SING,C15,O1,no,N,33,,222091,5319,RTL
34,,SING,C15,H151,no,N,34,,222091,5319,RTL
35,,SING,C15,H152,no,N,35,,222091,5319,RTL
36,,SING,O1,HO1,no,N,36,,222091,5319,RTL
37,,SING,C16,H161,no,N,37,,222091,5319,RTL
38,,SING,C16,H162,no,N,38,,222091,5319,RTL
39,,SING,C16,H163,no,N,39,,222091,5319,RTL
40,,SING,C17,H171,no,N,40,,222091,5319,RTL
41,,SING,C17,H172,no,N,41,,222091,5319,RTL
42,,SING,C17,H173,no,N,42,,222091,5319,RTL
43,,SING,C18,H181,no,N,43,,222091,5319,RTL
44,,SING,C18,H182,no,N,44,,222091,5319,RTL
45,,SING,C18,H183,no,N,45,,222091,5319,RTL
46,,SING,C19,H191,no,N,46,,222091,5319,RTL
47,,SING,C19,H192,no,N,47,,222091,5319,RTL
48,,SING,C19,H193,no,N,48,,222091,5319,RTL
49,,SING,C20,H201,no,N,49,,222091,5319,RTL
50,,SING,C20,H202,no,N,50,,222091,5319,RTL
51,,SING,C20,H203,no,N,51,,222091,5319,RTL
1,,SING,C1,C2,no,N,1,,222374,5331,RTL
2,,SING,C1,C6,no,N,2,,222374,5331,RTL
3,,SING,C1,C16,no,N,3,,222374,5331,RTL
4,,SING,C1,C17,no,N,4,,222374,5331,RTL
5,,SING,C2,C3,no,N,5,,222374,5331,RTL
6,,SING,C2,H21,no,N,6,,222374,5331,RTL
7,,SING,C2,H22,no,N,7,,222374,5331,RTL
8,,SING,C3,C4,no,N,8,,222374,5331,RTL
9,,SING,C3,H31,no,N,9,,222374,5331,RTL
10,,SING,C3,H32,no,N,10,,222374,5331,RTL
11,,SING,C4,C5,no,N,11,,222374,5331,RTL
12,,SING,C4,H41,no,N,12,,222374,5331,RTL
13,,SING,C4,H42,no,N,13,,222374,5331,RTL
14,,DOUB,C5,C6,no,N,14,,222374,5331,RTL
15,,SING,C5,C18,no,N,15,,222374,5331,RTL
16,,SING,C6,C7,no,N,16,,222374,5331,RTL
17,,DOUB,C7,C8,no,E,17,,222374,5331,RTL
18,,SING,C7,H7,no,N,18,,222374,5331,RTL
19,,SING,C8,C9,no,N,19,,222374,5331,RTL
20,,SING,C8,H8,no,N,20,,222374,5331,RTL
21,,DOUB,C9,C10,no,E,21,,222374,5331,RTL
22,,SING,C9,C19,no,N,22,,222374,5331,RTL
23,,SING,C10,C11,no,N,23,,222374,5331,RTL
24,,SING,C10,H10,no,N,24,,222374,5331,RTL
25,,DOUB,C11,C12,no,E,25,,222374,5331,RTL
26,,SING,C11,H11,no,N,26,,222374,5331,RTL
27,,SING,C12,C13,no,N,27,,222374,5331,RTL
28,,SING,C12,H12,no,N,28,,222374,5331,RTL
29,,DOUB,C13,C14,no,E,29,,222374,5331,RTL
30,,SING,C13,C20,no,N,30,,222374,5331,RTL
31,,SING,C14,C15,no,N,31,,222374,5331,RTL
32,,SING,C14,H14,no,N,32,,222374,5331,RTL
33,,SING,C15,O1,no,N,33,,222374,5331,RTL
34,,SING,C15,H151,no,N,34,,222374,5331,RTL
35,,SING,C15,H152,no,N,35,,222374,5331,RTL
36,,SING,O1,HO1,no,N,36,,222374,5331,RTL
37,,SING,C16,H161,no,N,37,,222374,5331,RTL
38,,SING,C16,H162,no,N,38,,222374,5331,RTL
39,,SING,C16,H163,no,N,39,,222374,5331,RTL
40,,SING,C17,H171,no,N,40,,222374,5331,RTL
41,,SING,C17,H172,no,N,41,,222374,5331,RTL
42,,SING,C17,H173,no,N,42,,222374,5331,RTL
43,,SING,C18,H181,no,N,43,,222374,5331,RTL
44,,SING,C18,H182,no,N,44,,222374,5331,RTL
45,,SING,C18,H183,no,N,45,,222374,5331,RTL
46,,SING,C19,H191,no,N,46,,222374,5331,RTL
47,,SING,C19,H192,no,N,47,,222374,5331,RTL
48,,SING,C19,H193,no,N,48,,222374,5331,RTL
49,,SING,C20,H201,no,N,49,,222374,5331,RTL
50,,SING,C20,H202,no,N,50,,222374,5331,RTL
51,,SING,C20,H203,no,N,51,,222374,5331,RTL
1,,DOUB,C1,O1,no,N,1,,222401,5332,MYR
2,,SING,C1,O2,no,N,2,,222401,5332,MYR
3,,SING,C1,C2,no,N,3,,222401,5332,MYR
4,,SING,O2,HO2,no,N,4,,222401,5332,MYR
5,,SING,C2,C3,no,N,5,,222401,5332,MYR
6,,SING,C2,H21,no,N,6,,222401,5332,MYR
7,,SING,C2,H22,no,N,7,,222401,5332,MYR
8,,SING,C3,C4,no,N,8,,222401,5332,MYR
9,,SING,C3,H31,no,N,9,,222401,5332,MYR
10,,SING,C3,H32,no,N,10,,222401,5332,MYR
11,,SING,C4,C5,no,N,11,,222401,5332,MYR
12,,SING,C4,H41,no,N,12,,222401,5332,MYR
13,,SING,C4,H42,no,N,13,,222401,5332,MYR
14,,SING,C5,C6,no,N,14,,222401,5332,MYR
15,,SING,C5,H51,no,N,15,,222401,5332,MYR
16,,SING,C5,H52,no,N,16,,222401,5332,MYR
17,,SING,C6,C7,no,N,17,,222401,5332,MYR
18,,SING,C6,H61,no,N,18,,222401,5332,MYR
19,,SING,C6,H62,no,N,19,,222401,5332,MYR
20,,SING,C7,C8,no,N,20,,222401,5332,MYR
21,,SING,C7,H71,no,N,21,,222401,5332,MYR
22,,SING,C7,H72,no,N,22,,222401,5332,MYR
23,,SING,C8,C9,no,N,23,,222401,5332,MYR
24,,SING,C8,H81,no,N,24,,222401,5332,MYR
25,,SING,C8,H82,no,N,25,,222401,5332,MYR
26,,SING,C9,C10,no,N,26,,222401,5332,MYR
27,,SING,C9,H91,no,N,27,,222401,5332,MYR
28,,SING,C9,H92,no,N,28,,222401,5332,MYR
29,,SING,C10,C11,no,N,29,,222401,5332,MYR
30,,SING,C10,H101,no,N,30,,222401,5332,MYR
31,,SING,C10,H102,no,N,31,,222401,5332,MYR
32,,SING,C11,C12,no,N,32,,222401,5332,MYR
33,,SING,C11,H111,no,N,33,,222401,5332,MYR
34,,SING,C11,H112,no,N,34,,222401,5332,MYR
35,,SING,C12,C13,no,N,35,,222401,5332,MYR
36,,SING,C12,H121,no,N,36,,222401,5332,MYR
37,,SING,C12,H122,no,N,37,,222401,5332,MYR
38,,SING,C13,C14,no,N,38,,222401,5332,MYR
39,,SING,C13,H131,no,N,39,,222401,5332,MYR
40,,SING,C13,H132,no,N,40,,222401,5332,MYR
41,,SING,C14,H141,no,N,41,,222401,5332,MYR
42,,SING,C14,H142,no,N,42,,222401,5332,MYR
43,,SING,C14,H143,no,N,43,,222401,5332,MYR
1,,SING,CHA,C1A,yes,N,1,,222423,5333,HEM
2,,DOUB,CHA,C4D,yes,N,2,,222423,5333,HEM
3,,SING,CHA,HHA,no,N,3,,222423,5333,HEM
4,,SING,CHB,C4A,yes,N,4,,222423,5333,HEM
5,,DOUB,CHB,C1B,yes,N,5,,222423,5333,HEM
6,,SING,CHB,HHB,no,N,6,,222423,5333,HEM
7,,SING,CHC,C4B,yes,N,7,,222423,5333,HEM
8,,DOUB,CHC,C1C,yes,N,8,,222423,5333,HEM
9,,SING,CHC,HHC,no,N,9,,222423,5333,HEM
10,,DOUB,CHD,C4C,yes,N,10,,222423,5333,HEM
11,,SING,CHD,C1D,yes,N,11,,222423,5333,HEM
12,,SING,CHD,HHD,no,N,12,,222423,5333,HEM
13,,DOUB,C1A,C2A,yes,N,13,,222423,5333,HEM
14,,SING,C1A,NA,yes,N,14,,222423,5333,HEM
15,,SING,C2A,C3A,yes,N,15,,222423,5333,HEM
16,,SING,C2A,CAA,no,N,16,,222423,5333,HEM
17,,DOUB,C3A,C4A,yes,N,17,,222423,5333,HEM
18,,SING,C3A,CMA,no,N,18,,222423,5333,HEM
19,,SING,C4A,NA,yes,N,19,,222423,5333,HEM
20,,SING,CMA,HMA,no,N,20,,222423,5333,HEM
21,,SING,CMA,HMAA,no,N,21,,222423,5333,HEM
22,,SING,CMA,HMAB,no,N,22,,222423,5333,HEM
23,,SING,CAA,CBA,no,N,23,,222423,5333,HEM
24,,SING,CAA,HAA,no,N,24,,222423,5333,HEM
25,,SING,CAA,HAAA,no,N,25,,222423,5333,HEM
26,,SING,CBA,CGA,no,N,26,,222423,5333,HEM
27,,SING,CBA,HBA,no,N,27,,222423,5333,HEM
28,,SING,CBA,HBAA,no,N,28,,222423,5333,HEM
29,,DOUB,CGA,O1A,no,N,29,,222423,5333,HEM
30,,SING,CGA,O2A,no,N,30,,222423,5333,HEM
31,,SING,C1B,C2B,no,N,31,,222423,5333,HEM
32,,SING,C1B,NB,yes,N,32,,222423,5333,HEM
33,,DOUB,C2B,C3B,yes,N,33,,222423,5333,HEM
34,,SING,C2B,CMB,yes,N,34,,222423,5333,HEM
35,,SING,C3B,C4B,no,N,35,,222423,5333,HEM
36,,SING,C3B,CAB,yes,N,36,,222423,5333,HEM
37,,DOUB,C4B,NB,no,N,37,,222423,5333,HEM
38,,SING,CMB,HMB,yes,N,38,,222423,5333,HEM
39,,SING,CMB,HMBA,no,N,39,,222423,5333,HEM
40,,SING,CMB,HMBB,no,N,40,,222423,5333,HEM
41,,DOUB,CAB,CBB,no,N,41,,222423,5333,HEM
42,,SING,CAB,HAB,no,N,42,,222423,5333,HEM
43,,SING,CBB,HBB,no,N,43,,222423,5333,HEM
44,,SING,CBB,HBBA,no,N,44,,222423,5333,HEM
45,,SING,C1C,C2C,no,N,45,,222423,5333,HEM
46,,SING,C1C,NC,yes,N,46,,222423,5333,HEM
47,,DOUB,C2C,C3C,yes,N,47,,222423,5333,HEM
48,,SING,C2C,CMC,yes,N,48,,222423,5333,HEM
49,,SING,C3C,C4C,no,N,49,,222423,5333,HEM
50,,SING,C3C,CAC,yes,N,50,,222423,5333,HEM
51,,SING,C4C,NC,no,N,51,,222423,5333,HEM
52,,SING,CMC,HMC,yes,N,52,,222423,5333,HEM
53,,SING,CMC,HMCA,no,N,53,,222423,5333,HEM
54,,SING,CMC,HMCB,no,N,54,,222423,5333,HEM
55,,DOUB,CAC,CBC,no,N,55,,222423,5333,HEM
56,,SING,CAC,HAC,no,N,56,,222423,5333,HEM
57,,SING,CBC,HBC,no,N,57,,222423,5333,HEM
58,,SING,CBC,HBCA,no,N,58,,222423,5333,HEM
59,,SING,C1D,C2D,no,N,59,,222423,5333,HEM
60,,DOUB,C1D,ND,yes,N,60,,222423,5333,HEM
61,,DOUB,C2D,C3D,yes,N,61,,222423,5333,HEM
62,,SING,C2D,CMD,yes,N,62,,222423,5333,HEM
63,,SING,C3D,C4D,no,N,63,,222423,5333,HEM
64,,SING,C3D,CAD,yes,N,64,,222423,5333,HEM
65,,SING,C4D,ND,no,N,65,,222423,5333,HEM
66,,SING,CMD,HMD,yes,N,66,,222423,5333,HEM
67,,SING,CMD,HMDA,no,N,67,,222423,5333,HEM
68,,SING,CMD,HMDB,no,N,68,,222423,5333,HEM
69,,SING,CAD,CBD,no,N,69,,222423,5333,HEM
70,,SING,CAD,HAD,no,N,70,,222423,5333,HEM
71,,SING,CAD,HADA,no,N,71,,222423,5333,HEM
72,,SING,CBD,CGD,no,N,72,,222423,5333,HEM
73,,SING,CBD,HBD,no,N,73,,222423,5333,HEM
74,,SING,CBD,HBDA,no,N,74,,222423,5333,HEM
75,,DOUB,CGD,O1D,no,N,75,,222423,5333,HEM
76,,SING,CGD,O2D,no,N,76,,222423,5333,HEM
77,,SING,O2A,H2A,no,N,77,,222423,5333,HEM
78,,SING,O2D,H2D,no,N,78,,222423,5333,HEM
79,,SING,FE,NA,no,N,79,,222423,5333,HEM
80,,SING,FE,NB,no,N,80,,222423,5333,HEM
81,,SING,FE,NC,no,N,81,,222423,5333,HEM
82,,SING,FE,ND,no,N,82,,222423,5333,HEM
1,,SING,FE1,S1,no,N,1,,222492,5337,FES
2,,SING,FE1,S2,no,N,2,,222492,5337,FES
3,,SING,FE2,S1,no,N,3,,222492,5337,FES
4,,SING,FE2,S2,no,N,4,,222492,5337,FES
1,,SING,O1,N1,no,N,1,,222786,5351,MTN
2,,SING,N1,C1,no,N,2,,222786,5351,MTN
3,,SING,N1,C5,no,N,3,,222786,5351,MTN
4,,SING,C1,C2,no,N,4,,222786,5351,MTN
5,,SING,C1,C8,no,N,5,,222786,5351,MTN
6,,SING,C1,C9,no,N,6,,222786,5351,MTN
7,,DOUB,C2,C3,no,N,7,,222786,5351,MTN
8,,SING,C2,H2,no,N,8,,222786,5351,MTN
9,,SING,C3,C4,no,N,9,,222786,5351,MTN
10,,SING,C3,C5,no,N,10,,222786,5351,MTN
11,,SING,C4,S1,no,N,11,,222786,5351,MTN
12,,SING,C4,H41,no,N,12,,222786,5351,MTN
13,,SING,C4,H42,no,N,13,,222786,5351,MTN
14,,SING,C5,C6,no,N,14,,222786,5351,MTN
15,,SING,C5,C7,no,N,15,,222786,5351,MTN
16,,SING,C6,H61,no,N,16,,222786,5351,MTN
17,,SING,C6,H62,no,N,17,,222786,5351,MTN
18,,SING,C6,H63,no,N,18,,222786,5351,MTN
19,,SING,C7,H71,no,N,19,,222786,5351,MTN
20,,SING,C7,H72,no,N,20,,222786,5351,MTN
21,,SING,C7,H73,no,N,21,,222786,5351,MTN
22,,SING,C8,H81,no,N,22,,222786,5351,MTN
23,,SING,C8,H82,no,N,23,,222786,5351,MTN
24,,SING,C8,H83,no,N,24,,222786,5351,MTN
25,,SING,C9,H91,no,N,25,,222786,5351,MTN
26,,SING,C9,H92,no,N,26,,222786,5351,MTN
27,,SING,C9,H93,no,N,27,,222786,5351,MTN
28,,SING,S1,S2,no,N,28,,222786,5351,MTN
29,,DOUB,S2,O2,no,N,29,,222786,5351,MTN
30,,DOUB,S2,O3,no,N,30,,222786,5351,MTN
31,,SING,S2,C12,no,N,31,,222786,5351,MTN
32,,SING,C12,H4,no,N,32,,222786,5351,MTN
33,,SING,C12,H1,no,N,33,,222786,5351,MTN
34,,SING,C12,H3,no,N,34,,222786,5351,MTN
1,,DOUB,PB,O1B,no,N,1,,223134,5368,GDP
2,,SING,PB,O2B,no,N,2,,223134,5368,GDP
3,,SING,PB,O3B,no,N,3,,223134,5368,GDP
4,,SING,PB,O3A,no,N,4,,223134,5368,GDP
5,,SING,O2B,HOB2,no,N,5,,223134,5368,GDP
6,,SING,O3B,HOB3,no,N,6,,223134,5368,GDP
7,,SING,O3A,PA,no,N,7,,223134,5368,GDP
8,,DOUB,PA,O1A,no,N,8,,223134,5368,GDP
9,,SING,PA,O2A,no,N,9,,223134,5368,GDP
10,,SING,PA,O5',no,N,10,,223134,5368,GDP
11,,SING,O2A,HOA2,no,N,11,,223134,5368,GDP
12,,SING,O5',C5',no,N,12,,223134,5368,GDP
13,,SING,C5',C4',no,N,13,,223134,5368,GDP
14,,SING,C5',H5',no,N,14,,223134,5368,GDP
15,,SING,C5',H5'',no,N,15,,223134,5368,GDP
16,,SING,C4',O4',no,N,16,,223134,5368,GDP
17,,SING,C4',C3',no,N,17,,223134,5368,GDP
18,,SING,C4',H4',no,N,18,,223134,5368,GDP
19,,SING,O4',C1',no,N,19,,223134,5368,GDP
20,,SING,C3',O3',no,N,20,,223134,5368,GDP
21,,SING,C3',C2',no,N,21,,223134,5368,GDP
22,,SING,C3',H3',no,N,22,,223134,5368,GDP
23,,SING,O3',HO3',no,N,23,,223134,5368,GDP
24,,SING,C2',O2',no,N,24,,223134,5368,GDP
25,,SING,C2',C1',no,N,25,,223134,5368,GDP
26,,SING,C2',H2',no,N,26,,223134,5368,GDP
27,,SING,O2',HO2',no,N,27,,223134,5368,GDP
28,,SING,C1',N9,no,N,28,,223134,5368,GDP
29,,SING,C1',H1',no,N,29,,223134,5368,GDP
30,,SING,N9,C8,yes,N,30,,223134,5368,GDP
31,,SING,N9,C4,yes,N,31,,223134,5368,GDP
32,,DOUB,C8,N7,yes,N,32,,223134,5368,GDP
33,,SING,C8,H8,no,N,33,,223134,5368,GDP
34,,SING,N7,C5,yes,N,34,,223134,5368,GDP
35,,SING,C5,C6,no,N,35,,223134,5368,GDP
36,,DOUB,C5,C4,yes,N,36,,223134,5368,GDP
37,,DOUB,C6,O6,no,N,37,,223134,5368,GDP
38,,SING,C6,N1,no,N,38,,223134,5368,GDP
39,,SING,N1,C2,no,N,39,,223134,5368,GDP
40,,SING,N1,HN1,no,N,40,,223134,5368,GDP
41,,SING,C2,N2,no,N,41,,223134,5368,GDP
42,,DOUB,C2,N3,no,N,42,,223134,5368,GDP
43,,SING,N2,HN21,no,N,43,,223134,5368,GDP
44,,SING,N2,HN22,no,N,44,,223134,5368,GDP
45,,SING,N3,C4,no,N,45,,223134,5368,GDP
1,,DOUB,C2,N3,yes,N,1,,223189,5370,P11
2,,SING,C2,N2,yes,N,2,,223189,5370,P11
3,,SING,C2,C1,no,N,3,,223189,5370,P11
4,,SING,N3,C4,yes,N,4,,223189,5370,P11
5,,DOUB,C4,C5,yes,N,5,,223189,5370,P11
6,,SING,C4,H4,no,N,6,,223189,5370,P11
7,,SING,C5,N2,yes,N,7,,223189,5370,P11
8,,SING,C5,H5,no,N,8,,223189,5370,P11
9,,SING,N2,C3,no,N,9,,223189,5370,P11
10,,SING,C3,H31,no,N,10,,223189,5370,P11
11,,SING,C3,H32A,no,N,11,,223189,5370,P11
12,,SING,C3,H33,no,N,12,,223189,5370,P11
13,,DOUB,C1,O1,no,N,13,,223189,5370,P11
14,,SING,C1,N1,no,N,14,,223189,5370,P11
15,,SING,N1,C9,no,N,15,,223189,5370,P11
16,,SING,N1,HN1,no,N,16,,223189,5370,P11
17,,DOUB,C7,C8,yes,N,17,,223189,5370,P11
18,,SING,C7,N5,yes,N,18,,223189,5370,P11
19,,SING,C7,C6,no,N,19,,223189,5370,P11
20,,SING,C8,C9,yes,N,20,,223189,5370,P11
21,,SING,C8,H8,no,N,21,,223189,5370,P11
22,,DOUB,C9,C10,yes,N,22,,223189,5370,P11
23,,SING,C10,N5,yes,N,23,,223189,5370,P11
24,,SING,C10,H10,no,N,24,,223189,5370,P11
25,,SING,N5,C11,no,N,25,,223189,5370,P11
26,,SING,C11,H111,no,N,26,,223189,5370,P11
27,,SING,C11,H112,no,N,27,,223189,5370,P11
28,,SING,C11,H113,no,N,28,,223189,5370,P11
29,,DOUB,C6,O2,no,N,29,,223189,5370,P11
30,,SING,C6,N4,no,N,30,,223189,5370,P11
31,,SING,N4,C13,no,N,31,,223189,5370,P11
32,,SING,N4,HN4,no,N,32,,223189,5370,P11
33,,SING,C13,C14,no,N,33,,223189,5370,P11
34,,SING,C13,H131,no,N,34,,223189,5370,P11
35,,SING,C13,H132,no,N,35,,223189,5370,P11
36,,SING,C14,C12,no,N,36,,223189,5370,P11
37,,SING,C14,H141,no,N,37,,223189,5370,P11
38,,SING,C14,H142,no,N,38,,223189,5370,P11
39,,DOUB,C12,O3,no,N,39,,223189,5370,P11
40,,SING,C12,N6,no,N,40,,223189,5370,P11
41,,SING,N6,C18,no,N,41,,223189,5370,P11
42,,SING,N6,HN6,no,N,42,,223189,5370,P11
43,,DOUB,C16,N9,yes,N,43,,223189,5370,P11
44,,SING,C16,N8,yes,N,44,,223189,5370,P11
45,,SING,C16,C15,no,N,45,,223189,5370,P11
46,,SING,N9,C18,yes,N,46,,223189,5370,P11
47,,DOUB,C18,C19,yes,N,47,,223189,5370,P11
48,,SING,C19,N8,yes,N,48,,223189,5370,P11
49,,SING,C19,H19,no,N,49,,223189,5370,P11
50,,SING,N8,C17,no,N,50,,223189,5370,P11
51,,SING,C17,H171,no,N,51,,223189,5370,P11
52,,SING,C17,H172,no,N,52,,223189,5370,P11
53,,SING,C17,H173,no,N,53,,223189,5370,P11
54,,DOUB,C15,O4,no,N,54,,223189,5370,P11
55,,SING,C15,N7,no,N,55,,223189,5370,P11
56,,SING,N7,C21,no,N,56,,223189,5370,P11
57,,SING,N7,HN7,no,N,57,,223189,5370,P11
58,,SING,C21,C22,no,N,58,,223189,5370,P11
59,,SING,C21,H211,no,N,59,,223189,5370,P11
60,,SING,C21,H212,no,N,60,,223189,5370,P11
61,,SING,C22,C20,no,N,61,,223189,5370,P11
62,,SING,C22,H221,no,N,62,,223189,5370,P11
63,,SING,C22,H222,no,N,63,,223189,5370,P11
64,,DOUB,C20,O5,no,N,64,,223189,5370,P11
65,,SING,C20,N10,no,N,65,,223189,5370,P11
66,,SING,N10,C26,no,N,66,,223189,5370,P11
67,,SING,N10,H10N,no,N,67,,223189,5370,P11
68,,DOUB,C24,N13,yes,N,68,,223189,5370,P11
69,,SING,C24,N12,yes,N,69,,223189,5370,P11
70,,SING,C24,C23,no,N,70,,223189,5370,P11
71,,SING,N13,C26,yes,N,71,,223189,5370,P11
72,,DOUB,C26,C27,yes,N,72,,223189,5370,P11
73,,SING,C27,N12,yes,N,73,,223189,5370,P11
74,,SING,C27,H27,no,N,74,,223189,5370,P11
75,,SING,N12,C25,no,N,75,,223189,5370,P11
76,,SING,C25,H251,no,N,76,,223189,5370,P11
77,,SING,C25,H252,no,N,77,,223189,5370,P11
78,,SING,C25,H253,no,N,78,,223189,5370,P11
79,,DOUB,C23,O6,no,N,79,,223189,5370,P11
80,,SING,C23,N11,no,N,80,,223189,5370,P11
81,,SING,N11,C31,no,N,81,,223189,5370,P11
82,,SING,N11,H11N,no,N,82,,223189,5370,P11
83,,DOUB,C29,C30,yes,N,83,,223189,5370,P11
84,,SING,C29,N15,yes,N,84,,223189,5370,P11
85,,SING,C29,C28,no,N,85,,223189,5370,P11
86,,SING,C30,C31,yes,N,86,,223189,5370,P11
87,,SING,C30,H30,no,N,87,,223189,5370,P11
88,,DOUB,C31,C32,yes,N,88,,223189,5370,P11
89,,SING,C32,N15,yes,N,89,,223189,5370,P11
90,,SING,C32,H32,no,N,90,,223189,5370,P11
91,,SING,N15,C33,no,N,91,,223189,5370,P11
92,,SING,C33,H331,no,N,92,,223189,5370,P11
93,,SING,C33,H332,no,N,93,,223189,5370,P11
94,,SING,C33,H333,no,N,94,,223189,5370,P11
95,,DOUB,C28,O7,no,N,95,,223189,5370,P11
96,,SING,C28,N14,no,N,96,,223189,5370,P11
97,,SING,N14,C35,no,N,97,,223189,5370,P11
98,,SING,N14,H14N,no,N,98,,223189,5370,P11
99,,SING,C35,C36,no,N,99,,223189,5370,P11
100,,SING,C35,H351,no,N,100,,223189,5370,P11
101,,SING,C35,H352,no,N,101,,223189,5370,P11
102,,SING,C36,C34,no,N,102,,223189,5370,P11
103,,SING,C36,H361,no,N,103,,223189,5370,P11
104,,SING,C36,H362,no,N,104,,223189,5370,P11
105,,DOUB,C34,O8,no,N,105,,223189,5370,P11
106,,SING,C34,N16,no,N,106,,223189,5370,P11
107,,SING,N16,C37,no,N,107,,223189,5370,P11
108,,SING,N16,H16N,no,N,108,,223189,5370,P11
109,,SING,C37,C38,no,N,109,,223189,5370,P11
110,,SING,C37,H371,no,N,110,,223189,5370,P11
111,,SING,C37,H372,no,N,111,,223189,5370,P11
112,,SING,C38,C39,no,N,112,,223189,5370,P11
113,,SING,C38,H381,no,N,113,,223189,5370,P11
114,,SING,C38,H382,no,N,114,,223189,5370,P11
115,,SING,C39,N17,no,N,115,,223189,5370,P11
116,,SING,C39,H391,no,N,116,,223189,5370,P11
117,,SING,C39,H392,no,N,117,,223189,5370,P11
118,,SING,N17,C40,no,N,118,,223189,5370,P11
119,,SING,N17,C41,no,N,119,,223189,5370,P11
120,,SING,N17,H17N,no,N,120,,223189,5370,P11
121,,SING,C40,H401,no,N,121,,223189,5370,P11
122,,SING,C40,H402,no,N,122,,223189,5370,P11
123,,SING,C40,H403,no,N,123,,223189,5370,P11
124,,SING,C41,H411,no,N,124,,223189,5370,P11
125,,SING,C41,H412,no,N,125,,223189,5370,P11
126,,SING,C41,H413,no,N,126,,223189,5370,P11
1,,SING,FE,NA,no,N,1,,223228,5372,HEC
2,,SING,FE,NB,no,N,2,,223228,5372,HEC
3,,SING,FE,NC,no,N,3,,223228,5372,HEC
4,,SING,FE,ND,no,N,4,,223228,5372,HEC
5,,DOUB,CHA,C1A,no,N,5,,223228,5372,HEC
6,,SING,CHA,C4D,no,N,6,,223228,5372,HEC
7,,SING,CHA,HHA,no,N,7,,223228,5372,HEC
8,,DOUB,CHB,C4A,no,N,8,,223228,5372,HEC
9,,SING,CHB,C1B,no,N,9,,223228,5372,HEC
10,,SING,CHB,HHB,no,N,10,,223228,5372,HEC
11,,DOUB,CHC,C4B,no,N,11,,223228,5372,HEC
12,,SING,CHC,C1C,no,N,12,,223228,5372,HEC
13,,SING,CHC,HHC,no,N,13,,223228,5372,HEC
14,,DOUB,CHD,C4C,no,N,14,,223228,5372,HEC
15,,SING,CHD,C1D,no,N,15,,223228,5372,HEC
16,,SING,CHD,HHD,no,N,16,,223228,5372,HEC
17,,SING,NA,C1A,yes,N,17,,223228,5372,HEC
18,,SING,NA,C4A,yes,N,18,,223228,5372,HEC
19,,SING,C1A,C2A,yes,N,19,,223228,5372,HEC
20,,DOUB,C2A,C3A,yes,N,20,,223228,5372,HEC
21,,SING,C2A,CAA,no,N,21,,223228,5372,HEC
22,,SING,C3A,C4A,yes,N,22,,223228,5372,HEC
23,,SING,C3A,CMA,no,N,23,,223228,5372,HEC
24,,SING,CMA,HMA1,no,N,24,,223228,5372,HEC
25,,SING,CMA,HMA2,no,N,25,,223228,5372,HEC
26,,SING,CMA,HMA3,no,N,26,,223228,5372,HEC
27,,SING,CAA,CBA,no,N,27,,223228,5372,HEC
28,,SING,CAA,HAA1,no,N,28,,223228,5372,HEC
29,,SING,CAA,HAA2,no,N,29,,223228,5372,HEC
30,,SING,CBA,CGA,no,N,30,,223228,5372,HEC
31,,SING,CBA,HBA1,no,N,31,,223228,5372,HEC
32,,SING,CBA,HBA2,no,N,32,,223228,5372,HEC
33,,DOUB,CGA,O1A,no,N,33,,223228,5372,HEC
34,,SING,CGA,O2A,no,N,34,,223228,5372,HEC
35,,SING,O2A,H2A,no,N,35,,223228,5372,HEC
36,,SING,NB,C1B,yes,N,36,,223228,5372,HEC
37,,SING,NB,C4B,yes,N,37,,223228,5372,HEC
38,,DOUB,C1B,C2B,yes,N,38,,223228,5372,HEC
39,,SING,C2B,C3B,yes,N,39,,223228,5372,HEC
40,,SING,C2B,CMB,no,N,40,,223228,5372,HEC
41,,SING,C3B,C4B,yes,N,41,,223228,5372,HEC
42,,DOUB,C3B,CAB,no,E,42,,223228,5372,HEC
43,,SING,CMB,HMB1,no,N,43,,223228,5372,HEC
44,,SING,CMB,HMB2,no,N,44,,223228,5372,HEC
45,,SING,CMB,HMB3,no,N,45,,223228,5372,HEC
46,,SING,CAB,CBB,no,N,46,,223228,5372,HEC
47,,SING,CAB,HAB,no,N,47,,223228,5372,HEC
48,,SING,CBB,HBB1,no,N,48,,223228,5372,HEC
49,,SING,CBB,HBB2,no,N,49,,223228,5372,HEC
50,,SING,CBB,HBB3,no,N,50,,223228,5372,HEC
51,,SING,NC,C1C,yes,N,51,,223228,5372,HEC
52,,SING,NC,C4C,yes,N,52,,223228,5372,HEC
53,,DOUB,C1C,C2C,yes,N,53,,223228,5372,HEC
54,,SING,C2C,C3C,yes,N,54,,223228,5372,HEC
55,,SING,C2C,CMC,no,N,55,,223228,5372,HEC
56,,SING,C3C,C4C,yes,N,56,,223228,5372,HEC
57,,DOUB,C3C,CAC,no,E,57,,223228,5372,HEC
58,,SING,CMC,HMC1,no,N,58,,223228,5372,HEC
59,,SING,CMC,HMC2,no,N,59,,223228,5372,HEC
60,,SING,CMC,HMC3,no,N,60,,223228,5372,HEC
61,,SING,CAC,CBC,no,N,61,,223228,5372,HEC
62,,SING,CAC,HAC,no,N,62,,223228,5372,HEC
63,,SING,CBC,HBC1,no,N,63,,223228,5372,HEC
64,,SING,CBC,HBC2,no,N,64,,223228,5372,HEC
65,,SING,CBC,HBC3,no,N,65,,223228,5372,HEC
66,,SING,ND,C1D,yes,N,66,,223228,5372,HEC
67,,SING,ND,C4D,yes,N,67,,223228,5372,HEC
68,,DOUB,C1D,C2D,yes,N,68,,223228,5372,HEC
69,,SING,C2D,C3D,yes,N,69,,223228,5372,HEC
70,,SING,C2D,CMD,no,N,70,,223228,5372,HEC
71,,DOUB,C3D,C4D,yes,N,71,,223228,5372,HEC
72,,SING,C3D,CAD,no,N,72,,223228,5372,HEC
73,,SING,CMD,HMD1,no,N,73,,223228,5372,HEC
74,,SING,CMD,HMD2,no,N,74,,223228,5372,HEC
75,,SING,CMD,HMD3,no,N,75,,223228,5372,HEC
76,,SING,CAD,CBD,no,N,76,,223228,5372,HEC
77,,SING,CAD,HAD1,no,N,77,,223228,5372,HEC
78,,SING,CAD,HAD2,no,N,78,,223228,5372,HEC
79,,SING,CBD,CGD,no,N,79,,223228,5372,HEC
80,,SING,CBD,HBD1,no,N,80,,223228,5372,HEC
81,,SING,CBD,HBD2,no,N,81,,223228,5372,HEC
82,,DOUB,CGD,O1D,no,N,82,,223228,5372,HEC
83,,SING,CGD,O2D,no,N,83,,223228,5372,HEC
84,,SING,O2D,H2D,no,N,84,,223228,5372,HEC
1,,DOUB,C,O,no,N,1,,223332,5377,ACE
2,,SING,C,CH3,no,N,2,,223332,5377,ACE
3,,SING,C,H,no,N,3,,223332,5377,ACE
4,,SING,CH3,H1,no,N,4,,223332,5377,ACE
5,,SING,CH3,H2,no,N,5,,223332,5377,ACE
6,,SING,CH3,H3,no,N,6,,223332,5377,ACE
1,,SING,N,HN1,no,N,1,,223333,5377,NH2
2,,SING,N,HN2,no,N,2,,223333,5377,NH2
1,,SING,N,HN1,no,N,1,,223380,5379,NH2
2,,SING,N,HN2,no,N,2,,223380,5379,NH2
1,,SING,N,CN,no,N,1,,223442,5383,MLE
2,,SING,N,CA,no,N,2,,223442,5383,MLE
3,,SING,N,H,no,N,3,,223442,5383,MLE
4,,SING,CN,HN1,no,N,4,,223442,5383,MLE
5,,SING,CN,HN2,no,N,5,,223442,5383,MLE
6,,SING,CN,HN3,no,N,6,,223442,5383,MLE
7,,SING,CA,CB,no,N,7,,223442,5383,MLE
8,,SING,CA,C,no,N,8,,223442,5383,MLE
9,,SING,CA,HA,no,N,9,,223442,5383,MLE
10,,SING,CB,CG,no,N,10,,223442,5383,MLE
11,,SING,CB,HB2,no,N,11,,223442,5383,MLE
12,,SING,CB,HB3,no,N,12,,223442,5383,MLE
13,,SING,CG,CD1,no,N,13,,223442,5383,MLE
14,,SING,CG,CD2,no,N,14,,223442,5383,MLE
15,,SING,CG,HG,no,N,15,,223442,5383,MLE
16,,SING,CD1,HD11,no,N,16,,223442,5383,MLE
17,,SING,CD1,HD12,no,N,17,,223442,5383,MLE
18,,SING,CD1,HD13,no,N,18,,223442,5383,MLE
19,,SING,CD2,HD21,no,N,19,,223442,5383,MLE
20,,SING,CD2,HD22,no,N,20,,223442,5383,MLE
21,,SING,CD2,HD23,no,N,21,,223442,5383,MLE
22,,DOUB,C,O,no,N,22,,223442,5383,MLE
23,,SING,C,OXT,no,N,23,,223442,5383,MLE
24,,SING,OXT,HXT,no,N,24,,223442,5383,MLE
1,,SING,N,CA,no,N,1,,223457,5384,PCA
2,,SING,N,CD,no,N,2,,223457,5384,PCA
3,,SING,N,H,no,N,3,,223457,5384,PCA
4,,SING,CA,CB,no,N,4,,223457,5384,PCA
5,,SING,CA,C,no,N,5,,223457,5384,PCA
6,,SING,CA,HA,no,N,6,,223457,5384,PCA
7,,SING,CB,CG,no,N,7,,223457,5384,PCA
8,,SING,CB,HB2,no,N,8,,223457,5384,PCA
9,,SING,CB,HB3,no,N,9,,223457,5384,PCA
10,,SING,CG,CD,no,N,10,,223457,5384,PCA
11,,SING,CG,HG2,no,N,11,,223457,5384,PCA
12,,SING,CG,HG3,no,N,12,,223457,5384,PCA
13,,DOUB,CD,OE,no,N,13,,223457,5384,PCA
14,,DOUB,C,O,no,N,14,,223457,5384,PCA
15,,SING,C,OXT,no,N,15,,223457,5384,PCA
16,,SING,OXT,HXT,no,N,16,,223457,5384,PCA
1,,SING,C1,C2,no,N,1,,223489,5386,BEP
2,,SING,C1,O1,no,N,2,,223489,5386,BEP
3,,SING,C1,H11,no,N,3,,223489,5386,BEP
4,,SING,C1,H12,no,N,4,,223489,5386,BEP
5,,SING,C2,C3,no,N,5,,223489,5386,BEP
6,,SING,C2,N2,no,N,6,,223489,5386,BEP
7,,SING,C2,H21,no,N,7,,223489,5386,BEP
8,,SING,C3,N3,no,N,8,,223489,5386,BEP
9,,SING,C3,H31,no,N,9,,223489,5386,BEP
10,,SING,C3,H32,no,N,10,,223489,5386,BEP
11,,SING,O1,C4,no,N,11,,223489,5386,BEP
12,,SING,N2,C8,no,N,12,,223489,5386,BEP
13,,SING,N2,C11,no,N,13,,223489,5386,BEP
14,,SING,N3,C12,no,N,14,,223489,5386,BEP
15,,SING,N3,C19,no,N,15,,223489,5386,BEP
16,,SING,C4,C5,no,N,16,,223489,5386,BEP
17,,SING,C4,H41,no,N,17,,223489,5386,BEP
18,,SING,C4,H42,no,N,18,,223489,5386,BEP
19,,SING,C5,C6,no,N,19,,223489,5386,BEP
20,,SING,C5,C7,no,N,20,,223489,5386,BEP
21,,SING,C5,H51,no,N,21,,223489,5386,BEP
22,,SING,C6,H61,no,N,22,,223489,5386,BEP
23,,SING,C6,H62,no,N,23,,223489,5386,BEP
24,,SING,C6,H63,no,N,24,,223489,5386,BEP
25,,SING,C7,H71,no,N,25,,223489,5386,BEP
26,,SING,C7,H72,no,N,26,,223489,5386,BEP
27,,SING,C7,H73,no,N,27,,223489,5386,BEP
28,,SING,C8,C9,no,N,28,,223489,5386,BEP
29,,SING,C8,H81,no,N,29,,223489,5386,BEP
30,,SING,C8,H82,no,N,30,,223489,5386,BEP
31,,SING,C9,C10,no,N,31,,223489,5386,BEP
32,,SING,C9,H91,no,N,32,,223489,5386,BEP
33,,SING,C9,H92,no,N,33,,223489,5386,BEP
34,,SING,C10,C11,no,N,34,,223489,5386,BEP
35,,SING,C10,H101,no,N,35,,223489,5386,BEP
36,,SING,C10,H102,no,N,36,,223489,5386,BEP
37,,SING,C11,H111,no,N,37,,223489,5386,BEP
38,,SING,C11,H112,no,N,38,,223489,5386,BEP
39,,SING,C12,C13,no,N,39,,223489,5386,BEP
40,,SING,C12,H121,no,N,40,,223489,5386,BEP
41,,SING,C12,H122,no,N,41,,223489,5386,BEP
42,,DOUB,C13,C14,yes,N,42,,223489,5386,BEP
43,,SING,C13,C18,yes,N,43,,223489,5386,BEP
44,,SING,C14,C15,yes,N,44,,223489,5386,BEP
45,,SING,C14,H141,no,N,45,,223489,5386,BEP
46,,DOUB,C15,C16,yes,N,46,,223489,5386,BEP
47,,SING,C15,H151,no,N,47,,223489,5386,BEP
48,,SING,C16,C17,yes,N,48,,223489,5386,BEP
49,,SING,C16,H161,no,N,49,,223489,5386,BEP
50,,DOUB,C17,C18,yes,N,50,,223489,5386,BEP
51,,SING,C17,H171,no,N,51,,223489,5386,BEP
52,,SING,C18,H181,no,N,52,,223489,5386,BEP
53,,DOUB,C19,C20,yes,N,53,,223489,5386,BEP
54,,SING,C19,C24,yes,N,54,,223489,5386,BEP
55,,SING,C20,C21,yes,N,55,,223489,5386,BEP
56,,SING,C20,H201,no,N,56,,223489,5386,BEP
57,,DOUB,C21,C22,yes,N,57,,223489,5386,BEP
58,,SING,C21,H211,no,N,58,,223489,5386,BEP
59,,SING,C22,C23,yes,N,59,,223489,5386,BEP
60,,SING,C22,H221,no,N,60,,223489,5386,BEP
61,,DOUB,C23,C24,yes,N,61,,223489,5386,BEP
62,,SING,C23,H231,no,N,62,,223489,5386,BEP
63,,SING,C24,H241,no,N,63,,223489,5386,BEP
1,,SING,N1,C2,no,N,1,,223697,5394,PSU
2,,SING,N1,C6,no,N,2,,223697,5394,PSU
3,,SING,N1,HN1,no,N,3,,223697,5394,PSU
4,,SING,C2,N3,no,N,4,,223697,5394,PSU
5,,DOUB,C2,O2,no,N,5,,223697,5394,PSU
6,,SING,N3,C4,no,N,6,,223697,5394,PSU
7,,SING,N3,HN3,no,N,7,,223697,5394,PSU
8,,SING,C4,C5,no,N,8,,223697,5394,PSU
9,,DOUB,C4,O4,no,N,9,,223697,5394,PSU
10,,DOUB,C5,C6,no,N,10,,223697,5394,PSU
11,,SING,C5,C1',no,N,11,,223697,5394,PSU
12,,SING,C6,H6,no,N,12,,223697,5394,PSU
13,,SING,C1',C2',no,N,13,,223697,5394,PSU
14,,SING,C1',O4',no,N,14,,223697,5394,PSU
15,,SING,C1',H1',no,N,15,,223697,5394,PSU
16,,SING,C2',O2',no,N,16,,223697,5394,PSU
17,,SING,C2',C3',no,N,17,,223697,5394,PSU
18,,SING,C2',H2',no,N,18,,223697,5394,PSU
19,,SING,O2',HO2',no,N,19,,223697,5394,PSU
20,,SING,C3',C4',no,N,20,,223697,5394,PSU
21,,SING,C3',O3',no,N,21,,223697,5394,PSU
22,,SING,C3',H3',no,N,22,,223697,5394,PSU
23,,SING,C4',O4',no,N,23,,223697,5394,PSU
24,,SING,C4',C5',no,N,24,,223697,5394,PSU
25,,SING,C4',H4',no,N,25,,223697,5394,PSU
26,,SING,O3',HO3',no,N,26,,223697,5394,PSU
27,,SING,C5',O5',no,N,27,,223697,5394,PSU
28,,SING,C5',H5',no,N,28,,223697,5394,PSU
29,,SING,C5',H5'',no,N,29,,223697,5394,PSU
30,,SING,O5',P,no,N,30,,223697,5394,PSU
31,,DOUB,P,OP1,no,N,31,,223697,5394,PSU
32,,SING,P,OP2,no,N,32,,223697,5394,PSU
33,,SING,P,OP3,no,N,33,,223697,5394,PSU
34,,SING,OP2,HOP2,no,N,34,,223697,5394,PSU
35,,SING,OP3,HOP3,no,N,35,,223697,5394,PSU
1,,DOUB,PA,O1A,no,N,1,,223742,5396,NAP
2,,SING,PA,O2A,no,N,2,,223742,5396,NAP
3,,SING,PA,O5B,no,N,3,,223742,5396,NAP
4,,SING,PA,O3,no,N,4,,223742,5396,NAP
5,,SING,O2A,HOA2,no,N,5,,223742,5396,NAP
6,,SING,O5B,C5B,no,N,6,,223742,5396,NAP
7,,SING,C5B,C4B,no,N,7,,223742,5396,NAP
8,,SING,C5B,H51A,no,N,8,,223742,5396,NAP
9,,SING,C5B,H52A,no,N,9,,223742,5396,NAP
10,,SING,C4B,O4B,no,N,10,,223742,5396,NAP
11,,SING,C4B,C3B,no,N,11,,223742,5396,NAP
12,,SING,C4B,H4B,no,N,12,,223742,5396,NAP
13,,SING,O4B,C1B,no,N,13,,223742,5396,NAP
14,,SING,C3B,O3B,no,N,14,,223742,5396,NAP
15,,SING,C3B,C2B,no,N,15,,223742,5396,NAP
16,,SING,C3B,H3B,no,N,16,,223742,5396,NAP
17,,SING,O3B,HO3A,no,N,17,,223742,5396,NAP
18,,SING,C2B,O2B,no,N,18,,223742,5396,NAP
19,,SING,C2B,C1B,no,N,19,,223742,5396,NAP
20,,SING,C2B,H2B,no,N,20,,223742,5396,NAP
21,,SING,O2B,P2B,no,N,21,,223742,5396,NAP
22,,SING,C1B,N9A,no,N,22,,223742,5396,NAP
23,,SING,C1B,H1B,no,N,23,,223742,5396,NAP
24,,SING,N9A,C8A,yes,N,24,,223742,5396,NAP
25,,SING,N9A,C4A,yes,N,25,,223742,5396,NAP
26,,DOUB,C8A,N7A,yes,N,26,,223742,5396,NAP
27,,SING,C8A,H8A,no,N,27,,223742,5396,NAP
28,,SING,N7A,C5A,yes,N,28,,223742,5396,NAP
29,,SING,C5A,C6A,yes,N,29,,223742,5396,NAP
30,,DOUB,C5A,C4A,yes,N,30,,223742,5396,NAP
31,,SING,C6A,N6A,no,N,31,,223742,5396,NAP
32,,DOUB,C6A,N1A,yes,N,32,,223742,5396,NAP
33,,SING,N6A,H61A,no,N,33,,223742,5396,NAP
34,,SING,N6A,H62A,no,N,34,,223742,5396,NAP
35,,SING,N1A,C2A,yes,N,35,,223742,5396,NAP
36,,DOUB,C2A,N3A,yes,N,36,,223742,5396,NAP
37,,SING,C2A,H2A,no,N,37,,223742,5396,NAP
38,,SING,N3A,C4A,yes,N,38,,223742,5396,NAP
39,,SING,O3,PN,no,N,39,,223742,5396,NAP
40,,DOUB,PN,O1N,no,N,40,,223742,5396,NAP
41,,SING,PN,O2N,no,N,41,,223742,5396,NAP
42,,SING,PN,O5D,no,N,42,,223742,5396,NAP
43,,SING,O5D,C5D,no,N,43,,223742,5396,NAP
44,,SING,C5D,C4D,no,N,44,,223742,5396,NAP
45,,SING,C5D,H51N,no,N,45,,223742,5396,NAP
46,,SING,C5D,H52N,no,N,46,,223742,5396,NAP
47,,SING,C4D,O4D,no,N,47,,223742,5396,NAP
48,,SING,C4D,C3D,no,N,48,,223742,5396,NAP
49,,SING,C4D,H4D,no,N,49,,223742,5396,NAP
50,,SING,O4D,C1D,no,N,50,,223742,5396,NAP
51,,SING,C3D,O3D,no,N,51,,223742,5396,NAP
52,,SING,C3D,C2D,no,N,52,,223742,5396,NAP
53,,SING,C3D,H3D,no,N,53,,223742,5396,NAP
54,,SING,O3D,HO3N,no,N,54,,223742,5396,NAP
55,,SING,C2D,O2D,no,N,55,,223742,5396,NAP
56,,SING,C2D,C1D,no,N,56,,223742,5396,NAP
57,,SING,C2D,H2D,no,N,57,,223742,5396,NAP
58,,SING,O2D,HO2N,no,N,58,,223742,5396,NAP
59,,SING,C1D,N1N,no,N,59,,223742,5396,NAP
60,,SING,C1D,H1D,no,N,60,,223742,5396,NAP
61,,SING,N1N,C2N,yes,N,61,,223742,5396,NAP
62,,DOUB,N1N,C6N,yes,N,62,,223742,5396,NAP
63,,DOUB,C2N,C3N,yes,N,63,,223742,5396,NAP
64,,SING,C2N,H2N,no,N,64,,223742,5396,NAP
65,,SING,C3N,C7N,no,N,65,,223742,5396,NAP
66,,SING,C3N,C4N,yes,N,66,,223742,5396,NAP
67,,DOUB,C7N,O7N,no,N,67,,223742,5396,NAP
68,,SING,C7N,N7N,no,N,68,,223742,5396,NAP
69,,SING,N7N,H71N,no,N,69,,223742,5396,NAP
70,,SING,N7N,H72N,no,N,70,,223742,5396,NAP
71,,DOUB,C4N,C5N,yes,N,71,,223742,5396,NAP
72,,SING,C4N,H4N,no,N,72,,223742,5396,NAP
73,,SING,C5N,C6N,yes,N,73,,223742,5396,NAP
74,,SING,C5N,H5N,no,N,74,,223742,5396,NAP
75,,SING,C6N,H6N,no,N,75,,223742,5396,NAP
76,,DOUB,P2B,O1X,no,N,76,,223742,5396,NAP
77,,SING,P2B,O2X,no,N,77,,223742,5396,NAP
78,,SING,P2B,O3X,no,N,78,,223742,5396,NAP
79,,SING,O2X,HOP2,no,N,79,,223742,5396,NAP
80,,SING,O3X,HOP3,no,N,80,,223742,5396,NAP
1,,DOUB,C1,N2,yes,N,1,,223743,5396,TOP
2,,SING,C1,C8,yes,N,2,,223743,5396,TOP
3,,SING,C1,H1,no,N,3,,223743,5396,TOP
4,,SING,N2,C3,yes,N,4,,223743,5396,TOP
5,,SING,C3,N4,no,N,5,,223743,5396,TOP
6,,DOUB,C3,N5,yes,N,6,,223743,5396,TOP
7,,SING,N4,HN41,no,N,7,,223743,5396,TOP
8,,SING,N4,HN42,no,N,8,,223743,5396,TOP
9,,SING,N5,C6,yes,N,9,,223743,5396,TOP
10,,SING,C6,N7,no,N,10,,223743,5396,TOP
11,,DOUB,C6,C8,yes,N,11,,223743,5396,TOP
12,,SING,N7,HN71,no,N,12,,223743,5396,TOP
13,,SING,N7,HN72,no,N,13,,223743,5396,TOP
14,,SING,C8,C9,no,N,14,,223743,5396,TOP
15,,SING,C9,C10,no,N,15,,223743,5396,TOP
16,,SING,C9,H91,no,N,16,,223743,5396,TOP
17,,SING,C9,H92,no,N,17,,223743,5396,TOP
18,,DOUB,C10,C11,yes,N,18,,223743,5396,TOP
19,,SING,C10,C21,yes,N,19,,223743,5396,TOP
20,,SING,C11,C12,yes,N,20,,223743,5396,TOP
21,,SING,C11,H11,no,N,21,,223743,5396,TOP
22,,SING,C12,O13,no,N,22,,223743,5396,TOP
23,,DOUB,C12,C15,yes,N,23,,223743,5396,TOP
24,,SING,O13,C14,no,N,24,,223743,5396,TOP
25,,SING,C14,H141,no,N,25,,223743,5396,TOP
26,,SING,C14,H142,no,N,26,,223743,5396,TOP
27,,SING,C14,H143,no,N,27,,223743,5396,TOP
28,,SING,C15,O16,no,N,28,,223743,5396,TOP
29,,SING,C15,C18,yes,N,29,,223743,5396,TOP
30,,SING,O16,C17,no,N,30,,223743,5396,TOP
31,,SING,C17,H171,no,N,31,,223743,5396,TOP
32,,SING,C17,H172,no,N,32,,223743,5396,TOP
33,,SING,C17,H173,no,N,33,,223743,5396,TOP
34,,SING,C18,O19,no,N,34,,223743,5396,TOP
35,,DOUB,C18,C21,yes,N,35,,223743,5396,TOP
36,,SING,O19,C20,no,N,36,,223743,5396,TOP
37,,SING,C20,H201,no,N,37,,223743,5396,TOP
38,,SING,C20,H202,no,N,38,,223743,5396,TOP
39,,SING,C20,H203,no,N,39,,223743,5396,TOP
40,,SING,C21,H21,no,N,40,,223743,5396,TOP
1,,SING,N,CA,no,N,1,,223934,5403,TRP
2,,SING,N,H,no,N,2,,223934,5403,TRP
3,,SING,N,H2,no,N,3,,223934,5403,TRP
4,,SING,CA,C,no,N,4,,223934,5403,TRP
5,,SING,CA,CB,no,N,5,,223934,5403,TRP
6,,SING,CA,HA,no,N,6,,223934,5403,TRP
7,,DOUB,C,O,no,N,7,,223934,5403,TRP
8,,SING,C,OXT,no,N,8,,223934,5403,TRP
9,,SING,CB,CG,no,N,9,,223934,5403,TRP
10,,SING,CB,HB2,no,N,10,,223934,5403,TRP
11,,SING,CB,HB3,no,N,11,,223934,5403,TRP
12,,DOUB,CG,CD1,yes,N,12,,223934,5403,TRP
13,,SING,CG,CD2,yes,N,13,,223934,5403,TRP
14,,SING,CD1,NE1,yes,N,14,,223934,5403,TRP
15,,SING,CD1,HD1,no,N,15,,223934,5403,TRP
16,,DOUB,CD2,CE2,yes,N,16,,223934,5403,TRP
17,,SING,CD2,CE3,yes,N,17,,223934,5403,TRP
18,,SING,NE1,CE2,yes,N,18,,223934,5403,TRP
19,,SING,NE1,HE1,no,N,19,,223934,5403,TRP
20,,SING,CE2,CZ2,yes,N,20,,223934,5403,TRP
21,,DOUB,CE3,CZ3,yes,N,21,,223934,5403,TRP
22,,SING,CE3,HE3,no,N,22,,223934,5403,TRP
23,,DOUB,CZ2,CH2,yes,N,23,,223934,5403,TRP
24,,SING,CZ2,HZ2,no,N,24,,223934,5403,TRP
25,,SING,CZ3,CH2,yes,N,25,,223934,5403,TRP
26,,SING,CZ3,HZ3,no,N,26,,223934,5403,TRP
27,,SING,CH2,HH2,no,N,27,,223934,5403,TRP
28,,SING,OXT,HXT,no,N,28,,223934,5403,TRP
1,,SING,C5,C3,no,N,1,,223950,5404,BB2
2,,SING,C5,C6,no,N,2,,223950,5404,BB2
3,,SING,C5,H51,no,N,3,,223950,5404,BB2
4,,SING,C5,H52,no,N,4,,223950,5404,BB2
5,,DOUB,C3,O4,no,N,5,,223950,5404,BB2
6,,SING,C3,N1,no,N,6,,223950,5404,BB2
7,,SING,N1,O2,no,N,7,,223950,5404,BB2
8,,SING,N1,HN1,no,N,8,,223950,5404,BB2
9,,SING,O2,HO2,no,N,9,,223950,5404,BB2
10,,SING,C6,C12,no,N,10,,223950,5404,BB2
11,,SING,C6,C7,no,N,11,,223950,5404,BB2
12,,SING,C6,H6,no,N,12,,223950,5404,BB2
13,,DOUB,C12,O13,no,N,13,,223950,5404,BB2
14,,SING,C12,N14,no,N,14,,223950,5404,BB2
15,,SING,C7,C8,no,N,15,,223950,5404,BB2
16,,SING,C7,H71,no,N,16,,223950,5404,BB2
17,,SING,C7,H72,no,N,17,,223950,5404,BB2
18,,SING,C8,C9,no,N,18,,223950,5404,BB2
19,,SING,C8,H81,no,N,19,,223950,5404,BB2
20,,SING,C8,H82,no,N,20,,223950,5404,BB2
21,,SING,C9,C10,no,N,21,,223950,5404,BB2
22,,SING,C9,H91,no,N,22,,223950,5404,BB2
23,,SING,C9,H92,no,N,23,,223950,5404,BB2
24,,SING,C10,C11,no,N,24,,223950,5404,BB2
25,,SING,C10,H101,no,N,25,,223950,5404,BB2
26,,SING,C10,H102,no,N,26,,223950,5404,BB2
27,,SING,C11,H111,no,N,27,,223950,5404,BB2
28,,SING,C11,H112,no,N,28,,223950,5404,BB2
29,,SING,C11,H113,no,N,29,,223950,5404,BB2
30,,SING,N14,C15,no,N,30,,223950,5404,BB2
31,,SING,N14,H14,no,N,31,,223950,5404,BB2
32,,SING,C15,C16,no,N,32,,223950,5404,BB2
33,,SING,C15,C19,no,N,33,,223950,5404,BB2
34,,SING,C15,H15,no,N,34,,223950,5404,BB2
35,,SING,C16,C18,no,N,35,,223950,5404,BB2
36,,SING,C16,C17,no,N,36,,223950,5404,BB2
37,,SING,C16,H16,no,N,37,,223950,5404,BB2
38,,SING,C18,H181,no,N,38,,223950,5404,BB2
39,,SING,C18,H182,no,N,39,,223950,5404,BB2
40,,SING,C18,H183,no,N,40,,223950,5404,BB2
41,,SING,C17,H171,no,N,41,,223950,5404,BB2
42,,SING,C17,H172,no,N,42,,223950,5404,BB2
43,,SING,C17,H173,no,N,43,,223950,5404,BB2
44,,DOUB,C19,O20,no,N,44,,223950,5404,BB2
45,,SING,C19,N21,no,N,45,,223950,5404,BB2
46,,SING,N21,C22,no,N,46,,223950,5404,BB2
47,,SING,N21,C23,no,N,47,,223950,5404,BB2
48,,SING,C22,C25,no,N,48,,223950,5404,BB2
49,,SING,C22,C26,no,N,49,,223950,5404,BB2
50,,SING,C22,H22,no,N,50,,223950,5404,BB2
51,,SING,C23,C24,no,N,51,,223950,5404,BB2
52,,SING,C23,H231,no,N,52,,223950,5404,BB2
53,,SING,C23,H232,no,N,53,,223950,5404,BB2
54,,SING,C24,C25,no,N,54,,223950,5404,BB2
55,,SING,C24,H241,no,N,55,,223950,5404,BB2
56,,SING,C24,H242,no,N,56,,223950,5404,BB2
57,,SING,C25,H251,no,N,57,,223950,5404,BB2
58,,SING,C25,H252,no,N,58,,223950,5404,BB2
59,,SING,C26,O27,no,N,59,,223950,5404,BB2
60,,SING,C26,H261,no,N,60,,223950,5404,BB2
61,,SING,C26,H262,no,N,61,,223950,5404,BB2
62,,SING,O27,H27,no,N,62,,223950,5404,BB2
1,,SING,FE,NA,no,N,1,,224002,5406,HEC
2,,SING,FE,NB,no,N,2,,224002,5406,HEC
3,,SING,FE,NC,no,N,3,,224002,5406,HEC
4,,SING,FE,ND,no,N,4,,224002,5406,HEC
5,,DOUB,CHA,C1A,no,N,5,,224002,5406,HEC
6,,SING,CHA,C4D,no,N,6,,224002,5406,HEC
7,,SING,CHA,HHA,no,N,7,,224002,5406,HEC
8,,DOUB,CHB,C4A,no,N,8,,224002,5406,HEC
9,,SING,CHB,C1B,no,N,9,,224002,5406,HEC
10,,SING,CHB,HHB,no,N,10,,224002,5406,HEC
11,,DOUB,CHC,C4B,no,N,11,,224002,5406,HEC
12,,SING,CHC,C1C,no,N,12,,224002,5406,HEC
13,,SING,CHC,HHC,no,N,13,,224002,5406,HEC
14,,DOUB,CHD,C4C,no,N,14,,224002,5406,HEC
15,,SING,CHD,C1D,no,N,15,,224002,5406,HEC
16,,SING,CHD,HHD,no,N,16,,224002,5406,HEC
17,,SING,NA,C1A,yes,N,17,,224002,5406,HEC
18,,SING,NA,C4A,yes,N,18,,224002,5406,HEC
19,,SING,C1A,C2A,yes,N,19,,224002,5406,HEC
20,,DOUB,C2A,C3A,yes,N,20,,224002,5406,HEC
21,,SING,C2A,CAA,no,N,21,,224002,5406,HEC
22,,SING,C3A,C4A,yes,N,22,,224002,5406,HEC
23,,SING,C3A,CMA,no,N,23,,224002,5406,HEC
24,,SING,CMA,HMA1,no,N,24,,224002,5406,HEC
25,,SING,CMA,HMA2,no,N,25,,224002,5406,HEC
26,,SING,CMA,HMA3,no,N,26,,224002,5406,HEC
27,,SING,CAA,CBA,no,N,27,,224002,5406,HEC
28,,SING,CAA,HAA1,no,N,28,,224002,5406,HEC
29,,SING,CAA,HAA2,no,N,29,,224002,5406,HEC
30,,SING,CBA,CGA,no,N,30,,224002,5406,HEC
31,,SING,CBA,HBA1,no,N,31,,224002,5406,HEC
32,,SING,CBA,HBA2,no,N,32,,224002,5406,HEC
33,,DOUB,CGA,O1A,no,N,33,,224002,5406,HEC
34,,SING,CGA,O2A,no,N,34,,224002,5406,HEC
35,,SING,O2A,H2A,no,N,35,,224002,5406,HEC
36,,SING,NB,C1B,yes,N,36,,224002,5406,HEC
37,,SING,NB,C4B,yes,N,37,,224002,5406,HEC
38,,DOUB,C1B,C2B,yes,N,38,,224002,5406,HEC
39,,SING,C2B,C3B,yes,N,39,,224002,5406,HEC
40,,SING,C2B,CMB,no,N,40,,224002,5406,HEC
41,,SING,C3B,C4B,yes,N,41,,224002,5406,HEC
42,,DOUB,C3B,CAB,no,E,42,,224002,5406,HEC
43,,SING,CMB,HMB1,no,N,43,,224002,5406,HEC
44,,SING,CMB,HMB2,no,N,44,,224002,5406,HEC
45,,SING,CMB,HMB3,no,N,45,,224002,5406,HEC
46,,SING,CAB,CBB,no,N,46,,224002,5406,HEC
47,,SING,CAB,HAB,no,N,47,,224002,5406,HEC
48,,SING,CBB,HBB1,no,N,48,,224002,5406,HEC
49,,SING,CBB,HBB2,no,N,49,,224002,5406,HEC
50,,SING,CBB,HBB3,no,N,50,,224002,5406,HEC
51,,SING,NC,C1C,yes,N,51,,224002,5406,HEC
52,,SING,NC,C4C,yes,N,52,,224002,5406,HEC
53,,DOUB,C1C,C2C,yes,N,53,,224002,5406,HEC
54,,SING,C2C,C3C,yes,N,54,,224002,5406,HEC
55,,SING,C2C,CMC,no,N,55,,224002,5406,HEC
56,,SING,C3C,C4C,yes,N,56,,224002,5406,HEC
57,,DOUB,C3C,CAC,no,E,57,,224002,5406,HEC
58,,SING,CMC,HMC1,no,N,58,,224002,5406,HEC
59,,SING,CMC,HMC2,no,N,59,,224002,5406,HEC
60,,SING,CMC,HMC3,no,N,60,,224002,5406,HEC
61,,SING,CAC,CBC,no,N,61,,224002,5406,HEC
62,,SING,CAC,HAC,no,N,62,,224002,5406,HEC
63,,SING,CBC,HBC1,no,N,63,,224002,5406,HEC
64,,SING,CBC,HBC2,no,N,64,,224002,5406,HEC
65,,SING,CBC,HBC3,no,N,65,,224002,5406,HEC
66,,SING,ND,C1D,yes,N,66,,224002,5406,HEC
67,,SING,ND,C4D,yes,N,67,,224002,5406,HEC
68,,DOUB,C1D,C2D,yes,N,68,,224002,5406,HEC
69,,SING,C2D,C3D,yes,N,69,,224002,5406,HEC
70,,SING,C2D,CMD,no,N,70,,224002,5406,HEC
71,,DOUB,C3D,C4D,yes,N,71,,224002,5406,HEC
72,,SING,C3D,CAD,no,N,72,,224002,5406,HEC
73,,SING,CMD,HMD1,no,N,73,,224002,5406,HEC
74,,SING,CMD,HMD2,no,N,74,,224002,5406,HEC
75,,SING,CMD,HMD3,no,N,75,,224002,5406,HEC
76,,SING,CAD,CBD,no,N,76,,224002,5406,HEC
77,,SING,CAD,HAD1,no,N,77,,224002,5406,HEC
78,,SING,CAD,HAD2,no,N,78,,224002,5406,HEC
79,,SING,CBD,CGD,no,N,79,,224002,5406,HEC
80,,SING,CBD,HBD1,no,N,80,,224002,5406,HEC
81,,SING,CBD,HBD2,no,N,81,,224002,5406,HEC
82,,DOUB,CGD,O1D,no,N,82,,224002,5406,HEC
83,,SING,CGD,O2D,no,N,83,,224002,5406,HEC
84,,SING,O2D,H2D,no,N,84,,224002,5406,HEC
1,,SING,C1,C2,no,N,1,,224405,543,AAC
2,,SING,C1,O1,no,N,2,,224405,543,AAC
3,,DOUB,C1,O2,no,N,3,,224405,543,AAC
4,,SING,C2,N1,no,N,4,,224405,543,AAC
5,,SING,C2,HC21,no,N,5,,224405,543,AAC
6,,SING,C2,HC22,no,N,6,,224405,543,AAC
7,,SING,C3,C4,no,N,7,,224405,543,AAC
8,,SING,C3,N1,no,N,8,,224405,543,AAC
9,,DOUB,C3,O3,no,N,9,,224405,543,AAC
10,,SING,C4,HC41,no,N,10,,224405,543,AAC
11,,SING,C4,HC42,no,N,11,,224405,543,AAC
12,,SING,C4,HC43,no,N,12,,224405,543,AAC
13,,SING,N1,HN1,no,N,13,,224405,543,AAC
14,,SING,O1,HO1,no,N,14,,224405,543,AAC
1,,SING,FE,NA,no,N,1,,224406,543,HEC
2,,SING,FE,NB,no,N,2,,224406,543,HEC
3,,SING,FE,NC,no,N,3,,224406,543,HEC
4,,SING,FE,ND,no,N,4,,224406,543,HEC
5,,DOUB,CHA,C1A,no,N,5,,224406,543,HEC
6,,SING,CHA,C4D,no,N,6,,224406,543,HEC
7,,SING,CHA,HHA,no,N,7,,224406,543,HEC
8,,DOUB,CHB,C4A,no,N,8,,224406,543,HEC
9,,SING,CHB,C1B,no,N,9,,224406,543,HEC
10,,SING,CHB,HHB,no,N,10,,224406,543,HEC
11,,DOUB,CHC,C4B,no,N,11,,224406,543,HEC
12,,SING,CHC,C1C,no,N,12,,224406,543,HEC
13,,SING,CHC,HHC,no,N,13,,224406,543,HEC
14,,DOUB,CHD,C4C,no,N,14,,224406,543,HEC
15,,SING,CHD,C1D,no,N,15,,224406,543,HEC
16,,SING,CHD,HHD,no,N,16,,224406,543,HEC
17,,SING,NA,C1A,yes,N,17,,224406,543,HEC
18,,SING,NA,C4A,yes,N,18,,224406,543,HEC
19,,SING,C1A,C2A,yes,N,19,,224406,543,HEC
20,,DOUB,C2A,C3A,yes,N,20,,224406,543,HEC
21,,SING,C2A,CAA,no,N,21,,224406,543,HEC
22,,SING,C3A,C4A,yes,N,22,,224406,543,HEC
23,,SING,C3A,CMA,no,N,23,,224406,543,HEC
24,,SING,CMA,HMA1,no,N,24,,224406,543,HEC
25,,SING,CMA,HMA2,no,N,25,,224406,543,HEC
26,,SING,CMA,HMA3,no,N,26,,224406,543,HEC
27,,SING,CAA,CBA,no,N,27,,224406,543,HEC
28,,SING,CAA,HAA1,no,N,28,,224406,543,HEC
29,,SING,CAA,HAA2,no,N,29,,224406,543,HEC
30,,SING,CBA,CGA,no,N,30,,224406,543,HEC
31,,SING,CBA,HBA1,no,N,31,,224406,543,HEC
32,,SING,CBA,HBA2,no,N,32,,224406,543,HEC
33,,DOUB,CGA,O1A,no,N,33,,224406,543,HEC
34,,SING,CGA,O2A,no,N,34,,224406,543,HEC
35,,SING,O2A,H2A,no,N,35,,224406,543,HEC
36,,SING,NB,C1B,yes,N,36,,224406,543,HEC
37,,SING,NB,C4B,yes,N,37,,224406,543,HEC
38,,DOUB,C1B,C2B,yes,N,38,,224406,543,HEC
39,,SING,C2B,C3B,yes,N,39,,224406,543,HEC
40,,SING,C2B,CMB,no,N,40,,224406,543,HEC
41,,SING,C3B,C4B,yes,N,41,,224406,543,HEC
42,,DOUB,C3B,CAB,no,E,42,,224406,543,HEC
43,,SING,CMB,HMB1,no,N,43,,224406,543,HEC
44,,SING,CMB,HMB2,no,N,44,,224406,543,HEC
45,,SING,CMB,HMB3,no,N,45,,224406,543,HEC
46,,SING,CAB,CBB,no,N,46,,224406,543,HEC
47,,SING,CAB,HAB,no,N,47,,224406,543,HEC
48,,SING,CBB,HBB1,no,N,48,,224406,543,HEC
49,,SING,CBB,HBB2,no,N,49,,224406,543,HEC
50,,SING,CBB,HBB3,no,N,50,,224406,543,HEC
51,,SING,NC,C1C,yes,N,51,,224406,543,HEC
52,,SING,NC,C4C,yes,N,52,,224406,543,HEC
53,,DOUB,C1C,C2C,yes,N,53,,224406,543,HEC
54,,SING,C2C,C3C,yes,N,54,,224406,543,HEC
55,,SING,C2C,CMC,no,N,55,,224406,543,HEC
56,,SING,C3C,C4C,yes,N,56,,224406,543,HEC
57,,DOUB,C3C,CAC,no,E,57,,224406,543,HEC
58,,SING,CMC,HMC1,no,N,58,,224406,543,HEC
59,,SING,CMC,HMC2,no,N,59,,224406,543,HEC
60,,SING,CMC,HMC3,no,N,60,,224406,543,HEC
61,,SING,CAC,CBC,no,N,61,,224406,543,HEC
62,,SING,CAC,HAC,no,N,62,,224406,543,HEC
63,,SING,CBC,HBC1,no,N,63,,224406,543,HEC
64,,SING,CBC,HBC2,no,N,64,,224406,543,HEC
65,,SING,CBC,HBC3,no,N,65,,224406,543,HEC
66,,SING,ND,C1D,yes,N,66,,224406,543,HEC
67,,SING,ND,C4D,yes,N,67,,224406,543,HEC
68,,DOUB,C1D,C2D,yes,N,68,,224406,543,HEC
69,,SING,C2D,C3D,yes,N,69,,224406,543,HEC
70,,SING,C2D,CMD,no,N,70,,224406,543,HEC
71,,DOUB,C3D,C4D,yes,N,71,,224406,543,HEC
72,,SING,C3D,CAD,no,N,72,,224406,543,HEC
73,,SING,CMD,HMD1,no,N,73,,224406,543,HEC
74,,SING,CMD,HMD2,no,N,74,,224406,543,HEC
75,,SING,CMD,HMD3,no,N,75,,224406,543,HEC
76,,SING,CAD,CBD,no,N,76,,224406,543,HEC
77,,SING,CAD,HAD1,no,N,77,,224406,543,HEC
78,,SING,CAD,HAD2,no,N,78,,224406,543,HEC
79,,SING,CBD,CGD,no,N,79,,224406,543,HEC
80,,SING,CBD,HBD1,no,N,80,,224406,543,HEC
81,,SING,CBD,HBD2,no,N,81,,224406,543,HEC
82,,DOUB,CGD,O1D,no,N,82,,224406,543,HEC
83,,SING,CGD,O2D,no,N,83,,224406,543,HEC
84,,SING,O2D,H2D,no,N,84,,224406,543,HEC
1,,SING,C1,C2,no,N,1,,224561,544,AAC
2,,SING,C1,O1,no,N,2,,224561,544,AAC
3,,DOUB,C1,O2,no,N,3,,224561,544,AAC
4,,SING,C2,N1,no,N,4,,224561,544,AAC
5,,SING,C2,HC21,no,N,5,,224561,544,AAC
6,,SING,C2,HC22,no,N,6,,224561,544,AAC
7,,SING,C3,C4,no,N,7,,224561,544,AAC
8,,SING,C3,N1,no,N,8,,224561,544,AAC
9,,DOUB,C3,O3,no,N,9,,224561,544,AAC
10,,SING,C4,HC41,no,N,10,,224561,544,AAC
11,,SING,C4,HC42,no,N,11,,224561,544,AAC
12,,SING,C4,HC43,no,N,12,,224561,544,AAC
13,,SING,N1,HN1,no,N,13,,224561,544,AAC
14,,SING,O1,HO1,no,N,14,,224561,544,AAC
1,,SING,FE,NA,no,N,1,,224562,544,HEC
2,,SING,FE,NB,no,N,2,,224562,544,HEC
3,,SING,FE,NC,no,N,3,,224562,544,HEC
4,,SING,FE,ND,no,N,4,,224562,544,HEC
5,,DOUB,CHA,C1A,no,N,5,,224562,544,HEC
6,,SING,CHA,C4D,no,N,6,,224562,544,HEC
7,,SING,CHA,HHA,no,N,7,,224562,544,HEC
8,,DOUB,CHB,C4A,no,N,8,,224562,544,HEC
9,,SING,CHB,C1B,no,N,9,,224562,544,HEC
10,,SING,CHB,HHB,no,N,10,,224562,544,HEC
11,,DOUB,CHC,C4B,no,N,11,,224562,544,HEC
12,,SING,CHC,C1C,no,N,12,,224562,544,HEC
13,,SING,CHC,HHC,no,N,13,,224562,544,HEC
14,,DOUB,CHD,C4C,no,N,14,,224562,544,HEC
15,,SING,CHD,C1D,no,N,15,,224562,544,HEC
16,,SING,CHD,HHD,no,N,16,,224562,544,HEC
17,,SING,NA,C1A,yes,N,17,,224562,544,HEC
18,,SING,NA,C4A,yes,N,18,,224562,544,HEC
19,,SING,C1A,C2A,yes,N,19,,224562,544,HEC
20,,DOUB,C2A,C3A,yes,N,20,,224562,544,HEC
21,,SING,C2A,CAA,no,N,21,,224562,544,HEC
22,,SING,C3A,C4A,yes,N,22,,224562,544,HEC
23,,SING,C3A,CMA,no,N,23,,224562,544,HEC
24,,SING,CMA,HMA1,no,N,24,,224562,544,HEC
25,,SING,CMA,HMA2,no,N,25,,224562,544,HEC
26,,SING,CMA,HMA3,no,N,26,,224562,544,HEC
27,,SING,CAA,CBA,no,N,27,,224562,544,HEC
28,,SING,CAA,HAA1,no,N,28,,224562,544,HEC
29,,SING,CAA,HAA2,no,N,29,,224562,544,HEC
30,,SING,CBA,CGA,no,N,30,,224562,544,HEC
31,,SING,CBA,HBA1,no,N,31,,224562,544,HEC
32,,SING,CBA,HBA2,no,N,32,,224562,544,HEC
33,,DOUB,CGA,O1A,no,N,33,,224562,544,HEC
34,,SING,CGA,O2A,no,N,34,,224562,544,HEC
35,,SING,O2A,H2A,no,N,35,,224562,544,HEC
36,,SING,NB,C1B,yes,N,36,,224562,544,HEC
37,,SING,NB,C4B,yes,N,37,,224562,544,HEC
38,,DOUB,C1B,C2B,yes,N,38,,224562,544,HEC
39,,SING,C2B,C3B,yes,N,39,,224562,544,HEC
40,,SING,C2B,CMB,no,N,40,,224562,544,HEC
41,,SING,C3B,C4B,yes,N,41,,224562,544,HEC
42,,DOUB,C3B,CAB,no,E,42,,224562,544,HEC
43,,SING,CMB,HMB1,no,N,43,,224562,544,HEC
44,,SING,CMB,HMB2,no,N,44,,224562,544,HEC
45,,SING,CMB,HMB3,no,N,45,,224562,544,HEC
46,,SING,CAB,CBB,no,N,46,,224562,544,HEC
47,,SING,CAB,HAB,no,N,47,,224562,544,HEC
48,,SING,CBB,HBB1,no,N,48,,224562,544,HEC
49,,SING,CBB,HBB2,no,N,49,,224562,544,HEC
50,,SING,CBB,HBB3,no,N,50,,224562,544,HEC
51,,SING,NC,C1C,yes,N,51,,224562,544,HEC
52,,SING,NC,C4C,yes,N,52,,224562,544,HEC
53,,DOUB,C1C,C2C,yes,N,53,,224562,544,HEC
54,,SING,C2C,C3C,yes,N,54,,224562,544,HEC
55,,SING,C2C,CMC,no,N,55,,224562,544,HEC
56,,SING,C3C,C4C,yes,N,56,,224562,544,HEC
57,,DOUB,C3C,CAC,no,E,57,,224562,544,HEC
58,,SING,CMC,HMC1,no,N,58,,224562,544,HEC
59,,SING,CMC,HMC2,no,N,59,,224562,544,HEC
60,,SING,CMC,HMC3,no,N,60,,224562,544,HEC
61,,SING,CAC,CBC,no,N,61,,224562,544,HEC
62,,SING,CAC,HAC,no,N,62,,224562,544,HEC
63,,SING,CBC,HBC1,no,N,63,,224562,544,HEC
64,,SING,CBC,HBC2,no,N,64,,224562,544,HEC
65,,SING,CBC,HBC3,no,N,65,,224562,544,HEC
66,,SING,ND,C1D,yes,N,66,,224562,544,HEC
67,,SING,ND,C4D,yes,N,67,,224562,544,HEC
68,,DOUB,C1D,C2D,yes,N,68,,224562,544,HEC
69,,SING,C2D,C3D,yes,N,69,,224562,544,HEC
70,,SING,C2D,CMD,no,N,70,,224562,544,HEC
71,,DOUB,C3D,C4D,yes,N,71,,224562,544,HEC
72,,SING,C3D,CAD,no,N,72,,224562,544,HEC
73,,SING,CMD,HMD1,no,N,73,,224562,544,HEC
74,,SING,CMD,HMD2,no,N,74,,224562,544,HEC
75,,SING,CMD,HMD3,no,N,75,,224562,544,HEC
76,,SING,CAD,CBD,no,N,76,,224562,544,HEC
77,,SING,CAD,HAD1,no,N,77,,224562,544,HEC
78,,SING,CAD,HAD2,no,N,78,,224562,544,HEC
79,,SING,CBD,CGD,no,N,79,,224562,544,HEC
80,,SING,CBD,HBD1,no,N,80,,224562,544,HEC
81,,SING,CBD,HBD2,no,N,81,,224562,544,HEC
82,,DOUB,CGD,O1D,no,N,82,,224562,544,HEC
83,,SING,CGD,O2D,no,N,83,,224562,544,HEC
84,,SING,O2D,H2D,no,N,84,,224562,544,HEC
1,,SING,C1,C2,no,N,1,,224717,545,AAC
2,,SING,C1,O1,no,N,2,,224717,545,AAC
3,,DOUB,C1,O2,no,N,3,,224717,545,AAC
4,,SING,C2,N1,no,N,4,,224717,545,AAC
5,,SING,C2,HC21,no,N,5,,224717,545,AAC
6,,SING,C2,HC22,no,N,6,,224717,545,AAC
7,,SING,C3,C4,no,N,7,,224717,545,AAC
8,,SING,C3,N1,no,N,8,,224717,545,AAC
9,,DOUB,C3,O3,no,N,9,,224717,545,AAC
10,,SING,C4,HC41,no,N,10,,224717,545,AAC
11,,SING,C4,HC42,no,N,11,,224717,545,AAC
12,,SING,C4,HC43,no,N,12,,224717,545,AAC
13,,SING,N1,HN1,no,N,13,,224717,545,AAC
14,,SING,O1,HO1,no,N,14,,224717,545,AAC
1,,SING,FE,NA,no,N,1,,224718,545,HEC
2,,SING,FE,NB,no,N,2,,224718,545,HEC
3,,SING,FE,NC,no,N,3,,224718,545,HEC
4,,SING,FE,ND,no,N,4,,224718,545,HEC
5,,DOUB,CHA,C1A,no,N,5,,224718,545,HEC
6,,SING,CHA,C4D,no,N,6,,224718,545,HEC
7,,SING,CHA,HHA,no,N,7,,224718,545,HEC
8,,DOUB,CHB,C4A,no,N,8,,224718,545,HEC
9,,SING,CHB,C1B,no,N,9,,224718,545,HEC
10,,SING,CHB,HHB,no,N,10,,224718,545,HEC
11,,DOUB,CHC,C4B,no,N,11,,224718,545,HEC
12,,SING,CHC,C1C,no,N,12,,224718,545,HEC
13,,SING,CHC,HHC,no,N,13,,224718,545,HEC
14,,DOUB,CHD,C4C,no,N,14,,224718,545,HEC
15,,SING,CHD,C1D,no,N,15,,224718,545,HEC
16,,SING,CHD,HHD,no,N,16,,224718,545,HEC
17,,SING,NA,C1A,yes,N,17,,224718,545,HEC
18,,SING,NA,C4A,yes,N,18,,224718,545,HEC
19,,SING,C1A,C2A,yes,N,19,,224718,545,HEC
20,,DOUB,C2A,C3A,yes,N,20,,224718,545,HEC
21,,SING,C2A,CAA,no,N,21,,224718,545,HEC
22,,SING,C3A,C4A,yes,N,22,,224718,545,HEC
23,,SING,C3A,CMA,no,N,23,,224718,545,HEC
24,,SING,CMA,HMA1,no,N,24,,224718,545,HEC
25,,SING,CMA,HMA2,no,N,25,,224718,545,HEC
26,,SING,CMA,HMA3,no,N,26,,224718,545,HEC
27,,SING,CAA,CBA,no,N,27,,224718,545,HEC
28,,SING,CAA,HAA1,no,N,28,,224718,545,HEC
29,,SING,CAA,HAA2,no,N,29,,224718,545,HEC
30,,SING,CBA,CGA,no,N,30,,224718,545,HEC
31,,SING,CBA,HBA1,no,N,31,,224718,545,HEC
32,,SING,CBA,HBA2,no,N,32,,224718,545,HEC
33,,DOUB,CGA,O1A,no,N,33,,224718,545,HEC
34,,SING,CGA,O2A,no,N,34,,224718,545,HEC
35,,SING,O2A,H2A,no,N,35,,224718,545,HEC
36,,SING,NB,C1B,yes,N,36,,224718,545,HEC
37,,SING,NB,C4B,yes,N,37,,224718,545,HEC
38,,DOUB,C1B,C2B,yes,N,38,,224718,545,HEC
39,,SING,C2B,C3B,yes,N,39,,224718,545,HEC
40,,SING,C2B,CMB,no,N,40,,224718,545,HEC
41,,SING,C3B,C4B,yes,N,41,,224718,545,HEC
42,,DOUB,C3B,CAB,no,E,42,,224718,545,HEC
43,,SING,CMB,HMB1,no,N,43,,224718,545,HEC
44,,SING,CMB,HMB2,no,N,44,,224718,545,HEC
45,,SING,CMB,HMB3,no,N,45,,224718,545,HEC
46,,SING,CAB,CBB,no,N,46,,224718,545,HEC
47,,SING,CAB,HAB,no,N,47,,224718,545,HEC
48,,SING,CBB,HBB1,no,N,48,,224718,545,HEC
49,,SING,CBB,HBB2,no,N,49,,224718,545,HEC
50,,SING,CBB,HBB3,no,N,50,,224718,545,HEC
51,,SING,NC,C1C,yes,N,51,,224718,545,HEC
52,,SING,NC,C4C,yes,N,52,,224718,545,HEC
53,,DOUB,C1C,C2C,yes,N,53,,224718,545,HEC
54,,SING,C2C,C3C,yes,N,54,,224718,545,HEC
55,,SING,C2C,CMC,no,N,55,,224718,545,HEC
56,,SING,C3C,C4C,yes,N,56,,224718,545,HEC
57,,DOUB,C3C,CAC,no,E,57,,224718,545,HEC
58,,SING,CMC,HMC1,no,N,58,,224718,545,HEC
59,,SING,CMC,HMC2,no,N,59,,224718,545,HEC
60,,SING,CMC,HMC3,no,N,60,,224718,545,HEC
61,,SING,CAC,CBC,no,N,61,,224718,545,HEC
62,,SING,CAC,HAC,no,N,62,,224718,545,HEC
63,,SING,CBC,HBC1,no,N,63,,224718,545,HEC
64,,SING,CBC,HBC2,no,N,64,,224718,545,HEC
65,,SING,CBC,HBC3,no,N,65,,224718,545,HEC
66,,SING,ND,C1D,yes,N,66,,224718,545,HEC
67,,SING,ND,C4D,yes,N,67,,224718,545,HEC
68,,DOUB,C1D,C2D,yes,N,68,,224718,545,HEC
69,,SING,C2D,C3D,yes,N,69,,224718,545,HEC
70,,SING,C2D,CMD,no,N,70,,224718,545,HEC
71,,DOUB,C3D,C4D,yes,N,71,,224718,545,HEC
72,,SING,C3D,CAD,no,N,72,,224718,545,HEC
73,,SING,CMD,HMD1,no,N,73,,224718,545,HEC
74,,SING,CMD,HMD2,no,N,74,,224718,545,HEC
75,,SING,CMD,HMD3,no,N,75,,224718,545,HEC
76,,SING,CAD,CBD,no,N,76,,224718,545,HEC
77,,SING,CAD,HAD1,no,N,77,,224718,545,HEC
78,,SING,CAD,HAD2,no,N,78,,224718,545,HEC
79,,SING,CBD,CGD,no,N,79,,224718,545,HEC
80,,SING,CBD,HBD1,no,N,80,,224718,545,HEC
81,,SING,CBD,HBD2,no,N,81,,224718,545,HEC
82,,DOUB,CGD,O1D,no,N,82,,224718,545,HEC
83,,SING,CGD,O2D,no,N,83,,224718,545,HEC
84,,SING,O2D,H2D,no,N,84,,224718,545,HEC
1,,SING,C1,C2,no,N,1,,224907,546,AAC
2,,SING,C1,O1,no,N,2,,224907,546,AAC
3,,DOUB,C1,O2,no,N,3,,224907,546,AAC
4,,SING,C2,N1,no,N,4,,224907,546,AAC
5,,SING,C2,HC21,no,N,5,,224907,546,AAC
6,,SING,C2,HC22,no,N,6,,224907,546,AAC
7,,SING,C3,C4,no,N,7,,224907,546,AAC
8,,SING,C3,N1,no,N,8,,224907,546,AAC
9,,DOUB,C3,O3,no,N,9,,224907,546,AAC
10,,SING,C4,HC41,no,N,10,,224907,546,AAC
11,,SING,C4,HC42,no,N,11,,224907,546,AAC
12,,SING,C4,HC43,no,N,12,,224907,546,AAC
13,,SING,N1,HN1,no,N,13,,224907,546,AAC
14,,SING,O1,HO1,no,N,14,,224907,546,AAC
1,,SING,FE,NA,no,N,1,,224908,546,HEC
2,,SING,FE,NB,no,N,2,,224908,546,HEC
3,,SING,FE,NC,no,N,3,,224908,546,HEC
4,,SING,FE,ND,no,N,4,,224908,546,HEC
5,,DOUB,CHA,C1A,no,N,5,,224908,546,HEC
6,,SING,CHA,C4D,no,N,6,,224908,546,HEC
7,,SING,CHA,HHA,no,N,7,,224908,546,HEC
8,,DOUB,CHB,C4A,no,N,8,,224908,546,HEC
9,,SING,CHB,C1B,no,N,9,,224908,546,HEC
10,,SING,CHB,HHB,no,N,10,,224908,546,HEC
11,,DOUB,CHC,C4B,no,N,11,,224908,546,HEC
12,,SING,CHC,C1C,no,N,12,,224908,546,HEC
13,,SING,CHC,HHC,no,N,13,,224908,546,HEC
14,,DOUB,CHD,C4C,no,N,14,,224908,546,HEC
15,,SING,CHD,C1D,no,N,15,,224908,546,HEC
16,,SING,CHD,HHD,no,N,16,,224908,546,HEC
17,,SING,NA,C1A,yes,N,17,,224908,546,HEC
18,,SING,NA,C4A,yes,N,18,,224908,546,HEC
19,,SING,C1A,C2A,yes,N,19,,224908,546,HEC
20,,DOUB,C2A,C3A,yes,N,20,,224908,546,HEC
21,,SING,C2A,CAA,no,N,21,,224908,546,HEC
22,,SING,C3A,C4A,yes,N,22,,224908,546,HEC
23,,SING,C3A,CMA,no,N,23,,224908,546,HEC
24,,SING,CMA,HMA1,no,N,24,,224908,546,HEC
25,,SING,CMA,HMA2,no,N,25,,224908,546,HEC
26,,SING,CMA,HMA3,no,N,26,,224908,546,HEC
27,,SING,CAA,CBA,no,N,27,,224908,546,HEC
28,,SING,CAA,HAA1,no,N,28,,224908,546,HEC
29,,SING,CAA,HAA2,no,N,29,,224908,546,HEC
30,,SING,CBA,CGA,no,N,30,,224908,546,HEC
31,,SING,CBA,HBA1,no,N,31,,224908,546,HEC
32,,SING,CBA,HBA2,no,N,32,,224908,546,HEC
33,,DOUB,CGA,O1A,no,N,33,,224908,546,HEC
34,,SING,CGA,O2A,no,N,34,,224908,546,HEC
35,,SING,O2A,H2A,no,N,35,,224908,546,HEC
36,,SING,NB,C1B,yes,N,36,,224908,546,HEC
37,,SING,NB,C4B,yes,N,37,,224908,546,HEC
38,,DOUB,C1B,C2B,yes,N,38,,224908,546,HEC
39,,SING,C2B,C3B,yes,N,39,,224908,546,HEC
40,,SING,C2B,CMB,no,N,40,,224908,546,HEC
41,,SING,C3B,C4B,yes,N,41,,224908,546,HEC
42,,DOUB,C3B,CAB,no,E,42,,224908,546,HEC
43,,SING,CMB,HMB1,no,N,43,,224908,546,HEC
44,,SING,CMB,HMB2,no,N,44,,224908,546,HEC
45,,SING,CMB,HMB3,no,N,45,,224908,546,HEC
46,,SING,CAB,CBB,no,N,46,,224908,546,HEC
47,,SING,CAB,HAB,no,N,47,,224908,546,HEC
48,,SING,CBB,HBB1,no,N,48,,224908,546,HEC
49,,SING,CBB,HBB2,no,N,49,,224908,546,HEC
50,,SING,CBB,HBB3,no,N,50,,224908,546,HEC
51,,SING,NC,C1C,yes,N,51,,224908,546,HEC
52,,SING,NC,C4C,yes,N,52,,224908,546,HEC
53,,DOUB,C1C,C2C,yes,N,53,,224908,546,HEC
54,,SING,C2C,C3C,yes,N,54,,224908,546,HEC
55,,SING,C2C,CMC,no,N,55,,224908,546,HEC
56,,SING,C3C,C4C,yes,N,56,,224908,546,HEC
57,,DOUB,C3C,CAC,no,E,57,,224908,546,HEC
58,,SING,CMC,HMC1,no,N,58,,224908,546,HEC
59,,SING,CMC,HMC2,no,N,59,,224908,546,HEC
60,,SING,CMC,HMC3,no,N,60,,224908,546,HEC
61,,SING,CAC,CBC,no,N,61,,224908,546,HEC
62,,SING,CAC,HAC,no,N,62,,224908,546,HEC
63,,SING,CBC,HBC1,no,N,63,,224908,546,HEC
64,,SING,CBC,HBC2,no,N,64,,224908,546,HEC
65,,SING,CBC,HBC3,no,N,65,,224908,546,HEC
66,,SING,ND,C1D,yes,N,66,,224908,546,HEC
67,,SING,ND,C4D,yes,N,67,,224908,546,HEC
68,,DOUB,C1D,C2D,yes,N,68,,224908,546,HEC
69,,SING,C2D,C3D,yes,N,69,,224908,546,HEC
70,,SING,C2D,CMD,no,N,70,,224908,546,HEC
71,,DOUB,C3D,C4D,yes,N,71,,224908,546,HEC
72,,SING,C3D,CAD,no,N,72,,224908,546,HEC
73,,SING,CMD,HMD1,no,N,73,,224908,546,HEC
74,,SING,CMD,HMD2,no,N,74,,224908,546,HEC
75,,SING,CMD,HMD3,no,N,75,,224908,546,HEC
76,,SING,CAD,CBD,no,N,76,,224908,546,HEC
77,,SING,CAD,HAD1,no,N,77,,224908,546,HEC
78,,SING,CAD,HAD2,no,N,78,,224908,546,HEC
79,,SING,CBD,CGD,no,N,79,,224908,546,HEC
80,,SING,CBD,HBD1,no,N,80,,224908,546,HEC
81,,SING,CBD,HBD2,no,N,81,,224908,546,HEC
82,,DOUB,CGD,O1D,no,N,82,,224908,546,HEC
83,,SING,CGD,O2D,no,N,83,,224908,546,HEC
84,,SING,O2D,H2D,no,N,84,,224908,546,HEC
1,,SING,CHA,C1A,yes,N,1,,225037,5466,HEM
2,,DOUB,CHA,C4D,yes,N,2,,225037,5466,HEM
3,,SING,CHA,HHA,no,N,3,,225037,5466,HEM
4,,SING,CHB,C4A,yes,N,4,,225037,5466,HEM
5,,DOUB,CHB,C1B,yes,N,5,,225037,5466,HEM
6,,SING,CHB,HHB,no,N,6,,225037,5466,HEM
7,,SING,CHC,C4B,yes,N,7,,225037,5466,HEM
8,,DOUB,CHC,C1C,yes,N,8,,225037,5466,HEM
9,,SING,CHC,HHC,no,N,9,,225037,5466,HEM
10,,DOUB,CHD,C4C,yes,N,10,,225037,5466,HEM
11,,SING,CHD,C1D,yes,N,11,,225037,5466,HEM
12,,SING,CHD,HHD,no,N,12,,225037,5466,HEM
13,,DOUB,C1A,C2A,yes,N,13,,225037,5466,HEM
14,,SING,C1A,NA,yes,N,14,,225037,5466,HEM
15,,SING,C2A,C3A,yes,N,15,,225037,5466,HEM
16,,SING,C2A,CAA,no,N,16,,225037,5466,HEM
17,,DOUB,C3A,C4A,yes,N,17,,225037,5466,HEM
18,,SING,C3A,CMA,no,N,18,,225037,5466,HEM
19,,SING,C4A,NA,yes,N,19,,225037,5466,HEM
20,,SING,CMA,HMA,no,N,20,,225037,5466,HEM
21,,SING,CMA,HMAA,no,N,21,,225037,5466,HEM
22,,SING,CMA,HMAB,no,N,22,,225037,5466,HEM
23,,SING,CAA,CBA,no,N,23,,225037,5466,HEM
24,,SING,CAA,HAA,no,N,24,,225037,5466,HEM
25,,SING,CAA,HAAA,no,N,25,,225037,5466,HEM
26,,SING,CBA,CGA,no,N,26,,225037,5466,HEM
27,,SING,CBA,HBA,no,N,27,,225037,5466,HEM
28,,SING,CBA,HBAA,no,N,28,,225037,5466,HEM
29,,DOUB,CGA,O1A,no,N,29,,225037,5466,HEM
30,,SING,CGA,O2A,no,N,30,,225037,5466,HEM
31,,SING,C1B,C2B,no,N,31,,225037,5466,HEM
32,,SING,C1B,NB,yes,N,32,,225037,5466,HEM
33,,DOUB,C2B,C3B,yes,N,33,,225037,5466,HEM
34,,SING,C2B,CMB,yes,N,34,,225037,5466,HEM
35,,SING,C3B,C4B,no,N,35,,225037,5466,HEM
36,,SING,C3B,CAB,yes,N,36,,225037,5466,HEM
37,,DOUB,C4B,NB,no,N,37,,225037,5466,HEM
38,,SING,CMB,HMB,yes,N,38,,225037,5466,HEM
39,,SING,CMB,HMBA,no,N,39,,225037,5466,HEM
40,,SING,CMB,HMBB,no,N,40,,225037,5466,HEM
41,,DOUB,CAB,CBB,no,N,41,,225037,5466,HEM
42,,SING,CAB,HAB,no,N,42,,225037,5466,HEM
43,,SING,CBB,HBB,no,N,43,,225037,5466,HEM
44,,SING,CBB,HBBA,no,N,44,,225037,5466,HEM
45,,SING,C1C,C2C,no,N,45,,225037,5466,HEM
46,,SING,C1C,NC,yes,N,46,,225037,5466,HEM
47,,DOUB,C2C,C3C,yes,N,47,,225037,5466,HEM
48,,SING,C2C,CMC,yes,N,48,,225037,5466,HEM
49,,SING,C3C,C4C,no,N,49,,225037,5466,HEM
50,,SING,C3C,CAC,yes,N,50,,225037,5466,HEM
51,,SING,C4C,NC,no,N,51,,225037,5466,HEM
52,,SING,CMC,HMC,yes,N,52,,225037,5466,HEM
53,,SING,CMC,HMCA,no,N,53,,225037,5466,HEM
54,,SING,CMC,HMCB,no,N,54,,225037,5466,HEM
55,,DOUB,CAC,CBC,no,N,55,,225037,5466,HEM
56,,SING,CAC,HAC,no,N,56,,225037,5466,HEM
57,,SING,CBC,HBC,no,N,57,,225037,5466,HEM
58,,SING,CBC,HBCA,no,N,58,,225037,5466,HEM
59,,SING,C1D,C2D,no,N,59,,225037,5466,HEM
60,,DOUB,C1D,ND,yes,N,60,,225037,5466,HEM
61,,DOUB,C2D,C3D,yes,N,61,,225037,5466,HEM
62,,SING,C2D,CMD,yes,N,62,,225037,5466,HEM
63,,SING,C3D,C4D,no,N,63,,225037,5466,HEM
64,,SING,C3D,CAD,yes,N,64,,225037,5466,HEM
65,,SING,C4D,ND,no,N,65,,225037,5466,HEM
66,,SING,CMD,HMD,yes,N,66,,225037,5466,HEM
67,,SING,CMD,HMDA,no,N,67,,225037,5466,HEM
68,,SING,CMD,HMDB,no,N,68,,225037,5466,HEM
69,,SING,CAD,CBD,no,N,69,,225037,5466,HEM
70,,SING,CAD,HAD,no,N,70,,225037,5466,HEM
71,,SING,CAD,HADA,no,N,71,,225037,5466,HEM
72,,SING,CBD,CGD,no,N,72,,225037,5466,HEM
73,,SING,CBD,HBD,no,N,73,,225037,5466,HEM
74,,SING,CBD,HBDA,no,N,74,,225037,5466,HEM
75,,DOUB,CGD,O1D,no,N,75,,225037,5466,HEM
76,,SING,CGD,O2D,no,N,76,,225037,5466,HEM
77,,SING,O2A,H2A,no,N,77,,225037,5466,HEM
78,,SING,O2D,H2D,no,N,78,,225037,5466,HEM
79,,SING,FE,NA,no,N,79,,225037,5466,HEM
80,,SING,FE,NB,no,N,80,,225037,5466,HEM
81,,SING,FE,NC,no,N,81,,225037,5466,HEM
82,,SING,FE,ND,no,N,82,,225037,5466,HEM
1,,SING,N,CA,no,N,1,,225330,548,TYC
2,,SING,N,H0,no,N,2,,225330,548,TYC
3,,SING,N,H,no,N,3,,225330,548,TYC
4,,SING,CA,C,no,N,4,,225330,548,TYC
5,,SING,CA,CB,no,N,5,,225330,548,TYC
6,,SING,CA,HA,no,N,6,,225330,548,TYC
7,,DOUB,C,O,no,N,7,,225330,548,TYC
8,,SING,C,NXT,no,N,8,,225330,548,TYC
9,,SING,CB,CG,no,N,9,,225330,548,TYC
10,,SING,CB,HB1,no,N,10,,225330,548,TYC
11,,SING,CB,HB2,no,N,11,,225330,548,TYC
12,,DOUB,CG,CD1,yes,N,12,,225330,548,TYC
13,,SING,CG,CD2,yes,N,13,,225330,548,TYC
14,,SING,CD1,CE1,yes,N,14,,225330,548,TYC
15,,SING,CD1,HD1,no,N,15,,225330,548,TYC
16,,DOUB,CD2,CE2,yes,N,16,,225330,548,TYC
17,,SING,CD2,HD2,no,N,17,,225330,548,TYC
18,,DOUB,CE1,CZ,yes,N,18,,225330,548,TYC
19,,SING,CE1,HE1,no,N,19,,225330,548,TYC
20,,SING,CE2,CZ,yes,N,20,,225330,548,TYC
21,,SING,CE2,HE2,no,N,21,,225330,548,TYC
22,,SING,OH,CZ,no,N,22,,225330,548,TYC
23,,SING,OH,HH,no,N,23,,225330,548,TYC
24,,SING,NXT,HT21,no,N,24,,225330,548,TYC
25,,SING,NXT,HT22,no,N,25,,225330,548,TYC
1,,DOUB,PB,O1B,no,N,1,,226045,5511,GDP
2,,SING,PB,O2B,no,N,2,,226045,5511,GDP
3,,SING,PB,O3B,no,N,3,,226045,5511,GDP
4,,SING,PB,O3A,no,N,4,,226045,5511,GDP
5,,SING,O2B,HOB2,no,N,5,,226045,5511,GDP
6,,SING,O3B,HOB3,no,N,6,,226045,5511,GDP
7,,SING,O3A,PA,no,N,7,,226045,5511,GDP
8,,DOUB,PA,O1A,no,N,8,,226045,5511,GDP
9,,SING,PA,O2A,no,N,9,,226045,5511,GDP
10,,SING,PA,O5',no,N,10,,226045,5511,GDP
11,,SING,O2A,HOA2,no,N,11,,226045,5511,GDP
12,,SING,O5',C5',no,N,12,,226045,5511,GDP
13,,SING,C5',C4',no,N,13,,226045,5511,GDP
14,,SING,C5',H5',no,N,14,,226045,5511,GDP
15,,SING,C5',H5'',no,N,15,,226045,5511,GDP
16,,SING,C4',O4',no,N,16,,226045,5511,GDP
17,,SING,C4',C3',no,N,17,,226045,5511,GDP
18,,SING,C4',H4',no,N,18,,226045,5511,GDP
19,,SING,O4',C1',no,N,19,,226045,5511,GDP
20,,SING,C3',O3',no,N,20,,226045,5511,GDP
21,,SING,C3',C2',no,N,21,,226045,5511,GDP
22,,SING,C3',H3',no,N,22,,226045,5511,GDP
23,,SING,O3',HO3',no,N,23,,226045,5511,GDP
24,,SING,C2',O2',no,N,24,,226045,5511,GDP
25,,SING,C2',C1',no,N,25,,226045,5511,GDP
26,,SING,C2',H2',no,N,26,,226045,5511,GDP
27,,SING,O2',HO2',no,N,27,,226045,5511,GDP
28,,SING,C1',N9,no,N,28,,226045,5511,GDP
29,,SING,C1',H1',no,N,29,,226045,5511,GDP
30,,SING,N9,C8,yes,N,30,,226045,5511,GDP
31,,SING,N9,C4,yes,N,31,,226045,5511,GDP
32,,DOUB,C8,N7,yes,N,32,,226045,5511,GDP
33,,SING,C8,H8,no,N,33,,226045,5511,GDP
34,,SING,N7,C5,yes,N,34,,226045,5511,GDP
35,,SING,C5,C6,no,N,35,,226045,5511,GDP
36,,DOUB,C5,C4,yes,N,36,,226045,5511,GDP
37,,DOUB,C6,O6,no,N,37,,226045,5511,GDP
38,,SING,C6,N1,no,N,38,,226045,5511,GDP
39,,SING,N1,C2,no,N,39,,226045,5511,GDP
40,,SING,N1,HN1,no,N,40,,226045,5511,GDP
41,,SING,C2,N2,no,N,41,,226045,5511,GDP
42,,DOUB,C2,N3,no,N,42,,226045,5511,GDP
43,,SING,N2,HN21,no,N,43,,226045,5511,GDP
44,,SING,N2,HN22,no,N,44,,226045,5511,GDP
45,,SING,N3,C4,no,N,45,,226045,5511,GDP
1,,SING,N1,C2,no,N,1,,226530,5530,OMC
2,,SING,N1,C6,no,N,2,,226530,5530,OMC
3,,SING,N1,C1',no,N,3,,226530,5530,OMC
4,,SING,C2,N3,no,N,4,,226530,5530,OMC
5,,DOUB,C2,O2,no,N,5,,226530,5530,OMC
6,,DOUB,N3,C4,no,N,6,,226530,5530,OMC
7,,SING,C4,C5,no,N,7,,226530,5530,OMC
8,,SING,C4,N4,no,N,8,,226530,5530,OMC
9,,DOUB,C5,C6,no,N,9,,226530,5530,OMC
10,,SING,C5,H5,no,N,10,,226530,5530,OMC
11,,SING,C6,H6,no,N,11,,226530,5530,OMC
12,,SING,N4,HN41,no,N,12,,226530,5530,OMC
13,,SING,N4,HN42,no,N,13,,226530,5530,OMC
14,,SING,C1',C2',no,N,14,,226530,5530,OMC
15,,SING,C1',O4',no,N,15,,226530,5530,OMC
16,,SING,C1',H1',no,N,16,,226530,5530,OMC
17,,SING,C2',O2',no,N,17,,226530,5530,OMC
18,,SING,C2',C3',no,N,18,,226530,5530,OMC
19,,SING,C2',H2',no,N,19,,226530,5530,OMC
20,,SING,O2',CM2,no,N,20,,226530,5530,OMC
21,,SING,CM2,HM21,no,N,21,,226530,5530,OMC
22,,SING,CM2,HM22,no,N,22,,226530,5530,OMC
23,,SING,CM2,HM23,no,N,23,,226530,5530,OMC
24,,SING,C3',C4',no,N,24,,226530,5530,OMC
25,,SING,C3',O3',no,N,25,,226530,5530,OMC
26,,SING,C3',H3',no,N,26,,226530,5530,OMC
27,,SING,C4',O4',no,N,27,,226530,5530,OMC
28,,SING,C4',C5',no,N,28,,226530,5530,OMC
29,,SING,C4',H4',no,N,29,,226530,5530,OMC
30,,SING,O3',HO3',no,N,30,,226530,5530,OMC
31,,SING,C5',O5',no,N,31,,226530,5530,OMC
32,,SING,C5',H5',no,N,32,,226530,5530,OMC
33,,SING,C5',H5'',no,N,33,,226530,5530,OMC
34,,SING,O5',P,no,N,34,,226530,5530,OMC
35,,DOUB,P,OP1,no,N,35,,226530,5530,OMC
36,,SING,P,OP2,no,N,36,,226530,5530,OMC
37,,SING,P,OP3,no,N,37,,226530,5530,OMC
38,,SING,OP2,HOP2,no,N,38,,226530,5530,OMC
39,,SING,OP3,HOP3,no,N,39,,226530,5530,OMC
1,,DOUB,P,OP1,no,N,1,,226531,5530,OMG
2,,SING,P,OP2,no,N,2,,226531,5530,OMG
3,,SING,P,OP3,no,N,3,,226531,5530,OMG
4,,SING,P,O5',no,N,4,,226531,5530,OMG
5,,SING,OP2,HOP2,no,N,5,,226531,5530,OMG
6,,SING,OP3,HOP3,no,N,6,,226531,5530,OMG
7,,SING,O5',C5',no,N,7,,226531,5530,OMG
8,,SING,C5',C4',no,N,8,,226531,5530,OMG
9,,SING,C5',H5',no,N,9,,226531,5530,OMG
10,,SING,C5',H5'',no,N,10,,226531,5530,OMG
11,,SING,C4',O4',no,N,11,,226531,5530,OMG
12,,SING,C4',C3',no,N,12,,226531,5530,OMG
13,,SING,C4',H4',no,N,13,,226531,5530,OMG
14,,SING,O4',C1',no,N,14,,226531,5530,OMG
15,,SING,C3',O3',no,N,15,,226531,5530,OMG
16,,SING,C3',C2',no,N,16,,226531,5530,OMG
17,,SING,C3',H3',no,N,17,,226531,5530,OMG
18,,SING,O3',HO3',no,N,18,,226531,5530,OMG
19,,SING,C2',O2',no,N,19,,226531,5530,OMG
20,,SING,C2',C1',no,N,20,,226531,5530,OMG
21,,SING,C2',H2',no,N,21,,226531,5530,OMG
22,,SING,O2',CM2,no,N,22,,226531,5530,OMG
23,,SING,CM2,HM21,no,N,23,,226531,5530,OMG
24,,SING,CM2,HM22,no,N,24,,226531,5530,OMG
25,,SING,CM2,HM23,no,N,25,,226531,5530,OMG
26,,SING,C1',N9,no,N,26,,226531,5530,OMG
27,,SING,C1',H1',no,N,27,,226531,5530,OMG
28,,SING,N9,C8,yes,N,28,,226531,5530,OMG
29,,SING,N9,C4,yes,N,29,,226531,5530,OMG
30,,DOUB,C8,N7,yes,N,30,,226531,5530,OMG
31,,SING,C8,H8,no,N,31,,226531,5530,OMG
32,,SING,N7,C5,yes,N,32,,226531,5530,OMG
33,,SING,C5,C6,no,N,33,,226531,5530,OMG
34,,DOUB,C5,C4,yes,N,34,,226531,5530,OMG
35,,DOUB,C6,O6,no,N,35,,226531,5530,OMG
36,,SING,C6,N1,no,N,36,,226531,5530,OMG
37,,SING,N1,C2,no,N,37,,226531,5530,OMG
38,,SING,N1,HN1,no,N,38,,226531,5530,OMG
39,,SING,C2,N2,no,N,39,,226531,5530,OMG
40,,DOUB,C2,N3,no,N,40,,226531,5530,OMG
41,,SING,N2,HN21,no,N,41,,226531,5530,OMG
42,,SING,N2,HN22,no,N,42,,226531,5530,OMG
43,,SING,N3,C4,no,N,43,,226531,5530,OMG
1,,DOUB,P,OP1,no,N,1,,226532,5530,5MC
2,,SING,P,OP2,no,N,2,,226532,5530,5MC
3,,SING,P,OP3,no,N,3,,226532,5530,5MC
4,,SING,P,O5',no,N,4,,226532,5530,5MC
5,,SING,OP2,HOP2,no,N,5,,226532,5530,5MC
6,,SING,OP3,HOP3,no,N,6,,226532,5530,5MC
7,,SING,O5',C5',no,N,7,,226532,5530,5MC
8,,SING,C5',C4',no,N,8,,226532,5530,5MC
9,,SING,C5',H5',no,N,9,,226532,5530,5MC
10,,SING,C5',H5'',no,N,10,,226532,5530,5MC
11,,SING,C4',O4',no,N,11,,226532,5530,5MC
12,,SING,C4',C3',no,N,12,,226532,5530,5MC
13,,SING,C4',H4',no,N,13,,226532,5530,5MC
14,,SING,O4',C1',no,N,14,,226532,5530,5MC
15,,SING,C3',O3',no,N,15,,226532,5530,5MC
16,,SING,C3',C2',no,N,16,,226532,5530,5MC
17,,SING,C3',H3',no,N,17,,226532,5530,5MC
18,,SING,O3',HO3',no,N,18,,226532,5530,5MC
19,,SING,C2',O2',no,N,19,,226532,5530,5MC
20,,SING,C2',C1',no,N,20,,226532,5530,5MC
21,,SING,C2',H2',no,N,21,,226532,5530,5MC
22,,SING,O2',HO2',no,N,22,,226532,5530,5MC
23,,SING,C1',N1,no,N,23,,226532,5530,5MC
24,,SING,C1',H1',no,N,24,,226532,5530,5MC
25,,SING,N1,C2,no,N,25,,226532,5530,5MC
26,,SING,N1,C6,no,N,26,,226532,5530,5MC
27,,DOUB,C2,O2,no,N,27,,226532,5530,5MC
28,,SING,C2,N3,no,N,28,,226532,5530,5MC
29,,DOUB,N3,C4,no,N,29,,226532,5530,5MC
30,,SING,C4,N4,no,N,30,,226532,5530,5MC
31,,SING,C4,C5,no,N,31,,226532,5530,5MC
32,,SING,N4,HN41,no,N,32,,226532,5530,5MC
33,,SING,N4,HN42,no,N,33,,226532,5530,5MC
34,,DOUB,C5,C6,no,N,34,,226532,5530,5MC
35,,SING,C5,CM5,no,N,35,,226532,5530,5MC
36,,SING,C6,H6,no,N,36,,226532,5530,5MC
37,,SING,CM5,HM51,no,N,37,,226532,5530,5MC
38,,SING,CM5,HM52,no,N,38,,226532,5530,5MC
39,,SING,CM5,HM53,no,N,39,,226532,5530,5MC
1,,SING,N1,C2,no,N,1,,226555,5531,OMC
2,,SING,N1,C6,no,N,2,,226555,5531,OMC
3,,SING,N1,C1',no,N,3,,226555,5531,OMC
4,,SING,C2,N3,no,N,4,,226555,5531,OMC
5,,DOUB,C2,O2,no,N,5,,226555,5531,OMC
6,,DOUB,N3,C4,no,N,6,,226555,5531,OMC
7,,SING,C4,C5,no,N,7,,226555,5531,OMC
8,,SING,C4,N4,no,N,8,,226555,5531,OMC
9,,DOUB,C5,C6,no,N,9,,226555,5531,OMC
10,,SING,C5,H5,no,N,10,,226555,5531,OMC
11,,SING,C6,H6,no,N,11,,226555,5531,OMC
12,,SING,N4,HN41,no,N,12,,226555,5531,OMC
13,,SING,N4,HN42,no,N,13,,226555,5531,OMC
14,,SING,C1',C2',no,N,14,,226555,5531,OMC
15,,SING,C1',O4',no,N,15,,226555,5531,OMC
16,,SING,C1',H1',no,N,16,,226555,5531,OMC
17,,SING,C2',O2',no,N,17,,226555,5531,OMC
18,,SING,C2',C3',no,N,18,,226555,5531,OMC
19,,SING,C2',H2',no,N,19,,226555,5531,OMC
20,,SING,O2',CM2,no,N,20,,226555,5531,OMC
21,,SING,CM2,HM21,no,N,21,,226555,5531,OMC
22,,SING,CM2,HM22,no,N,22,,226555,5531,OMC
23,,SING,CM2,HM23,no,N,23,,226555,5531,OMC
24,,SING,C3',C4',no,N,24,,226555,5531,OMC
25,,SING,C3',O3',no,N,25,,226555,5531,OMC
26,,SING,C3',H3',no,N,26,,226555,5531,OMC
27,,SING,C4',O4',no,N,27,,226555,5531,OMC
28,,SING,C4',C5',no,N,28,,226555,5531,OMC
29,,SING,C4',H4',no,N,29,,226555,5531,OMC
30,,SING,O3',HO3',no,N,30,,226555,5531,OMC
31,,SING,C5',O5',no,N,31,,226555,5531,OMC
32,,SING,C5',H5',no,N,32,,226555,5531,OMC
33,,SING,C5',H5'',no,N,33,,226555,5531,OMC
34,,SING,O5',P,no,N,34,,226555,5531,OMC
35,,DOUB,P,OP1,no,N,35,,226555,5531,OMC
36,,SING,P,OP2,no,N,36,,226555,5531,OMC
37,,SING,P,OP3,no,N,37,,226555,5531,OMC
38,,SING,OP2,HOP2,no,N,38,,226555,5531,OMC
39,,SING,OP3,HOP3,no,N,39,,226555,5531,OMC
1,,DOUB,P,OP1,no,N,1,,226556,5531,OMG
2,,SING,P,OP2,no,N,2,,226556,5531,OMG
3,,SING,P,OP3,no,N,3,,226556,5531,OMG
4,,SING,P,O5',no,N,4,,226556,5531,OMG
5,,SING,OP2,HOP2,no,N,5,,226556,5531,OMG
6,,SING,OP3,HOP3,no,N,6,,226556,5531,OMG
7,,SING,O5',C5',no,N,7,,226556,5531,OMG
8,,SING,C5',C4',no,N,8,,226556,5531,OMG
9,,SING,C5',H5',no,N,9,,226556,5531,OMG
10,,SING,C5',H5'',no,N,10,,226556,5531,OMG
11,,SING,C4',O4',no,N,11,,226556,5531,OMG
12,,SING,C4',C3',no,N,12,,226556,5531,OMG
13,,SING,C4',H4',no,N,13,,226556,5531,OMG
14,,SING,O4',C1',no,N,14,,226556,5531,OMG
15,,SING,C3',O3',no,N,15,,226556,5531,OMG
16,,SING,C3',C2',no,N,16,,226556,5531,OMG
17,,SING,C3',H3',no,N,17,,226556,5531,OMG
18,,SING,O3',HO3',no,N,18,,226556,5531,OMG
19,,SING,C2',O2',no,N,19,,226556,5531,OMG
20,,SING,C2',C1',no,N,20,,226556,5531,OMG
21,,SING,C2',H2',no,N,21,,226556,5531,OMG
22,,SING,O2',CM2,no,N,22,,226556,5531,OMG
23,,SING,CM2,HM21,no,N,23,,226556,5531,OMG
24,,SING,CM2,HM22,no,N,24,,226556,5531,OMG
25,,SING,CM2,HM23,no,N,25,,226556,5531,OMG
26,,SING,C1',N9,no,N,26,,226556,5531,OMG
27,,SING,C1',H1',no,N,27,,226556,5531,OMG
28,,SING,N9,C8,yes,N,28,,226556,5531,OMG
29,,SING,N9,C4,yes,N,29,,226556,5531,OMG
30,,DOUB,C8,N7,yes,N,30,,226556,5531,OMG
31,,SING,C8,H8,no,N,31,,226556,5531,OMG
32,,SING,N7,C5,yes,N,32,,226556,5531,OMG
33,,SING,C5,C6,no,N,33,,226556,5531,OMG
34,,DOUB,C5,C4,yes,N,34,,226556,5531,OMG
35,,DOUB,C6,O6,no,N,35,,226556,5531,OMG
36,,SING,C6,N1,no,N,36,,226556,5531,OMG
37,,SING,N1,C2,no,N,37,,226556,5531,OMG
38,,SING,N1,HN1,no,N,38,,226556,5531,OMG
39,,SING,C2,N2,no,N,39,,226556,5531,OMG
40,,DOUB,C2,N3,no,N,40,,226556,5531,OMG
41,,SING,N2,HN21,no,N,41,,226556,5531,OMG
42,,SING,N2,HN22,no,N,42,,226556,5531,OMG
43,,SING,N3,C4,no,N,43,,226556,5531,OMG
1,,DOUB,P,OP1,no,N,1,,226557,5531,5MC
2,,SING,P,OP2,no,N,2,,226557,5531,5MC
3,,SING,P,OP3,no,N,3,,226557,5531,5MC
4,,SING,P,O5',no,N,4,,226557,5531,5MC
5,,SING,OP2,HOP2,no,N,5,,226557,5531,5MC
6,,SING,OP3,HOP3,no,N,6,,226557,5531,5MC
7,,SING,O5',C5',no,N,7,,226557,5531,5MC
8,,SING,C5',C4',no,N,8,,226557,5531,5MC
9,,SING,C5',H5',no,N,9,,226557,5531,5MC
10,,SING,C5',H5'',no,N,10,,226557,5531,5MC
11,,SING,C4',O4',no,N,11,,226557,5531,5MC
12,,SING,C4',C3',no,N,12,,226557,5531,5MC
13,,SING,C4',H4',no,N,13,,226557,5531,5MC
14,,SING,O4',C1',no,N,14,,226557,5531,5MC
15,,SING,C3',O3',no,N,15,,226557,5531,5MC
16,,SING,C3',C2',no,N,16,,226557,5531,5MC
17,,SING,C3',H3',no,N,17,,226557,5531,5MC
18,,SING,O3',HO3',no,N,18,,226557,5531,5MC
19,,SING,C2',O2',no,N,19,,226557,5531,5MC
20,,SING,C2',C1',no,N,20,,226557,5531,5MC
21,,SING,C2',H2',no,N,21,,226557,5531,5MC
22,,SING,O2',HO2',no,N,22,,226557,5531,5MC
23,,SING,C1',N1,no,N,23,,226557,5531,5MC
24,,SING,C1',H1',no,N,24,,226557,5531,5MC
25,,SING,N1,C2,no,N,25,,226557,5531,5MC
26,,SING,N1,C6,no,N,26,,226557,5531,5MC
27,,DOUB,C2,O2,no,N,27,,226557,5531,5MC
28,,SING,C2,N3,no,N,28,,226557,5531,5MC
29,,DOUB,N3,C4,no,N,29,,226557,5531,5MC
30,,SING,C4,N4,no,N,30,,226557,5531,5MC
31,,SING,C4,C5,no,N,31,,226557,5531,5MC
32,,SING,N4,HN41,no,N,32,,226557,5531,5MC
33,,SING,N4,HN42,no,N,33,,226557,5531,5MC
34,,DOUB,C5,C6,no,N,34,,226557,5531,5MC
35,,SING,C5,CM5,no,N,35,,226557,5531,5MC
36,,SING,C6,H6,no,N,36,,226557,5531,5MC
37,,SING,CM5,HM51,no,N,37,,226557,5531,5MC
38,,SING,CM5,HM52,no,N,38,,226557,5531,5MC
39,,SING,CM5,HM53,no,N,39,,226557,5531,5MC
1,,DOUB,P,OP1,no,N,1,,226558,5531,1MG
2,,SING,P,OP2,no,N,2,,226558,5531,1MG
3,,SING,P,OP3,no,N,3,,226558,5531,1MG
4,,SING,P,O5',no,N,4,,226558,5531,1MG
5,,SING,OP2,HOP2,no,N,5,,226558,5531,1MG
6,,SING,OP3,HOP3,no,N,6,,226558,5531,1MG
7,,SING,O5',C5',no,N,7,,226558,5531,1MG
8,,SING,C5',C4',no,N,8,,226558,5531,1MG
9,,SING,C5',H5',no,N,9,,226558,5531,1MG
10,,SING,C5',H5'',no,N,10,,226558,5531,1MG
11,,SING,C4',O4',no,N,11,,226558,5531,1MG
12,,SING,C4',C3',no,N,12,,226558,5531,1MG
13,,SING,C4',H4',no,N,13,,226558,5531,1MG
14,,SING,O4',C1',no,N,14,,226558,5531,1MG
15,,SING,C3',O3',no,N,15,,226558,5531,1MG
16,,SING,C3',C2',no,N,16,,226558,5531,1MG
17,,SING,C3',H3',no,N,17,,226558,5531,1MG
18,,SING,O3',HO3',no,N,18,,226558,5531,1MG
19,,SING,C2',O2',no,N,19,,226558,5531,1MG
20,,SING,C2',C1',no,N,20,,226558,5531,1MG
21,,SING,C2',H2',no,N,21,,226558,5531,1MG
22,,SING,O2',HO2',no,N,22,,226558,5531,1MG
23,,SING,C1',N9,no,N,23,,226558,5531,1MG
24,,SING,C1',H1',no,N,24,,226558,5531,1MG
25,,SING,N9,C8,yes,N,25,,226558,5531,1MG
26,,SING,N9,C4,yes,N,26,,226558,5531,1MG
27,,DOUB,C8,N7,yes,N,27,,226558,5531,1MG
28,,SING,C8,H8,no,N,28,,226558,5531,1MG
29,,SING,N7,C5,yes,N,29,,226558,5531,1MG
30,,SING,C5,C6,no,N,30,,226558,5531,1MG
31,,DOUB,C5,C4,yes,N,31,,226558,5531,1MG
32,,DOUB,C6,O6,no,N,32,,226558,5531,1MG
33,,SING,C6,N1,no,N,33,,226558,5531,1MG
34,,SING,N1,CM1,no,N,34,,226558,5531,1MG
35,,SING,N1,C2,no,N,35,,226558,5531,1MG
36,,SING,CM1,HM11,no,N,36,,226558,5531,1MG
37,,SING,CM1,HM12,no,N,37,,226558,5531,1MG
38,,SING,CM1,HM13,no,N,38,,226558,5531,1MG
39,,SING,C2,N2,no,N,39,,226558,5531,1MG
40,,DOUB,C2,N3,no,N,40,,226558,5531,1MG
41,,SING,N2,HN21,no,N,41,,226558,5531,1MG
42,,SING,N2,HN22,no,N,42,,226558,5531,1MG
43,,SING,N3,C4,no,N,43,,226558,5531,1MG
1,,SING,N1,C2,yes,N,1,,226766,5540,FMN
2,,DOUB,N1,C10,yes,N,2,,226766,5540,FMN
3,,DOUB,C2,O2,no,N,3,,226766,5540,FMN
4,,SING,C2,N3,yes,N,4,,226766,5540,FMN
5,,SING,N3,C4,yes,N,5,,226766,5540,FMN
6,,SING,N3,HN3,no,N,6,,226766,5540,FMN
7,,DOUB,C4,O4,no,N,7,,226766,5540,FMN
8,,SING,C4,C4A,yes,N,8,,226766,5540,FMN
9,,DOUB,C4A,N5,yes,N,9,,226766,5540,FMN
10,,SING,C4A,C10,no,N,10,,226766,5540,FMN
11,,SING,N5,C5A,yes,N,11,,226766,5540,FMN
12,,DOUB,C5A,C6,yes,N,12,,226766,5540,FMN
13,,SING,C5A,C9A,yes,N,13,,226766,5540,FMN
14,,SING,C6,C7,yes,N,14,,226766,5540,FMN
15,,SING,C6,H6,no,N,15,,226766,5540,FMN
16,,SING,C7,C7M,no,N,16,,226766,5540,FMN
17,,DOUB,C7,C8,yes,N,17,,226766,5540,FMN
18,,SING,C7M,HM71,no,N,18,,226766,5540,FMN
19,,SING,C7M,HM72,no,N,19,,226766,5540,FMN
20,,SING,C7M,HM73,no,N,20,,226766,5540,FMN
21,,SING,C8,C8M,no,N,21,,226766,5540,FMN
22,,SING,C8,C9,yes,N,22,,226766,5540,FMN
23,,SING,C8M,HM81,no,N,23,,226766,5540,FMN
24,,SING,C8M,HM82,no,N,24,,226766,5540,FMN
25,,SING,C8M,HM83,no,N,25,,226766,5540,FMN
26,,DOUB,C9,C9A,yes,N,26,,226766,5540,FMN
27,,SING,C9,H9,no,N,27,,226766,5540,FMN
28,,SING,C9A,N10,yes,N,28,,226766,5540,FMN
29,,SING,N10,C10,yes,N,29,,226766,5540,FMN
30,,SING,N10,C1',no,N,30,,226766,5540,FMN
31,,SING,C1',C2',no,N,31,,226766,5540,FMN
32,,SING,C1',H1'1,no,N,32,,226766,5540,FMN
33,,SING,C1',H1'2,no,N,33,,226766,5540,FMN
34,,SING,C2',O2',no,N,34,,226766,5540,FMN
35,,SING,C2',C3',no,N,35,,226766,5540,FMN
36,,SING,C2',H2',no,N,36,,226766,5540,FMN
37,,SING,O2',HO2',no,N,37,,226766,5540,FMN
38,,SING,C3',O3',no,N,38,,226766,5540,FMN
39,,SING,C3',C4',no,N,39,,226766,5540,FMN
40,,SING,C3',H3',no,N,40,,226766,5540,FMN
41,,SING,O3',HO3',no,N,41,,226766,5540,FMN
42,,SING,C4',O4',no,N,42,,226766,5540,FMN
43,,SING,C4',C5',no,N,43,,226766,5540,FMN
44,,SING,C4',H4',no,N,44,,226766,5540,FMN
45,,SING,O4',HO4',no,N,45,,226766,5540,FMN
46,,SING,C5',O5',no,N,46,,226766,5540,FMN
47,,SING,C5',H5'1,no,N,47,,226766,5540,FMN
48,,SING,C5',H5'2,no,N,48,,226766,5540,FMN
49,,SING,O5',P,no,N,49,,226766,5540,FMN
50,,DOUB,P,O1P,no,N,50,,226766,5540,FMN
51,,SING,P,O2P,no,N,51,,226766,5540,FMN
52,,SING,P,O3P,no,N,52,,226766,5540,FMN
53,,SING,O2P,HOP2,no,N,53,,226766,5540,FMN
54,,SING,O3P,HOP3,no,N,54,,226766,5540,FMN
1,,SING,N,HN1,no,N,1,,226929,5548,NH2
2,,SING,N,HN2,no,N,2,,226929,5548,NH2
1,,SING,N,HN1,no,N,1,,226964,5549,NH2
2,,SING,N,HN2,no,N,2,,226964,5549,NH2
1,,SING,N,HN1,no,N,1,,227004,5550,NH2
2,,SING,N,HN2,no,N,2,,227004,5550,NH2
1,,SING,N1,C2,yes,N,1,,227577,5571,FMN
2,,DOUB,N1,C10,yes,N,2,,227577,5571,FMN
3,,DOUB,C2,O2,no,N,3,,227577,5571,FMN
4,,SING,C2,N3,yes,N,4,,227577,5571,FMN
5,,SING,N3,C4,yes,N,5,,227577,5571,FMN
6,,SING,N3,HN3,no,N,6,,227577,5571,FMN
7,,DOUB,C4,O4,no,N,7,,227577,5571,FMN
8,,SING,C4,C4A,yes,N,8,,227577,5571,FMN
9,,DOUB,C4A,N5,yes,N,9,,227577,5571,FMN
10,,SING,C4A,C10,no,N,10,,227577,5571,FMN
11,,SING,N5,C5A,yes,N,11,,227577,5571,FMN
12,,DOUB,C5A,C6,yes,N,12,,227577,5571,FMN
13,,SING,C5A,C9A,yes,N,13,,227577,5571,FMN
14,,SING,C6,C7,yes,N,14,,227577,5571,FMN
15,,SING,C6,H6,no,N,15,,227577,5571,FMN
16,,SING,C7,C7M,no,N,16,,227577,5571,FMN
17,,DOUB,C7,C8,yes,N,17,,227577,5571,FMN
18,,SING,C7M,HM71,no,N,18,,227577,5571,FMN
19,,SING,C7M,HM72,no,N,19,,227577,5571,FMN
20,,SING,C7M,HM73,no,N,20,,227577,5571,FMN
21,,SING,C8,C8M,no,N,21,,227577,5571,FMN
22,,SING,C8,C9,yes,N,22,,227577,5571,FMN
23,,SING,C8M,HM81,no,N,23,,227577,5571,FMN
24,,SING,C8M,HM82,no,N,24,,227577,5571,FMN
25,,SING,C8M,HM83,no,N,25,,227577,5571,FMN
26,,DOUB,C9,C9A,yes,N,26,,227577,5571,FMN
27,,SING,C9,H9,no,N,27,,227577,5571,FMN
28,,SING,C9A,N10,yes,N,28,,227577,5571,FMN
29,,SING,N10,C10,yes,N,29,,227577,5571,FMN
30,,SING,N10,C1',no,N,30,,227577,5571,FMN
31,,SING,C1',C2',no,N,31,,227577,5571,FMN
32,,SING,C1',H1'1,no,N,32,,227577,5571,FMN
33,,SING,C1',H1'2,no,N,33,,227577,5571,FMN
34,,SING,C2',O2',no,N,34,,227577,5571,FMN
35,,SING,C2',C3',no,N,35,,227577,5571,FMN
36,,SING,C2',H2',no,N,36,,227577,5571,FMN
37,,SING,O2',HO2',no,N,37,,227577,5571,FMN
38,,SING,C3',O3',no,N,38,,227577,5571,FMN
39,,SING,C3',C4',no,N,39,,227577,5571,FMN
40,,SING,C3',H3',no,N,40,,227577,5571,FMN
41,,SING,O3',HO3',no,N,41,,227577,5571,FMN
42,,SING,C4',O4',no,N,42,,227577,5571,FMN
43,,SING,C4',C5',no,N,43,,227577,5571,FMN
44,,SING,C4',H4',no,N,44,,227577,5571,FMN
45,,SING,O4',HO4',no,N,45,,227577,5571,FMN
46,,SING,C5',O5',no,N,46,,227577,5571,FMN
47,,SING,C5',H5'1,no,N,47,,227577,5571,FMN
48,,SING,C5',H5'2,no,N,48,,227577,5571,FMN
49,,SING,O5',P,no,N,49,,227577,5571,FMN
50,,DOUB,P,O1P,no,N,50,,227577,5571,FMN
51,,SING,P,O2P,no,N,51,,227577,5571,FMN
52,,SING,P,O3P,no,N,52,,227577,5571,FMN
53,,SING,O2P,HOP2,no,N,53,,227577,5571,FMN
54,,SING,O3P,HOP3,no,N,54,,227577,5571,FMN
1,,SING,N,CA,no,N,1,,227643,5575,PCA
2,,SING,N,CD,no,N,2,,227643,5575,PCA
3,,SING,N,H,no,N,3,,227643,5575,PCA
4,,SING,CA,CB,no,N,4,,227643,5575,PCA
5,,SING,CA,C,no,N,5,,227643,5575,PCA
6,,SING,CA,HA,no,N,6,,227643,5575,PCA
7,,SING,CB,CG,no,N,7,,227643,5575,PCA
8,,SING,CB,HB2,no,N,8,,227643,5575,PCA
9,,SING,CB,HB3,no,N,9,,227643,5575,PCA
10,,SING,CG,CD,no,N,10,,227643,5575,PCA
11,,SING,CG,HG2,no,N,11,,227643,5575,PCA
12,,SING,CG,HG3,no,N,12,,227643,5575,PCA
13,,DOUB,CD,OE,no,N,13,,227643,5575,PCA
14,,DOUB,C,O,no,N,14,,227643,5575,PCA
15,,SING,C,OXT,no,N,15,,227643,5575,PCA
16,,SING,OXT,HXT,no,N,16,,227643,5575,PCA
1,,DOUB,PG,O1G,no,N,1,,227662,5576,ATP
2,,SING,PG,O2G,no,N,2,,227662,5576,ATP
3,,SING,PG,O3G,no,N,3,,227662,5576,ATP
4,,SING,PG,O3B,no,N,4,,227662,5576,ATP
5,,SING,O2G,HOG2,no,N,5,,227662,5576,ATP
6,,SING,O3G,HOG3,no,N,6,,227662,5576,ATP
7,,DOUB,PB,O1B,no,N,7,,227662,5576,ATP
8,,SING,PB,O2B,no,N,8,,227662,5576,ATP
9,,SING,PB,O3B,no,N,9,,227662,5576,ATP
10,,SING,PB,O3A,no,N,10,,227662,5576,ATP
11,,SING,O2B,HOB2,no,N,11,,227662,5576,ATP
12,,DOUB,PA,O1A,no,N,12,,227662,5576,ATP
13,,SING,PA,O2A,no,N,13,,227662,5576,ATP
14,,SING,PA,O3A,no,N,14,,227662,5576,ATP
15,,SING,PA,O5',no,N,15,,227662,5576,ATP
16,,SING,O2A,HOA2,no,N,16,,227662,5576,ATP
17,,SING,O5',C5',no,N,17,,227662,5576,ATP
18,,SING,C5',C4',no,N,18,,227662,5576,ATP
19,,SING,C5',H5'1,no,N,19,,227662,5576,ATP
20,,SING,C5',H5'2,no,N,20,,227662,5576,ATP
21,,SING,C4',O4',no,N,21,,227662,5576,ATP
22,,SING,C4',C3',no,N,22,,227662,5576,ATP
23,,SING,C4',H4',no,N,23,,227662,5576,ATP
24,,SING,O4',C1',no,N,24,,227662,5576,ATP
25,,SING,C3',O3',no,N,25,,227662,5576,ATP
26,,SING,C3',C2',no,N,26,,227662,5576,ATP
27,,SING,C3',H3',no,N,27,,227662,5576,ATP
28,,SING,O3',HO3',no,N,28,,227662,5576,ATP
29,,SING,C2',O2',no,N,29,,227662,5576,ATP
30,,SING,C2',C1',no,N,30,,227662,5576,ATP
31,,SING,C2',H2',no,N,31,,227662,5576,ATP
32,,SING,O2',HO2',no,N,32,,227662,5576,ATP
33,,SING,C1',N9,no,N,33,,227662,5576,ATP
34,,SING,C1',H1',no,N,34,,227662,5576,ATP
35,,SING,N9,C8,yes,N,35,,227662,5576,ATP
36,,SING,N9,C4,yes,N,36,,227662,5576,ATP
37,,DOUB,C8,N7,yes,N,37,,227662,5576,ATP
38,,SING,C8,H8,no,N,38,,227662,5576,ATP
39,,SING,N7,C5,yes,N,39,,227662,5576,ATP
40,,SING,C5,C6,yes,N,40,,227662,5576,ATP
41,,DOUB,C5,C4,yes,N,41,,227662,5576,ATP
42,,SING,C6,N6,no,N,42,,227662,5576,ATP
43,,DOUB,C6,N1,yes,N,43,,227662,5576,ATP
44,,SING,N6,HN61,no,N,44,,227662,5576,ATP
45,,SING,N6,HN62,no,N,45,,227662,5576,ATP
46,,SING,N1,C2,yes,N,46,,227662,5576,ATP
47,,DOUB,C2,N3,yes,N,47,,227662,5576,ATP
48,,SING,C2,H2,no,N,48,,227662,5576,ATP
49,,SING,N3,C4,yes,N,49,,227662,5576,ATP
1,,SING,C1,C2,,,,,227703,5578,RTL
2,,SING,C1,C6,,,,,227703,5578,RTL
3,,SING,C1,C16,,,,,227703,5578,RTL
4,,SING,C1,C17,,,,,227703,5578,RTL
5,,SING,C2,C3,,,,,227703,5578,RTL
6,,SING,C2,1H2,,,,,227703,5578,RTL
7,,SING,C2,2H2,,,,,227703,5578,RTL
8,,SING,C3,C4,,,,,227703,5578,RTL
9,,SING,C3,1H3,,,,,227703,5578,RTL
10,,SING,C3,2H3,,,,,227703,5578,RTL
11,,SING,C4,C5,,,,,227703,5578,RTL
12,,SING,C4,1H4,,,,,227703,5578,RTL
13,,SING,C4,2H4,,,,,227703,5578,RTL
14,,DOUB,C5,C6,,,,,227703,5578,RTL
15,,SING,C5,C18,,,,,227703,5578,RTL
16,,SING,C6,C7,,,,,227703,5578,RTL
17,,DOUB,C7,C8,,,,,227703,5578,RTL
18,,SING,C7,H7,,,,,227703,5578,RTL
19,,SING,C8,C9,,,,,227703,5578,RTL
20,,SING,C8,H8,,,,,227703,5578,RTL
21,,DOUB,C9,C10,,,,,227703,5578,RTL
22,,SING,C9,C19,,,,,227703,5578,RTL
23,,SING,C10,C11,,,,,227703,5578,RTL
24,,SING,C10,H10,,,,,227703,5578,RTL
25,,DOUB,C11,C12,,,,,227703,5578,RTL
26,,SING,C11,H11,,,,,227703,5578,RTL
27,,SING,C12,C13,,,,,227703,5578,RTL
28,,SING,C12,H12,,,,,227703,5578,RTL
29,,DOUB,C13,C14,,,,,227703,5578,RTL
30,,SING,C13,C20,,,,,227703,5578,RTL
31,,SING,C14,C15,,,,,227703,5578,RTL
32,,SING,C14,H14,,,,,227703,5578,RTL
33,,SING,C15,O1,,,,,227703,5578,RTL
34,,SING,C15,1H15,,,,,227703,5578,RTL
35,,SING,C15,2H15,,,,,227703,5578,RTL
36,,SING,O1,HO1,,,,,227703,5578,RTL
37,,SING,C16,1H16,,,,,227703,5578,RTL
38,,SING,C16,2H16,,,,,227703,5578,RTL
39,,SING,C16,3H16,,,,,227703,5578,RTL
40,,SING,C17,1H17,,,,,227703,5578,RTL
41,,SING,C17,2H17,,,,,227703,5578,RTL
42,,SING,C17,3H17,,,,,227703,5578,RTL
43,,SING,C18,1H18,,,,,227703,5578,RTL
44,,SING,C18,2H18,,,,,227703,5578,RTL
45,,SING,C18,3H18,,,,,227703,5578,RTL
46,,SING,C19,1H19,,,,,227703,5578,RTL
47,,SING,C19,2H19,,,,,227703,5578,RTL
48,,SING,C19,3H19,,,,,227703,5578,RTL
49,,SING,C20,1H20,,,,,227703,5578,RTL
50,,SING,C20,2H20,,,,,227703,5578,RTL
51,,SING,C20,3H20,,,,,227703,5578,RTL
1,,SING,N,CA,no,N,1,,227775,5580,ABA
2,,SING,N,H,no,N,2,,227775,5580,ABA
3,,SING,N,HN2,no,N,3,,227775,5580,ABA
4,,SING,CA,C,no,N,4,,227775,5580,ABA
5,,SING,CA,CB,no,N,5,,227775,5580,ABA
6,,SING,CA,HA,no,N,6,,227775,5580,ABA
7,,DOUB,C,O,no,N,7,,227775,5580,ABA
8,,SING,C,OXT,no,N,8,,227775,5580,ABA
9,,SING,CB,CG,no,N,9,,227775,5580,ABA
10,,SING,CB,HB3,no,N,10,,227775,5580,ABA
11,,SING,CB,HB2,no,N,11,,227775,5580,ABA
12,,SING,CG,HG1,no,N,12,,227775,5580,ABA
13,,SING,CG,HG3,no,N,13,,227775,5580,ABA
14,,SING,CG,HG2,no,N,14,,227775,5580,ABA
15,,SING,OXT,HXT,no,N,15,,227775,5580,ABA
1,,SING,N,CA,no,N,1,,227776,5580,DHA
2,,SING,N,H,no,N,2,,227776,5580,DHA
3,,SING,N,H2,no,N,3,,227776,5580,DHA
4,,DOUB,CA,CB,no,N,4,,227776,5580,DHA
5,,SING,CA,C,no,N,5,,227776,5580,DHA
6,,SING,CB,HB1,no,N,6,,227776,5580,DHA
7,,SING,CB,HB2,no,N,7,,227776,5580,DHA
8,,DOUB,C,O,no,N,8,,227776,5580,DHA
9,,SING,C,OXT,no,N,9,,227776,5580,DHA
10,,SING,OXT,HXT,no,N,10,,227776,5580,DHA
1,,SING,N,CA,no,N,1,,227777,5580,DHL
2,,SING,N,HN1,no,N,2,,227777,5580,DHL
3,,SING,N,HN2,no,N,3,,227777,5580,DHL
4,,SING,CA,CB,no,N,4,,227777,5580,DHL
5,,SING,CA,HA2,no,N,5,,227777,5580,DHL
6,,SING,CA,HA3,no,N,6,,227777,5580,DHL
7,,SING,CB,SG,no,N,7,,227777,5580,DHL
8,,SING,CB,HB2,no,N,8,,227777,5580,DHL
9,,SING,CB,HB3,no,N,9,,227777,5580,DHL
10,,SING,SG,HS,no,N,10,,227777,5580,DHL
1,,SING,N,CA,no,N,1,,227797,5581,ABA
2,,SING,N,H,no,N,2,,227797,5581,ABA
3,,SING,N,HN2,no,N,3,,227797,5581,ABA
4,,SING,CA,C,no,N,4,,227797,5581,ABA
5,,SING,CA,CB,no,N,5,,227797,5581,ABA
6,,SING,CA,HA,no,N,6,,227797,5581,ABA
7,,DOUB,C,O,no,N,7,,227797,5581,ABA
8,,SING,C,OXT,no,N,8,,227797,5581,ABA
9,,SING,CB,CG,no,N,9,,227797,5581,ABA
10,,SING,CB,HB3,no,N,10,,227797,5581,ABA
11,,SING,CB,HB2,no,N,11,,227797,5581,ABA
12,,SING,CG,HG1,no,N,12,,227797,5581,ABA
13,,SING,CG,HG3,no,N,13,,227797,5581,ABA
14,,SING,CG,HG2,no,N,14,,227797,5581,ABA
15,,SING,OXT,HXT,no,N,15,,227797,5581,ABA
1,,SING,N,CA,no,N,1,,227798,5581,DHA
2,,SING,N,H,no,N,2,,227798,5581,DHA
3,,SING,N,H2,no,N,3,,227798,5581,DHA
4,,DOUB,CA,CB,no,N,4,,227798,5581,DHA
5,,SING,CA,C,no,N,5,,227798,5581,DHA
6,,SING,CB,HB1,no,N,6,,227798,5581,DHA
7,,SING,CB,HB2,no,N,7,,227798,5581,DHA
8,,DOUB,C,O,no,N,8,,227798,5581,DHA
9,,SING,C,OXT,no,N,9,,227798,5581,DHA
10,,SING,OXT,HXT,no,N,10,,227798,5581,DHA
1,,SING,N,CA,no,N,1,,227799,5581,DHL
2,,SING,N,HN1,no,N,2,,227799,5581,DHL
3,,SING,N,HN2,no,N,3,,227799,5581,DHL
4,,SING,CA,CB,no,N,4,,227799,5581,DHL
5,,SING,CA,HA2,no,N,5,,227799,5581,DHL
6,,SING,CA,HA3,no,N,6,,227799,5581,DHL
7,,SING,CB,SG,no,N,7,,227799,5581,DHL
8,,SING,CB,HB2,no,N,8,,227799,5581,DHL
9,,SING,CB,HB3,no,N,9,,227799,5581,DHL
10,,SING,SG,HS,no,N,10,,227799,5581,DHL
1,,SING,N,CA,no,N,1,,227819,5582,ABA
2,,SING,N,H,no,N,2,,227819,5582,ABA
3,,SING,N,HN2,no,N,3,,227819,5582,ABA
4,,SING,CA,C,no,N,4,,227819,5582,ABA
5,,SING,CA,CB,no,N,5,,227819,5582,ABA
6,,SING,CA,HA,no,N,6,,227819,5582,ABA
7,,DOUB,C,O,no,N,7,,227819,5582,ABA
8,,SING,C,OXT,no,N,8,,227819,5582,ABA
9,,SING,CB,CG,no,N,9,,227819,5582,ABA
10,,SING,CB,HB3,no,N,10,,227819,5582,ABA
11,,SING,CB,HB2,no,N,11,,227819,5582,ABA
12,,SING,CG,HG1,no,N,12,,227819,5582,ABA
13,,SING,CG,HG3,no,N,13,,227819,5582,ABA
14,,SING,CG,HG2,no,N,14,,227819,5582,ABA
15,,SING,OXT,HXT,no,N,15,,227819,5582,ABA
1,,SING,N,CA,no,N,1,,227820,5582,DHA
2,,SING,N,H,no,N,2,,227820,5582,DHA
3,,SING,N,H2,no,N,3,,227820,5582,DHA
4,,DOUB,CA,CB,no,N,4,,227820,5582,DHA
5,,SING,CA,C,no,N,5,,227820,5582,DHA
6,,SING,CB,HB1,no,N,6,,227820,5582,DHA
7,,SING,CB,HB2,no,N,7,,227820,5582,DHA
8,,DOUB,C,O,no,N,8,,227820,5582,DHA
9,,SING,C,OXT,no,N,9,,227820,5582,DHA
10,,SING,OXT,HXT,no,N,10,,227820,5582,DHA
1,,SING,N,CA,no,N,1,,227821,5582,DHL
2,,SING,N,HN1,no,N,2,,227821,5582,DHL
3,,SING,N,HN2,no,N,3,,227821,5582,DHL
4,,SING,CA,CB,no,N,4,,227821,5582,DHL
5,,SING,CA,HA2,no,N,5,,227821,5582,DHL
6,,SING,CA,HA3,no,N,6,,227821,5582,DHL
7,,SING,CB,SG,no,N,7,,227821,5582,DHL
8,,SING,CB,HB2,no,N,8,,227821,5582,DHL
9,,SING,CB,HB3,no,N,9,,227821,5582,DHL
10,,SING,SG,HS,no,N,10,,227821,5582,DHL
1,,SING,N,CA,no,N,1,,227885,5585,CGU
2,,SING,N,H,no,N,2,,227885,5585,CGU
3,,SING,N,HN2,no,N,3,,227885,5585,CGU
4,,SING,CA,C,no,N,4,,227885,5585,CGU
5,,SING,CA,CB,no,N,5,,227885,5585,CGU
6,,SING,CA,HA,no,N,6,,227885,5585,CGU
7,,DOUB,C,O,no,N,7,,227885,5585,CGU
8,,SING,C,OXT,no,N,8,,227885,5585,CGU
9,,SING,OXT,HXT,no,N,9,,227885,5585,CGU
10,,SING,CB,CG,no,N,10,,227885,5585,CGU
11,,SING,CB,HB2,no,N,11,,227885,5585,CGU
12,,SING,CB,HB3,no,N,12,,227885,5585,CGU
13,,SING,CG,CD1,no,N,13,,227885,5585,CGU
14,,SING,CG,CD2,no,N,14,,227885,5585,CGU
15,,SING,CG,HG,no,N,15,,227885,5585,CGU
16,,DOUB,CD1,OE11,no,N,16,,227885,5585,CGU
17,,SING,CD1,OE12,no,N,17,,227885,5585,CGU
18,,DOUB,CD2,OE21,no,N,18,,227885,5585,CGU
19,,SING,CD2,OE22,no,N,19,,227885,5585,CGU
20,,SING,OE12,HE12,no,N,20,,227885,5585,CGU
21,,SING,OE22,HE22,no,N,21,,227885,5585,CGU
1,,SING,N,CA,no,N,1,,227886,5585,HYP
2,,SING,N,CD,no,N,2,,227886,5585,HYP
3,,SING,N,H,no,N,3,,227886,5585,HYP
4,,SING,CA,C,no,N,4,,227886,5585,HYP
5,,SING,CA,CB,no,N,5,,227886,5585,HYP
6,,SING,CA,HA,no,N,6,,227886,5585,HYP
7,,DOUB,C,O,no,N,7,,227886,5585,HYP
8,,SING,C,OXT,no,N,8,,227886,5585,HYP
9,,SING,CB,CG,no,N,9,,227886,5585,HYP
10,,SING,CB,HB2,no,N,10,,227886,5585,HYP
11,,SING,CB,HB3,no,N,11,,227886,5585,HYP
12,,SING,CG,CD,no,N,12,,227886,5585,HYP
13,,SING,CG,OD1,no,N,13,,227886,5585,HYP
14,,SING,CG,HG,no,N,14,,227886,5585,HYP
15,,SING,CD,HD22,no,N,15,,227886,5585,HYP
16,,SING,CD,HD23,no,N,16,,227886,5585,HYP
17,,SING,OD1,HD1,no,N,17,,227886,5585,HYP
18,,SING,OXT,HXT,no,N,18,,227886,5585,HYP
1,,SING,N1,C2,yes,N,1,,227905,5586,P5P
2,,DOUB,N1,C6,yes,N,2,,227905,5586,P5P
3,,DOUB,C2,N3,yes,N,3,,227905,5586,P5P
4,,SING,C2,H2,no,N,4,,227905,5586,P5P
5,,SING,N3,C4,yes,N,5,,227905,5586,P5P
6,,DOUB,C4,C5,yes,N,6,,227905,5586,P5P
7,,SING,C4,N9,yes,N,7,,227905,5586,P5P
8,,SING,C5,C6,yes,N,8,,227905,5586,P5P
9,,SING,C5,N7,yes,N,9,,227905,5586,P5P
10,,SING,C6,H6,no,N,10,,227905,5586,P5P
11,,DOUB,N7,C8,yes,N,11,,227905,5586,P5P
12,,SING,C8,N9,yes,N,12,,227905,5586,P5P
13,,SING,C8,H8,no,N,13,,227905,5586,P5P
14,,SING,N9,C1',no,N,14,,227905,5586,P5P
15,,SING,C1',C2',no,N,15,,227905,5586,P5P
16,,SING,C1',O4',no,N,16,,227905,5586,P5P
17,,SING,C1',H1',no,N,17,,227905,5586,P5P
18,,SING,C2',O2',no,N,18,,227905,5586,P5P
19,,SING,C2',C3',no,N,19,,227905,5586,P5P
20,,SING,C2',H2',no,N,20,,227905,5586,P5P
21,,SING,O2',HO2',no,N,21,,227905,5586,P5P
22,,SING,C3',O3',no,N,22,,227905,5586,P5P
23,,SING,C3',C4',no,N,23,,227905,5586,P5P
24,,SING,C3',H3',no,N,24,,227905,5586,P5P
25,,SING,O3',HO3',no,N,25,,227905,5586,P5P
26,,SING,C4',O4',no,N,26,,227905,5586,P5P
27,,SING,C4',C5',no,N,27,,227905,5586,P5P
28,,SING,C4',H4',no,N,28,,227905,5586,P5P
29,,SING,C5',O5',no,N,29,,227905,5586,P5P
30,,SING,C5',H5'1,no,N,30,,227905,5586,P5P
31,,SING,C5',H5'2,no,N,31,,227905,5586,P5P
32,,SING,O5',P,no,N,32,,227905,5586,P5P
33,,DOUB,P,OP1,no,N,33,,227905,5586,P5P
34,,SING,P,OP2,no,N,34,,227905,5586,P5P
35,,SING,P,OP3,no,N,35,,227905,5586,P5P
36,,SING,OP2,HOP2,no,N,36,,227905,5586,P5P
37,,SING,OP3,HOP3,no,N,37,,227905,5586,P5P
1,,SING,N1,C2,yes,N,1,,227925,5587,P5P
2,,DOUB,N1,C6,yes,N,2,,227925,5587,P5P
3,,DOUB,C2,N3,yes,N,3,,227925,5587,P5P
4,,SING,C2,H2,no,N,4,,227925,5587,P5P
5,,SING,N3,C4,yes,N,5,,227925,5587,P5P
6,,DOUB,C4,C5,yes,N,6,,227925,5587,P5P
7,,SING,C4,N9,yes,N,7,,227925,5587,P5P
8,,SING,C5,C6,yes,N,8,,227925,5587,P5P
9,,SING,C5,N7,yes,N,9,,227925,5587,P5P
10,,SING,C6,H6,no,N,10,,227925,5587,P5P
11,,DOUB,N7,C8,yes,N,11,,227925,5587,P5P
12,,SING,C8,N9,yes,N,12,,227925,5587,P5P
13,,SING,C8,H8,no,N,13,,227925,5587,P5P
14,,SING,N9,C1',no,N,14,,227925,5587,P5P
15,,SING,C1',C2',no,N,15,,227925,5587,P5P
16,,SING,C1',O4',no,N,16,,227925,5587,P5P
17,,SING,C1',H1',no,N,17,,227925,5587,P5P
18,,SING,C2',O2',no,N,18,,227925,5587,P5P
19,,SING,C2',C3',no,N,19,,227925,5587,P5P
20,,SING,C2',H2',no,N,20,,227925,5587,P5P
21,,SING,O2',HO2',no,N,21,,227925,5587,P5P
22,,SING,C3',O3',no,N,22,,227925,5587,P5P
23,,SING,C3',C4',no,N,23,,227925,5587,P5P
24,,SING,C3',H3',no,N,24,,227925,5587,P5P
25,,SING,O3',HO3',no,N,25,,227925,5587,P5P
26,,SING,C4',O4',no,N,26,,227925,5587,P5P
27,,SING,C4',C5',no,N,27,,227925,5587,P5P
28,,SING,C4',H4',no,N,28,,227925,5587,P5P
29,,SING,C5',O5',no,N,29,,227925,5587,P5P
30,,SING,C5',H5'1,no,N,30,,227925,5587,P5P
31,,SING,C5',H5'2,no,N,31,,227925,5587,P5P
32,,SING,O5',P,no,N,32,,227925,5587,P5P
33,,DOUB,P,OP1,no,N,33,,227925,5587,P5P
34,,SING,P,OP2,no,N,34,,227925,5587,P5P
35,,SING,P,OP3,no,N,35,,227925,5587,P5P
36,,SING,OP2,HOP2,no,N,36,,227925,5587,P5P
37,,SING,OP3,HOP3,no,N,37,,227925,5587,P5P
1,,SING,N1,C2,yes,N,1,,227945,5588,P5P
2,,DOUB,N1,C6,yes,N,2,,227945,5588,P5P
3,,DOUB,C2,N3,yes,N,3,,227945,5588,P5P
4,,SING,C2,H2,no,N,4,,227945,5588,P5P
5,,SING,N3,C4,yes,N,5,,227945,5588,P5P
6,,DOUB,C4,C5,yes,N,6,,227945,5588,P5P
7,,SING,C4,N9,yes,N,7,,227945,5588,P5P
8,,SING,C5,C6,yes,N,8,,227945,5588,P5P
9,,SING,C5,N7,yes,N,9,,227945,5588,P5P
10,,SING,C6,H6,no,N,10,,227945,5588,P5P
11,,DOUB,N7,C8,yes,N,11,,227945,5588,P5P
12,,SING,C8,N9,yes,N,12,,227945,5588,P5P
13,,SING,C8,H8,no,N,13,,227945,5588,P5P
14,,SING,N9,C1',no,N,14,,227945,5588,P5P
15,,SING,C1',C2',no,N,15,,227945,5588,P5P
16,,SING,C1',O4',no,N,16,,227945,5588,P5P
17,,SING,C1',H1',no,N,17,,227945,5588,P5P
18,,SING,C2',O2',no,N,18,,227945,5588,P5P
19,,SING,C2',C3',no,N,19,,227945,5588,P5P
20,,SING,C2',H2',no,N,20,,227945,5588,P5P
21,,SING,O2',HO2',no,N,21,,227945,5588,P5P
22,,SING,C3',O3',no,N,22,,227945,5588,P5P
23,,SING,C3',C4',no,N,23,,227945,5588,P5P
24,,SING,C3',H3',no,N,24,,227945,5588,P5P
25,,SING,O3',HO3',no,N,25,,227945,5588,P5P
26,,SING,C4',O4',no,N,26,,227945,5588,P5P
27,,SING,C4',C5',no,N,27,,227945,5588,P5P
28,,SING,C4',H4',no,N,28,,227945,5588,P5P
29,,SING,C5',O5',no,N,29,,227945,5588,P5P
30,,SING,C5',H5'1,no,N,30,,227945,5588,P5P
31,,SING,C5',H5'2,no,N,31,,227945,5588,P5P
32,,SING,O5',P,no,N,32,,227945,5588,P5P
33,,DOUB,P,OP1,no,N,33,,227945,5588,P5P
34,,SING,P,OP2,no,N,34,,227945,5588,P5P
35,,SING,P,OP3,no,N,35,,227945,5588,P5P
36,,SING,OP2,HOP2,no,N,36,,227945,5588,P5P
37,,SING,OP3,HOP3,no,N,37,,227945,5588,P5P
1,,SING,CHA,C1A,yes,N,1,,228252,5597,HEM
2,,DOUB,CHA,C4D,yes,N,2,,228252,5597,HEM
3,,SING,CHA,HHA,no,N,3,,228252,5597,HEM
4,,SING,CHB,C4A,yes,N,4,,228252,5597,HEM
5,,DOUB,CHB,C1B,yes,N,5,,228252,5597,HEM
6,,SING,CHB,HHB,no,N,6,,228252,5597,HEM
7,,SING,CHC,C4B,yes,N,7,,228252,5597,HEM
8,,DOUB,CHC,C1C,yes,N,8,,228252,5597,HEM
9,,SING,CHC,HHC,no,N,9,,228252,5597,HEM
10,,DOUB,CHD,C4C,yes,N,10,,228252,5597,HEM
11,,SING,CHD,C1D,yes,N,11,,228252,5597,HEM
12,,SING,CHD,HHD,no,N,12,,228252,5597,HEM
13,,DOUB,C1A,C2A,yes,N,13,,228252,5597,HEM
14,,SING,C1A,NA,yes,N,14,,228252,5597,HEM
15,,SING,C2A,C3A,yes,N,15,,228252,5597,HEM
16,,SING,C2A,CAA,no,N,16,,228252,5597,HEM
17,,DOUB,C3A,C4A,yes,N,17,,228252,5597,HEM
18,,SING,C3A,CMA,no,N,18,,228252,5597,HEM
19,,SING,C4A,NA,yes,N,19,,228252,5597,HEM
20,,SING,CMA,HMA,no,N,20,,228252,5597,HEM
21,,SING,CMA,HMAA,no,N,21,,228252,5597,HEM
22,,SING,CMA,HMAB,no,N,22,,228252,5597,HEM
23,,SING,CAA,CBA,no,N,23,,228252,5597,HEM
24,,SING,CAA,HAA,no,N,24,,228252,5597,HEM
25,,SING,CAA,HAAA,no,N,25,,228252,5597,HEM
26,,SING,CBA,CGA,no,N,26,,228252,5597,HEM
27,,SING,CBA,HBA,no,N,27,,228252,5597,HEM
28,,SING,CBA,HBAA,no,N,28,,228252,5597,HEM
29,,DOUB,CGA,O1A,no,N,29,,228252,5597,HEM
30,,SING,CGA,O2A,no,N,30,,228252,5597,HEM
31,,SING,C1B,C2B,no,N,31,,228252,5597,HEM
32,,SING,C1B,NB,yes,N,32,,228252,5597,HEM
33,,DOUB,C2B,C3B,yes,N,33,,228252,5597,HEM
34,,SING,C2B,CMB,yes,N,34,,228252,5597,HEM
35,,SING,C3B,C4B,no,N,35,,228252,5597,HEM
36,,SING,C3B,CAB,yes,N,36,,228252,5597,HEM
37,,DOUB,C4B,NB,no,N,37,,228252,5597,HEM
38,,SING,CMB,HMB,yes,N,38,,228252,5597,HEM
39,,SING,CMB,HMBA,no,N,39,,228252,5597,HEM
40,,SING,CMB,HMBB,no,N,40,,228252,5597,HEM
41,,DOUB,CAB,CBB,no,N,41,,228252,5597,HEM
42,,SING,CAB,HAB,no,N,42,,228252,5597,HEM
43,,SING,CBB,HBB,no,N,43,,228252,5597,HEM
44,,SING,CBB,HBBA,no,N,44,,228252,5597,HEM
45,,SING,C1C,C2C,no,N,45,,228252,5597,HEM
46,,SING,C1C,NC,yes,N,46,,228252,5597,HEM
47,,DOUB,C2C,C3C,yes,N,47,,228252,5597,HEM
48,,SING,C2C,CMC,yes,N,48,,228252,5597,HEM
49,,SING,C3C,C4C,no,N,49,,228252,5597,HEM
50,,SING,C3C,CAC,yes,N,50,,228252,5597,HEM
51,,SING,C4C,NC,no,N,51,,228252,5597,HEM
52,,SING,CMC,HMC,yes,N,52,,228252,5597,HEM
53,,SING,CMC,HMCA,no,N,53,,228252,5597,HEM
54,,SING,CMC,HMCB,no,N,54,,228252,5597,HEM
55,,DOUB,CAC,CBC,no,N,55,,228252,5597,HEM
56,,SING,CAC,HAC,no,N,56,,228252,5597,HEM
57,,SING,CBC,HBC,no,N,57,,228252,5597,HEM
58,,SING,CBC,HBCA,no,N,58,,228252,5597,HEM
59,,SING,C1D,C2D,no,N,59,,228252,5597,HEM
60,,DOUB,C1D,ND,yes,N,60,,228252,5597,HEM
61,,DOUB,C2D,C3D,yes,N,61,,228252,5597,HEM
62,,SING,C2D,CMD,yes,N,62,,228252,5597,HEM
63,,SING,C3D,C4D,no,N,63,,228252,5597,HEM
64,,SING,C3D,CAD,yes,N,64,,228252,5597,HEM
65,,SING,C4D,ND,no,N,65,,228252,5597,HEM
66,,SING,CMD,HMD,yes,N,66,,228252,5597,HEM
67,,SING,CMD,HMDA,no,N,67,,228252,5597,HEM
68,,SING,CMD,HMDB,no,N,68,,228252,5597,HEM
69,,SING,CAD,CBD,no,N,69,,228252,5597,HEM
70,,SING,CAD,HAD,no,N,70,,228252,5597,HEM
71,,SING,CAD,HADA,no,N,71,,228252,5597,HEM
72,,SING,CBD,CGD,no,N,72,,228252,5597,HEM
73,,SING,CBD,HBD,no,N,73,,228252,5597,HEM
74,,SING,CBD,HBDA,no,N,74,,228252,5597,HEM
75,,DOUB,CGD,O1D,no,N,75,,228252,5597,HEM
76,,SING,CGD,O2D,no,N,76,,228252,5597,HEM
77,,SING,O2A,H2A,no,N,77,,228252,5597,HEM
78,,SING,O2D,H2D,no,N,78,,228252,5597,HEM
79,,SING,FE,NA,no,N,79,,228252,5597,HEM
80,,SING,FE,NB,no,N,80,,228252,5597,HEM
81,,SING,FE,NC,no,N,81,,228252,5597,HEM
82,,SING,FE,ND,no,N,82,,228252,5597,HEM
1,,SING,N,CN,no,N,1,,228338,5600,FME
2,,SING,N,CA,no,N,2,,228338,5600,FME
3,,SING,N,H,no,N,3,,228338,5600,FME
4,,DOUB,CN,O1,no,N,4,,228338,5600,FME
5,,SING,CN,HCN,no,N,5,,228338,5600,FME
6,,SING,CA,CB,no,N,6,,228338,5600,FME
7,,SING,CA,C,no,N,7,,228338,5600,FME
8,,SING,CA,HA,no,N,8,,228338,5600,FME
9,,SING,CB,CG,no,N,9,,228338,5600,FME
10,,SING,CB,HB2,no,N,10,,228338,5600,FME
11,,SING,CB,HB3,no,N,11,,228338,5600,FME
12,,SING,CG,SD,no,N,12,,228338,5600,FME
13,,SING,CG,HG2,no,N,13,,228338,5600,FME
14,,SING,CG,HG3,no,N,14,,228338,5600,FME
15,,SING,SD,CE,no,N,15,,228338,5600,FME
16,,SING,CE,HE1,no,N,16,,228338,5600,FME
17,,SING,CE,HE2,no,N,17,,228338,5600,FME
18,,SING,CE,HE3,no,N,18,,228338,5600,FME
19,,DOUB,C,O,no,N,19,,228338,5600,FME
20,,SING,C,OXT,no,N,20,,228338,5600,FME
21,,SING,OXT,HXT,no,N,21,,228338,5600,FME
1,,SING,N,CN,no,N,1,,228373,5601,FME
2,,SING,N,CA,no,N,2,,228373,5601,FME
3,,SING,N,H,no,N,3,,228373,5601,FME
4,,DOUB,CN,O1,no,N,4,,228373,5601,FME
5,,SING,CN,HCN,no,N,5,,228373,5601,FME
6,,SING,CA,CB,no,N,6,,228373,5601,FME
7,,SING,CA,C,no,N,7,,228373,5601,FME
8,,SING,CA,HA,no,N,8,,228373,5601,FME
9,,SING,CB,CG,no,N,9,,228373,5601,FME
10,,SING,CB,HB2,no,N,10,,228373,5601,FME
11,,SING,CB,HB3,no,N,11,,228373,5601,FME
12,,SING,CG,SD,no,N,12,,228373,5601,FME
13,,SING,CG,HG2,no,N,13,,228373,5601,FME
14,,SING,CG,HG3,no,N,14,,228373,5601,FME
15,,SING,SD,CE,no,N,15,,228373,5601,FME
16,,SING,CE,HE1,no,N,16,,228373,5601,FME
17,,SING,CE,HE2,no,N,17,,228373,5601,FME
18,,SING,CE,HE3,no,N,18,,228373,5601,FME
19,,DOUB,C,O,no,N,19,,228373,5601,FME
20,,SING,C,OXT,no,N,20,,228373,5601,FME
21,,SING,OXT,HXT,no,N,21,,228373,5601,FME
1,,SING,N,CA,no,N,1,,228555,5608,DTR
2,,SING,N,H,no,N,2,,228555,5608,DTR
3,,SING,N,HN2,no,N,3,,228555,5608,DTR
4,,SING,CA,CB,no,N,4,,228555,5608,DTR
5,,SING,CA,C,no,N,5,,228555,5608,DTR
6,,SING,CA,HA,no,N,6,,228555,5608,DTR
7,,SING,CB,CG,no,N,7,,228555,5608,DTR
8,,SING,CB,HB2,no,N,8,,228555,5608,DTR
9,,SING,CB,HB3,no,N,9,,228555,5608,DTR
10,,DOUB,CG,CD1,yes,N,10,,228555,5608,DTR
11,,SING,CG,CD2,yes,N,11,,228555,5608,DTR
12,,SING,CD1,NE1,yes,N,12,,228555,5608,DTR
13,,SING,CD1,HD1,no,N,13,,228555,5608,DTR
14,,SING,NE1,CE2,yes,N,14,,228555,5608,DTR
15,,SING,NE1,HE1,no,N,15,,228555,5608,DTR
16,,DOUB,CE2,CZ2,yes,N,16,,228555,5608,DTR
17,,SING,CE2,CD2,yes,N,17,,228555,5608,DTR
18,,SING,CZ2,CH2,yes,N,18,,228555,5608,DTR
19,,SING,CZ2,HZ2,no,N,19,,228555,5608,DTR
20,,DOUB,CH2,CZ3,yes,N,20,,228555,5608,DTR
21,,SING,CH2,HH2,no,N,21,,228555,5608,DTR
22,,SING,CZ3,CE3,yes,N,22,,228555,5608,DTR
23,,SING,CZ3,HZ3,no,N,23,,228555,5608,DTR
24,,DOUB,CE3,CD2,yes,N,24,,228555,5608,DTR
25,,SING,CE3,HE3,no,N,25,,228555,5608,DTR
26,,DOUB,C,O,no,N,26,,228555,5608,DTR
27,,SING,C,OXT,no,N,27,,228555,5608,DTR
28,,SING,OXT,HXT,no,N,28,,228555,5608,DTR
1,,SING,N,HN1,no,N,1,,228556,5608,NH2
2,,SING,N,HN2,no,N,2,,228556,5608,NH2
1,,DOUB,C,O,no,N,1,,228666,5613,ACE
2,,SING,C,CH3,no,N,2,,228666,5613,ACE
3,,SING,C,H,no,N,3,,228666,5613,ACE
4,,SING,CH3,H1,no,N,4,,228666,5613,ACE
5,,SING,CH3,H2,no,N,5,,228666,5613,ACE
6,,SING,CH3,H3,no,N,6,,228666,5613,ACE
1,,SING,N,HN1,no,N,1,,228667,5613,NH2
2,,SING,N,HN2,no,N,2,,228667,5613,NH2
1,,SING,FE,NA,no,N,1,,228961,5625,HEC
2,,SING,FE,NB,no,N,2,,228961,5625,HEC
3,,SING,FE,NC,no,N,3,,228961,5625,HEC
4,,SING,FE,ND,no,N,4,,228961,5625,HEC
5,,DOUB,CHA,C1A,no,N,5,,228961,5625,HEC
6,,SING,CHA,C4D,no,N,6,,228961,5625,HEC
7,,SING,CHA,HHA,no,N,7,,228961,5625,HEC
8,,DOUB,CHB,C4A,no,N,8,,228961,5625,HEC
9,,SING,CHB,C1B,no,N,9,,228961,5625,HEC
10,,SING,CHB,HHB,no,N,10,,228961,5625,HEC
11,,DOUB,CHC,C4B,no,N,11,,228961,5625,HEC
12,,SING,CHC,C1C,no,N,12,,228961,5625,HEC
13,,SING,CHC,HHC,no,N,13,,228961,5625,HEC
14,,DOUB,CHD,C4C,no,N,14,,228961,5625,HEC
15,,SING,CHD,C1D,no,N,15,,228961,5625,HEC
16,,SING,CHD,HHD,no,N,16,,228961,5625,HEC
17,,SING,NA,C1A,yes,N,17,,228961,5625,HEC
18,,SING,NA,C4A,yes,N,18,,228961,5625,HEC
19,,SING,C1A,C2A,yes,N,19,,228961,5625,HEC
20,,DOUB,C2A,C3A,yes,N,20,,228961,5625,HEC
21,,SING,C2A,CAA,no,N,21,,228961,5625,HEC
22,,SING,C3A,C4A,yes,N,22,,228961,5625,HEC
23,,SING,C3A,CMA,no,N,23,,228961,5625,HEC
24,,SING,CMA,HMA1,no,N,24,,228961,5625,HEC
25,,SING,CMA,HMA2,no,N,25,,228961,5625,HEC
26,,SING,CMA,HMA3,no,N,26,,228961,5625,HEC
27,,SING,CAA,CBA,no,N,27,,228961,5625,HEC
28,,SING,CAA,HAA1,no,N,28,,228961,5625,HEC
29,,SING,CAA,HAA2,no,N,29,,228961,5625,HEC
30,,SING,CBA,CGA,no,N,30,,228961,5625,HEC
31,,SING,CBA,HBA1,no,N,31,,228961,5625,HEC
32,,SING,CBA,HBA2,no,N,32,,228961,5625,HEC
33,,DOUB,CGA,O1A,no,N,33,,228961,5625,HEC
34,,SING,CGA,O2A,no,N,34,,228961,5625,HEC
35,,SING,O2A,H2A,no,N,35,,228961,5625,HEC
36,,SING,NB,C1B,yes,N,36,,228961,5625,HEC
37,,SING,NB,C4B,yes,N,37,,228961,5625,HEC
38,,DOUB,C1B,C2B,yes,N,38,,228961,5625,HEC
39,,SING,C2B,C3B,yes,N,39,,228961,5625,HEC
40,,SING,C2B,CMB,no,N,40,,228961,5625,HEC
41,,SING,C3B,C4B,yes,N,41,,228961,5625,HEC
42,,DOUB,C3B,CAB,no,E,42,,228961,5625,HEC
43,,SING,CMB,HMB1,no,N,43,,228961,5625,HEC
44,,SING,CMB,HMB2,no,N,44,,228961,5625,HEC
45,,SING,CMB,HMB3,no,N,45,,228961,5625,HEC
46,,SING,CAB,CBB,no,N,46,,228961,5625,HEC
47,,SING,CAB,HAB,no,N,47,,228961,5625,HEC
48,,SING,CBB,HBB1,no,N,48,,228961,5625,HEC
49,,SING,CBB,HBB2,no,N,49,,228961,5625,HEC
50,,SING,CBB,HBB3,no,N,50,,228961,5625,HEC
51,,SING,NC,C1C,yes,N,51,,228961,5625,HEC
52,,SING,NC,C4C,yes,N,52,,228961,5625,HEC
53,,DOUB,C1C,C2C,yes,N,53,,228961,5625,HEC
54,,SING,C2C,C3C,yes,N,54,,228961,5625,HEC
55,,SING,C2C,CMC,no,N,55,,228961,5625,HEC
56,,SING,C3C,C4C,yes,N,56,,228961,5625,HEC
57,,DOUB,C3C,CAC,no,E,57,,228961,5625,HEC
58,,SING,CMC,HMC1,no,N,58,,228961,5625,HEC
59,,SING,CMC,HMC2,no,N,59,,228961,5625,HEC
60,,SING,CMC,HMC3,no,N,60,,228961,5625,HEC
61,,SING,CAC,CBC,no,N,61,,228961,5625,HEC
62,,SING,CAC,HAC,no,N,62,,228961,5625,HEC
63,,SING,CBC,HBC1,no,N,63,,228961,5625,HEC
64,,SING,CBC,HBC2,no,N,64,,228961,5625,HEC
65,,SING,CBC,HBC3,no,N,65,,228961,5625,HEC
66,,SING,ND,C1D,yes,N,66,,228961,5625,HEC
67,,SING,ND,C4D,yes,N,67,,228961,5625,HEC
68,,DOUB,C1D,C2D,yes,N,68,,228961,5625,HEC
69,,SING,C2D,C3D,yes,N,69,,228961,5625,HEC
70,,SING,C2D,CMD,no,N,70,,228961,5625,HEC
71,,DOUB,C3D,C4D,yes,N,71,,228961,5625,HEC
72,,SING,C3D,CAD,no,N,72,,228961,5625,HEC
73,,SING,CMD,HMD1,no,N,73,,228961,5625,HEC
74,,SING,CMD,HMD2,no,N,74,,228961,5625,HEC
75,,SING,CMD,HMD3,no,N,75,,228961,5625,HEC
76,,SING,CAD,CBD,no,N,76,,228961,5625,HEC
77,,SING,CAD,HAD1,no,N,77,,228961,5625,HEC
78,,SING,CAD,HAD2,no,N,78,,228961,5625,HEC
79,,SING,CBD,CGD,no,N,79,,228961,5625,HEC
80,,SING,CBD,HBD1,no,N,80,,228961,5625,HEC
81,,SING,CBD,HBD2,no,N,81,,228961,5625,HEC
82,,DOUB,CGD,O1D,no,N,82,,228961,5625,HEC
83,,SING,CGD,O2D,no,N,83,,228961,5625,HEC
84,,SING,O2D,H2D,no,N,84,,228961,5625,HEC
1,,SING,C3G,C4G,no,N,1,,229013,5627,TUX
2,,SING,C3G,C2G,no,N,2,,229013,5627,TUX
3,,SING,C3G,O3G,no,N,3,,229013,5627,TUX
4,,SING,C3G,H3G,no,N,4,,229013,5627,TUX
5,,SING,C4G,C5G,no,N,5,,229013,5627,TUX
6,,SING,C4G,O4G,no,N,6,,229013,5627,TUX
7,,SING,C4G,H4G,no,N,7,,229013,5627,TUX
8,,SING,C5G,O5G,no,N,8,,229013,5627,TUX
9,,SING,C5G,C6G,no,N,9,,229013,5627,TUX
10,,SING,C5G,H5G,no,N,10,,229013,5627,TUX
11,,SING,C2G,C1G,no,N,11,,229013,5627,TUX
12,,SING,C2G,CZH,no,N,12,,229013,5627,TUX
13,,SING,C2G,H2G,no,N,13,,229013,5627,TUX
14,,SING,C1G,O5G,no,N,14,,229013,5627,TUX
15,,SING,C1G,H1G1,no,N,15,,229013,5627,TUX
16,,SING,C1G,H1G2,no,N,16,,229013,5627,TUX
17,,SING,O3G,C1A,no,N,17,,229013,5627,TUX
18,,DOUB,O1A,C1A,no,N,18,,229013,5627,TUX
19,,SING,C1A,C2A,no,N,19,,229013,5627,TUX
20,,SING,C2A,C3A,no,N,20,,229013,5627,TUX
21,,SING,C2A,H2A2,no,N,21,,229013,5627,TUX
22,,SING,C2A,H2A3,no,N,22,,229013,5627,TUX
23,,SING,C3A,C4A,no,N,23,,229013,5627,TUX
24,,SING,C3A,H3A3,no,N,24,,229013,5627,TUX
25,,SING,C3A,H3A2,no,N,25,,229013,5627,TUX
26,,SING,C4A,C5A,no,N,26,,229013,5627,TUX
27,,SING,C4A,H4A2,no,N,27,,229013,5627,TUX
28,,SING,C4A,H4A3,no,N,28,,229013,5627,TUX
29,,SING,C5A,C6A,no,N,29,,229013,5627,TUX
30,,SING,C5A,H5A3,no,N,30,,229013,5627,TUX
31,,SING,C5A,H5A2,no,N,31,,229013,5627,TUX
32,,SING,C6A,C7A,no,N,32,,229013,5627,TUX
33,,SING,C6A,H6A2,no,N,33,,229013,5627,TUX
34,,SING,C6A,H6A3,no,N,34,,229013,5627,TUX
35,,SING,C7A,C8A,no,N,35,,229013,5627,TUX
36,,SING,C7A,H7A3,no,N,36,,229013,5627,TUX
37,,SING,C7A,H7A2,no,N,37,,229013,5627,TUX
38,,SING,C8A,C9A,no,N,38,,229013,5627,TUX
39,,SING,C8A,H8A2,no,N,39,,229013,5627,TUX
40,,SING,C8A,H8A3,no,N,40,,229013,5627,TUX
41,,SING,C9A,CAA,no,N,41,,229013,5627,TUX
42,,SING,C9A,H9A3,no,N,42,,229013,5627,TUX
43,,SING,C9A,H9A2,no,N,43,,229013,5627,TUX
44,,SING,CAA,CBA,no,N,44,,229013,5627,TUX
45,,SING,CAA,HAA2,no,N,45,,229013,5627,TUX
46,,SING,CAA,HAA3,no,N,46,,229013,5627,TUX
47,,SING,CBA,CCA,no,N,47,,229013,5627,TUX
48,,SING,CBA,HBA3,no,N,48,,229013,5627,TUX
49,,SING,CBA,HBA2,no,N,49,,229013,5627,TUX
50,,SING,CCA,CDA,no,N,50,,229013,5627,TUX
51,,SING,CCA,HCA2,no,N,51,,229013,5627,TUX
52,,SING,CCA,HCA3,no,N,52,,229013,5627,TUX
53,,SING,CDA,CEA,no,N,53,,229013,5627,TUX
54,,SING,CDA,HDA3,no,N,54,,229013,5627,TUX
55,,SING,CDA,HDA2,no,N,55,,229013,5627,TUX
56,,SING,CEA,HEA1,no,N,56,,229013,5627,TUX
57,,SING,CEA,HEA2,no,N,57,,229013,5627,TUX
58,,SING,CEA,HEA3,no,N,58,,229013,5627,TUX
59,,SING,CZH,CYH,no,N,59,,229013,5627,TUX
60,,SING,CZH,HZH2,no,N,60,,229013,5627,TUX
61,,SING,CZH,HZH3,no,N,61,,229013,5627,TUX
62,,DOUB,CYH,OYH,no,N,62,,229013,5627,TUX
63,,SING,CYH,NXH,no,N,63,,229013,5627,TUX
64,,SING,NXH,OXH,no,N,64,,229013,5627,TUX
65,,SING,NXH,HNH1,no,N,65,,229013,5627,TUX
66,,SING,OXH,HOH1,no,N,66,,229013,5627,TUX
67,,SING,O4G,HOG4,no,N,67,,229013,5627,TUX
68,,SING,C6G,O6G,no,N,68,,229013,5627,TUX
69,,SING,C6G,H6G2,no,N,69,,229013,5627,TUX
70,,SING,C6G,H6G3,no,N,70,,229013,5627,TUX
71,,SING,O6G,HOG6,no,N,71,,229013,5627,TUX
1,,SING,CHA,C1A,yes,N,1,,229667,5660,HEM
2,,DOUB,CHA,C4D,yes,N,2,,229667,5660,HEM
3,,SING,CHA,HHA,no,N,3,,229667,5660,HEM
4,,SING,CHB,C4A,yes,N,4,,229667,5660,HEM
5,,DOUB,CHB,C1B,yes,N,5,,229667,5660,HEM
6,,SING,CHB,HHB,no,N,6,,229667,5660,HEM
7,,SING,CHC,C4B,yes,N,7,,229667,5660,HEM
8,,DOUB,CHC,C1C,yes,N,8,,229667,5660,HEM
9,,SING,CHC,HHC,no,N,9,,229667,5660,HEM
10,,DOUB,CHD,C4C,yes,N,10,,229667,5660,HEM
11,,SING,CHD,C1D,yes,N,11,,229667,5660,HEM
12,,SING,CHD,HHD,no,N,12,,229667,5660,HEM
13,,DOUB,C1A,C2A,yes,N,13,,229667,5660,HEM
14,,SING,C1A,NA,yes,N,14,,229667,5660,HEM
15,,SING,C2A,C3A,yes,N,15,,229667,5660,HEM
16,,SING,C2A,CAA,no,N,16,,229667,5660,HEM
17,,DOUB,C3A,C4A,yes,N,17,,229667,5660,HEM
18,,SING,C3A,CMA,no,N,18,,229667,5660,HEM
19,,SING,C4A,NA,yes,N,19,,229667,5660,HEM
20,,SING,CMA,HMA,no,N,20,,229667,5660,HEM
21,,SING,CMA,HMAA,no,N,21,,229667,5660,HEM
22,,SING,CMA,HMAB,no,N,22,,229667,5660,HEM
23,,SING,CAA,CBA,no,N,23,,229667,5660,HEM
24,,SING,CAA,HAA,no,N,24,,229667,5660,HEM
25,,SING,CAA,HAAA,no,N,25,,229667,5660,HEM
26,,SING,CBA,CGA,no,N,26,,229667,5660,HEM
27,,SING,CBA,HBA,no,N,27,,229667,5660,HEM
28,,SING,CBA,HBAA,no,N,28,,229667,5660,HEM
29,,DOUB,CGA,O1A,no,N,29,,229667,5660,HEM
30,,SING,CGA,O2A,no,N,30,,229667,5660,HEM
31,,SING,C1B,C2B,no,N,31,,229667,5660,HEM
32,,SING,C1B,NB,yes,N,32,,229667,5660,HEM
33,,DOUB,C2B,C3B,yes,N,33,,229667,5660,HEM
34,,SING,C2B,CMB,yes,N,34,,229667,5660,HEM
35,,SING,C3B,C4B,no,N,35,,229667,5660,HEM
36,,SING,C3B,CAB,yes,N,36,,229667,5660,HEM
37,,DOUB,C4B,NB,no,N,37,,229667,5660,HEM
38,,SING,CMB,HMB,yes,N,38,,229667,5660,HEM
39,,SING,CMB,HMBA,no,N,39,,229667,5660,HEM
40,,SING,CMB,HMBB,no,N,40,,229667,5660,HEM
41,,DOUB,CAB,CBB,no,N,41,,229667,5660,HEM
42,,SING,CAB,HAB,no,N,42,,229667,5660,HEM
43,,SING,CBB,HBB,no,N,43,,229667,5660,HEM
44,,SING,CBB,HBBA,no,N,44,,229667,5660,HEM
45,,SING,C1C,C2C,no,N,45,,229667,5660,HEM
46,,SING,C1C,NC,yes,N,46,,229667,5660,HEM
47,,DOUB,C2C,C3C,yes,N,47,,229667,5660,HEM
48,,SING,C2C,CMC,yes,N,48,,229667,5660,HEM
49,,SING,C3C,C4C,no,N,49,,229667,5660,HEM
50,,SING,C3C,CAC,yes,N,50,,229667,5660,HEM
51,,SING,C4C,NC,no,N,51,,229667,5660,HEM
52,,SING,CMC,HMC,yes,N,52,,229667,5660,HEM
53,,SING,CMC,HMCA,no,N,53,,229667,5660,HEM
54,,SING,CMC,HMCB,no,N,54,,229667,5660,HEM
55,,DOUB,CAC,CBC,no,N,55,,229667,5660,HEM
56,,SING,CAC,HAC,no,N,56,,229667,5660,HEM
57,,SING,CBC,HBC,no,N,57,,229667,5660,HEM
58,,SING,CBC,HBCA,no,N,58,,229667,5660,HEM
59,,SING,C1D,C2D,no,N,59,,229667,5660,HEM
60,,DOUB,C1D,ND,yes,N,60,,229667,5660,HEM
61,,DOUB,C2D,C3D,yes,N,61,,229667,5660,HEM
62,,SING,C2D,CMD,yes,N,62,,229667,5660,HEM
63,,SING,C3D,C4D,no,N,63,,229667,5660,HEM
64,,SING,C3D,CAD,yes,N,64,,229667,5660,HEM
65,,SING,C4D,ND,no,N,65,,229667,5660,HEM
66,,SING,CMD,HMD,yes,N,66,,229667,5660,HEM
67,,SING,CMD,HMDA,no,N,67,,229667,5660,HEM
68,,SING,CMD,HMDB,no,N,68,,229667,5660,HEM
69,,SING,CAD,CBD,no,N,69,,229667,5660,HEM
70,,SING,CAD,HAD,no,N,70,,229667,5660,HEM
71,,SING,CAD,HADA,no,N,71,,229667,5660,HEM
72,,SING,CBD,CGD,no,N,72,,229667,5660,HEM
73,,SING,CBD,HBD,no,N,73,,229667,5660,HEM
74,,SING,CBD,HBDA,no,N,74,,229667,5660,HEM
75,,DOUB,CGD,O1D,no,N,75,,229667,5660,HEM
76,,SING,CGD,O2D,no,N,76,,229667,5660,HEM
77,,SING,O2A,H2A,no,N,77,,229667,5660,HEM
78,,SING,O2D,H2D,no,N,78,,229667,5660,HEM
79,,SING,FE,NA,no,N,79,,229667,5660,HEM
80,,SING,FE,NB,no,N,80,,229667,5660,HEM
81,,SING,FE,NC,no,N,81,,229667,5660,HEM
82,,SING,FE,ND,no,N,82,,229667,5660,HEM
1,,SING,N,HN1,no,N,1,,229977,5673,NH2
2,,SING,N,HN2,no,N,2,,229977,5673,NH2
1,,SING,N,HN1,no,N,1,,230000,5674,NH2
2,,SING,N,HN2,no,N,2,,230000,5674,NH2
1,,SING,CD1,CG,no,N,1,,230020,5675,NLW
2,,SING,CG,CD2,no,N,2,,230020,5675,NLW
3,,SING,CG,CB,no,N,3,,230020,5675,NLW
4,,SING,CB,CA,no,N,4,,230020,5675,NLW
5,,SING,N,CA,no,N,5,,230020,5675,NLW
6,,SING,CA,C,no,N,6,,230020,5675,NLW
7,,SING,C,NH2,no,N,7,,230020,5675,NLW
8,,DOUB,C,O,no,N,8,,230020,5675,NLW
9,,SING,CD2,H1,no,N,9,,230020,5675,NLW
10,,SING,CD2,H2,no,N,10,,230020,5675,NLW
11,,SING,CD2,H3,no,N,11,,230020,5675,NLW
12,,SING,CG,H4,no,N,12,,230020,5675,NLW
13,,SING,CD1,H5,no,N,13,,230020,5675,NLW
14,,SING,CD1,H6,no,N,14,,230020,5675,NLW
15,,SING,CD1,H7,no,N,15,,230020,5675,NLW
16,,SING,CB,H8,no,N,16,,230020,5675,NLW
17,,SING,CB,H9,no,N,17,,230020,5675,NLW
18,,SING,CA,H10,no,N,18,,230020,5675,NLW
19,,SING,N,H11,no,N,19,,230020,5675,NLW
20,,SING,N,H12,no,N,20,,230020,5675,NLW
21,,SING,NH2,H14,no,N,21,,230020,5675,NLW
22,,SING,NH2,H15,no,N,22,,230020,5675,NLW
1,,SING,N,CA,no,N,1,,230477,5693,PTR
2,,SING,N,H,no,N,2,,230477,5693,PTR
3,,SING,N,HN2,no,N,3,,230477,5693,PTR
4,,SING,CA,C,no,N,4,,230477,5693,PTR
5,,SING,CA,CB,no,N,5,,230477,5693,PTR
6,,SING,CA,HA,no,N,6,,230477,5693,PTR
7,,DOUB,C,O,no,N,7,,230477,5693,PTR
8,,SING,C,OXT,no,N,8,,230477,5693,PTR
9,,SING,OXT,HXT,no,N,9,,230477,5693,PTR
10,,SING,CB,CG,no,N,10,,230477,5693,PTR
11,,SING,CB,HB2,no,N,11,,230477,5693,PTR
12,,SING,CB,HB3,no,N,12,,230477,5693,PTR
13,,DOUB,CG,CD1,yes,N,13,,230477,5693,PTR
14,,SING,CG,CD2,yes,N,14,,230477,5693,PTR
15,,SING,CD1,CE1,yes,N,15,,230477,5693,PTR
16,,SING,CD1,HD1,no,N,16,,230477,5693,PTR
17,,DOUB,CD2,CE2,yes,N,17,,230477,5693,PTR
18,,SING,CD2,HD2,no,N,18,,230477,5693,PTR
19,,DOUB,CE1,CZ,yes,N,19,,230477,5693,PTR
20,,SING,CE1,HE1,no,N,20,,230477,5693,PTR
21,,SING,CE2,CZ,yes,N,21,,230477,5693,PTR
22,,SING,CE2,HE2,no,N,22,,230477,5693,PTR
23,,SING,CZ,OH,no,N,23,,230477,5693,PTR
24,,SING,OH,P,no,N,24,,230477,5693,PTR
25,,DOUB,P,O1P,no,N,25,,230477,5693,PTR
26,,SING,P,O2P,no,N,26,,230477,5693,PTR
27,,SING,P,O3P,no,N,27,,230477,5693,PTR
28,,SING,O2P,HO2P,no,N,28,,230477,5693,PTR
29,,SING,O3P,HO3P,no,N,29,,230477,5693,PTR
1,,SING,O2',C2',no,N,1,,230706,5703,SSU
2,,SING,O2',HO2',no,N,2,,230706,5703,SSU
3,,SING,C2',C1',no,N,3,,230706,5703,SSU
4,,SING,C2',C3',no,N,4,,230706,5703,SSU
5,,SING,C2',H2',no,N,5,,230706,5703,SSU
6,,SING,C1',O4',no,N,6,,230706,5703,SSU
7,,SING,C1',N1,no,N,7,,230706,5703,SSU
8,,SING,C1',H1',no,N,8,,230706,5703,SSU
9,,SING,O4',C4',no,N,9,,230706,5703,SSU
10,,SING,C4',C5',no,N,10,,230706,5703,SSU
11,,SING,C4',C3',no,N,11,,230706,5703,SSU
12,,SING,C4',H4',no,N,12,,230706,5703,SSU
13,,SING,C5',O5',no,N,13,,230706,5703,SSU
14,,SING,C5',H5',no,N,14,,230706,5703,SSU
15,,SING,C5',H5'',no,N,15,,230706,5703,SSU
16,,SING,O5',P,no,N,16,,230706,5703,SSU
17,,DOUB,P,S1P,no,N,17,,230706,5703,SSU
18,,SING,P,OP2,no,N,18,,230706,5703,SSU
19,,SING,P,OP3,no,N,19,,230706,5703,SSU
20,,SING,OP2,H2P,no,N,20,,230706,5703,SSU
21,,SING,OP3,H3P,no,N,21,,230706,5703,SSU
22,,SING,C3',O3',no,N,22,,230706,5703,SSU
23,,SING,C3',H3',no,N,23,,230706,5703,SSU
24,,SING,O3',HO3',no,N,24,,230706,5703,SSU
25,,SING,N1,C6,no,N,25,,230706,5703,SSU
26,,SING,N1,C2,no,N,26,,230706,5703,SSU
27,,DOUB,C6,C5,no,N,27,,230706,5703,SSU
28,,SING,C6,H6,no,N,28,,230706,5703,SSU
29,,SING,C5,C4,no,N,29,,230706,5703,SSU
30,,SING,C5,H5,no,N,30,,230706,5703,SSU
31,,DOUB,C4,O4,no,N,31,,230706,5703,SSU
32,,SING,C4,N3,no,N,32,,230706,5703,SSU
33,,SING,N3,C2,no,N,33,,230706,5703,SSU
34,,SING,N3,H3,no,N,34,,230706,5703,SSU
35,,DOUB,C2,O2,no,N,35,,230706,5703,SSU
1,,DOUB,PA,O1A,no,N,1,,230905,5712,M7G
2,,SING,PA,O2A,no,N,2,,230905,5712,M7G
3,,SING,PA,O3A,no,N,3,,230905,5712,M7G
4,,SING,PA,O5',no,N,4,,230905,5712,M7G
5,,SING,O2A,HOA2,no,N,5,,230905,5712,M7G
6,,SING,O3A,PB,no,N,6,,230905,5712,M7G
7,,SING,O5',C5',no,N,7,,230905,5712,M7G
8,,DOUB,PB,O1B,no,N,8,,230905,5712,M7G
9,,SING,PB,O2B,no,N,9,,230905,5712,M7G
10,,SING,PB,O3B,no,N,10,,230905,5712,M7G
11,,SING,O2B,HOB2,no,N,11,,230905,5712,M7G
12,,SING,O3B,HOB3,no,N,12,,230905,5712,M7G
13,,SING,C5',C4',no,N,13,,230905,5712,M7G
14,,SING,C5',H5'1,no,N,14,,230905,5712,M7G
15,,SING,C5',H5'2,no,N,15,,230905,5712,M7G
16,,SING,C4',O4',no,N,16,,230905,5712,M7G
17,,SING,C4',C3',no,N,17,,230905,5712,M7G
18,,SING,C4',H4',no,N,18,,230905,5712,M7G
19,,SING,O4',C1',no,N,19,,230905,5712,M7G
20,,SING,C3',O3',no,N,20,,230905,5712,M7G
21,,SING,C3',C2',no,N,21,,230905,5712,M7G
22,,SING,C3',H3',no,N,22,,230905,5712,M7G
23,,SING,O3',HO3',no,N,23,,230905,5712,M7G
24,,SING,C2',O2',no,N,24,,230905,5712,M7G
25,,SING,C2',C1',no,N,25,,230905,5712,M7G
26,,SING,C2',H2',no,N,26,,230905,5712,M7G
27,,SING,O2',HO2',no,N,27,,230905,5712,M7G
28,,SING,C1',N9,no,N,28,,230905,5712,M7G
29,,SING,C1',H1',no,N,29,,230905,5712,M7G
30,,SING,N9,C8,no,N,30,,230905,5712,M7G
31,,SING,N9,C4,no,N,31,,230905,5712,M7G
32,,SING,C8,N7,no,N,32,,230905,5712,M7G
33,,SING,C8,H81,no,N,33,,230905,5712,M7G
34,,SING,C8,H82,no,N,34,,230905,5712,M7G
35,,SING,N7,CM7,no,N,35,,230905,5712,M7G
36,,SING,N7,C5,no,N,36,,230905,5712,M7G
37,,SING,CM7,HM71,no,N,37,,230905,5712,M7G
38,,SING,CM7,HM72,no,N,38,,230905,5712,M7G
39,,SING,CM7,HM73,no,N,39,,230905,5712,M7G
40,,SING,C5,C6,no,N,40,,230905,5712,M7G
41,,DOUB,C5,C4,no,N,41,,230905,5712,M7G
42,,DOUB,C6,O6,no,N,42,,230905,5712,M7G
43,,SING,C6,N1,no,N,43,,230905,5712,M7G
44,,SING,N1,C2,no,N,44,,230905,5712,M7G
45,,SING,N1,HN1,no,N,45,,230905,5712,M7G
46,,SING,C2,N2,no,N,46,,230905,5712,M7G
47,,DOUB,C2,N3,no,N,47,,230905,5712,M7G
48,,SING,N2,HN21,no,N,48,,230905,5712,M7G
49,,SING,N2,HN22,no,N,49,,230905,5712,M7G
50,,SING,N3,C4,no,N,50,,230905,5712,M7G
1,,DOUB,C1,C2,yes,N,1,,231271,5730,BAP
2,,SING,C1,C1A,yes,N,2,,231271,5730,BAP
3,,SING,C1,H1,no,N,3,,231271,5730,BAP
4,,SING,C2,C3,yes,N,4,,231271,5730,BAP
5,,SING,C2,H2,no,N,5,,231271,5730,BAP
6,,DOUB,C3,C3A,yes,N,6,,231271,5730,BAP
7,,SING,C3,H3,no,N,7,,231271,5730,BAP
8,,SING,C3A,C4,yes,N,8,,231271,5730,BAP
9,,SING,C3A,C3B,yes,N,9,,231271,5730,BAP
10,,DOUB,C4,C5,yes,N,10,,231271,5730,BAP
11,,SING,C4,H4,no,N,11,,231271,5730,BAP
12,,SING,C5,C5A,yes,N,12,,231271,5730,BAP
13,,SING,C5,H5,no,N,13,,231271,5730,BAP
14,,DOUB,C5A,C6,yes,N,14,,231271,5730,BAP
15,,SING,C5A,C5B,yes,N,15,,231271,5730,BAP
16,,SING,C6,C7,yes,N,16,,231271,5730,BAP
17,,SING,C6,C4',no,N,17,,231271,5730,BAP
18,,DOUB,C7,C8,yes,N,18,,231271,5730,BAP
19,,SING,C7,C1',no,N,19,,231271,5730,BAP
20,,SING,C8,C8A,yes,N,20,,231271,5730,BAP
21,,SING,C8,H8,no,N,21,,231271,5730,BAP
22,,DOUB,C8A,C9,yes,N,22,,231271,5730,BAP
23,,SING,C8A,C5B,yes,N,23,,231271,5730,BAP
24,,SING,C9,C10,yes,N,24,,231271,5730,BAP
25,,SING,C9,H9,no,N,25,,231271,5730,BAP
26,,DOUB,C10,C1A,yes,N,26,,231271,5730,BAP
27,,SING,C10,H10,no,N,27,,231271,5730,BAP
28,,SING,C1A,C3B,yes,N,28,,231271,5730,BAP
29,,DOUB,C3B,C5B,yes,N,29,,231271,5730,BAP
30,,SING,C1',O1',no,N,30,,231271,5730,BAP
31,,SING,C1',C2',no,N,31,,231271,5730,BAP
32,,SING,C1',H1',no,N,32,,231271,5730,BAP
33,,SING,O1',HO1,no,N,33,,231271,5730,BAP
34,,SING,C2',O2',no,N,34,,231271,5730,BAP
35,,SING,C2',C3',no,N,35,,231271,5730,BAP
36,,SING,C2',H2',no,N,36,,231271,5730,BAP
37,,SING,O2',HO2,no,N,37,,231271,5730,BAP
38,,SING,C3',O3',no,N,38,,231271,5730,BAP
39,,SING,C3',C4',no,N,39,,231271,5730,BAP
40,,SING,C3',H3',no,N,40,,231271,5730,BAP
41,,SING,O3',HO3,no,N,41,,231271,5730,BAP
42,,SING,C4',H4'1,no,N,42,,231271,5730,BAP
43,,SING,C4',H4'2,no,N,43,,231271,5730,BAP
1,,SING,C8A,C9,no,N,1,,231443,5739,AFN
2,,SING,C8A,O7,no,N,2,,231443,5739,AFN
3,,SING,C8A,H8A2,no,N,3,,231443,5739,AFN
4,,SING,C8A,H8A,no,N,4,,231443,5739,AFN
5,,SING,C9,O9,no,N,5,,231443,5739,AFN
6,,SING,C9,C9A,no,N,6,,231443,5739,AFN
7,,SING,C9,H9,no,N,7,,231443,5739,AFN
8,,SING,O9,HO9,no,N,8,,231443,5739,AFN
9,,SING,C9A,C9B,no,N,9,,231443,5739,AFN
10,,SING,C9A,C6A,no,N,10,,231443,5739,AFN
11,,SING,C9A,H9A,no,N,11,,231443,5739,AFN
12,,DOUB,C9B,C5A,yes,N,12,,231443,5739,AFN
13,,SING,C9B,C10,yes,N,13,,231443,5739,AFN
14,,SING,O7,C6A,no,N,14,,231443,5739,AFN
15,,SING,C6A,O6A,no,N,15,,231443,5739,AFN
16,,SING,C6A,H6A,no,N,16,,231443,5739,AFN
17,,SING,O6A,C5A,no,N,17,,231443,5739,AFN
18,,SING,C5A,C5B,yes,N,18,,231443,5739,AFN
19,,DOUB,C5B,C4B,yes,N,19,,231443,5739,AFN
20,,SING,C5B,H5B,no,N,20,,231443,5739,AFN
21,,SING,C4B,O4,no,N,21,,231443,5739,AFN
22,,SING,C4B,C4A,yes,N,22,,231443,5739,AFN
23,,SING,O4,CM,no,N,23,,231443,5739,AFN
24,,SING,CM,HM1,no,N,24,,231443,5739,AFN
25,,SING,CM,HM2,no,N,25,,231443,5739,AFN
26,,SING,CM,HM3,no,N,26,,231443,5739,AFN
27,,DOUB,C4A,C10,yes,N,27,,231443,5739,AFN
28,,SING,C4A,C3A,yes,N,28,,231443,5739,AFN
29,,SING,C10,O10,yes,N,29,,231443,5739,AFN
30,,SING,O10,C11,yes,N,30,,231443,5739,AFN
31,,DOUB,C11,O11,no,N,31,,231443,5739,AFN
32,,SING,C11,C12,yes,N,32,,231443,5739,AFN
33,,DOUB,C12,C3A,yes,N,33,,231443,5739,AFN
34,,SING,C12,C1,no,N,34,,231443,5739,AFN
35,,SING,C3A,C3,no,N,35,,231443,5739,AFN
36,,SING,C3,C2A,no,N,36,,231443,5739,AFN
37,,SING,C3,H31,no,N,37,,231443,5739,AFN
38,,SING,C3,H32,no,N,38,,231443,5739,AFN
39,,SING,C2A,C1,no,N,39,,231443,5739,AFN
40,,SING,C2A,H2A1,no,N,40,,231443,5739,AFN
41,,SING,C2A,H2A2,no,N,41,,231443,5739,AFN
42,,DOUB,C1,O1,no,N,42,,231443,5739,AFN
1,,SING,N1,C2,yes,N,1,,231472,5740,FOL
2,,SING,N1,C8A,yes,N,2,,231472,5740,FOL
3,,SING,N1,HN1,no,N,3,,231472,5740,FOL
4,,SING,C2,NA2,no,N,4,,231472,5740,FOL
5,,DOUB,C2,N3,yes,N,5,,231472,5740,FOL
6,,SING,NA2,HN21,no,N,6,,231472,5740,FOL
7,,SING,NA2,HN22,no,N,7,,231472,5740,FOL
8,,SING,N3,C4,yes,N,8,,231472,5740,FOL
9,,DOUB,C4,O4,no,N,9,,231472,5740,FOL
10,,SING,C4,C4A,yes,N,10,,231472,5740,FOL
11,,SING,C4A,N5,yes,N,11,,231472,5740,FOL
12,,DOUB,C4A,C8A,yes,N,12,,231472,5740,FOL
13,,DOUB,N5,C6,yes,N,13,,231472,5740,FOL
14,,SING,C6,C7,yes,N,14,,231472,5740,FOL
15,,SING,C6,C9,no,N,15,,231472,5740,FOL
16,,DOUB,C7,N8,yes,N,16,,231472,5740,FOL
17,,SING,C7,H7,no,N,17,,231472,5740,FOL
18,,SING,N8,C8A,yes,N,18,,231472,5740,FOL
19,,SING,C9,N10,no,N,19,,231472,5740,FOL
20,,SING,C9,H91,no,N,20,,231472,5740,FOL
21,,SING,C9,H92,no,N,21,,231472,5740,FOL
22,,SING,N10,C14,no,N,22,,231472,5740,FOL
23,,SING,N10,HN0,no,N,23,,231472,5740,FOL
24,,DOUB,C11,C12,yes,N,24,,231472,5740,FOL
25,,SING,C11,C16,yes,N,25,,231472,5740,FOL
26,,SING,C11,C,no,N,26,,231472,5740,FOL
27,,SING,C12,C13,yes,N,27,,231472,5740,FOL
28,,SING,C12,H12,no,N,28,,231472,5740,FOL
29,,DOUB,C13,C14,yes,N,29,,231472,5740,FOL
30,,SING,C13,H13,no,N,30,,231472,5740,FOL
31,,SING,C14,C15,yes,N,31,,231472,5740,FOL
32,,DOUB,C15,C16,yes,N,32,,231472,5740,FOL
33,,SING,C15,H15,no,N,33,,231472,5740,FOL
34,,SING,C16,H16,no,N,34,,231472,5740,FOL
35,,DOUB,C,O,no,N,35,,231472,5740,FOL
36,,SING,C,N,no,N,36,,231472,5740,FOL
37,,SING,N,CA,no,N,37,,231472,5740,FOL
38,,SING,N,HN,no,N,38,,231472,5740,FOL
39,,SING,CA,CB,no,N,39,,231472,5740,FOL
40,,SING,CA,CT,no,N,40,,231472,5740,FOL
41,,SING,CA,HA,no,N,41,,231472,5740,FOL
42,,SING,CB,CG,no,N,42,,231472,5740,FOL
43,,SING,CB,HB1,no,N,43,,231472,5740,FOL
44,,SING,CB,HB2,no,N,44,,231472,5740,FOL
45,,SING,CG,CD,no,N,45,,231472,5740,FOL
46,,SING,CG,HG1,no,N,46,,231472,5740,FOL
47,,SING,CG,HG2,no,N,47,,231472,5740,FOL
48,,DOUB,CD,OE1,no,N,48,,231472,5740,FOL
49,,SING,CD,OE2,no,N,49,,231472,5740,FOL
50,,SING,OE2,HOE2,no,N,50,,231472,5740,FOL
51,,DOUB,CT,O1,no,N,51,,231472,5740,FOL
52,,SING,CT,O2,no,N,52,,231472,5740,FOL
53,,SING,O2,HO2,no,N,53,,231472,5740,FOL
1,,DOUB,PA,O1A,no,N,1,,231473,5740,NAP
2,,SING,PA,O2A,no,N,2,,231473,5740,NAP
3,,SING,PA,O5B,no,N,3,,231473,5740,NAP
4,,SING,PA,O3,no,N,4,,231473,5740,NAP
5,,SING,O2A,HOA2,no,N,5,,231473,5740,NAP
6,,SING,O5B,C5B,no,N,6,,231473,5740,NAP
7,,SING,C5B,C4B,no,N,7,,231473,5740,NAP
8,,SING,C5B,H51A,no,N,8,,231473,5740,NAP
9,,SING,C5B,H52A,no,N,9,,231473,5740,NAP
10,,SING,C4B,O4B,no,N,10,,231473,5740,NAP
11,,SING,C4B,C3B,no,N,11,,231473,5740,NAP
12,,SING,C4B,H4B,no,N,12,,231473,5740,NAP
13,,SING,O4B,C1B,no,N,13,,231473,5740,NAP
14,,SING,C3B,O3B,no,N,14,,231473,5740,NAP
15,,SING,C3B,C2B,no,N,15,,231473,5740,NAP
16,,SING,C3B,H3B,no,N,16,,231473,5740,NAP
17,,SING,O3B,HO3A,no,N,17,,231473,5740,NAP
18,,SING,C2B,O2B,no,N,18,,231473,5740,NAP
19,,SING,C2B,C1B,no,N,19,,231473,5740,NAP
20,,SING,C2B,H2B,no,N,20,,231473,5740,NAP
21,,SING,O2B,P2B,no,N,21,,231473,5740,NAP
22,,SING,C1B,N9A,no,N,22,,231473,5740,NAP
23,,SING,C1B,H1B,no,N,23,,231473,5740,NAP
24,,SING,N9A,C8A,yes,N,24,,231473,5740,NAP
25,,SING,N9A,C4A,yes,N,25,,231473,5740,NAP
26,,DOUB,C8A,N7A,yes,N,26,,231473,5740,NAP
27,,SING,C8A,H8A,no,N,27,,231473,5740,NAP
28,,SING,N7A,C5A,yes,N,28,,231473,5740,NAP
29,,SING,C5A,C6A,yes,N,29,,231473,5740,NAP
30,,DOUB,C5A,C4A,yes,N,30,,231473,5740,NAP
31,,SING,C6A,N6A,no,N,31,,231473,5740,NAP
32,,DOUB,C6A,N1A,yes,N,32,,231473,5740,NAP
33,,SING,N6A,H61A,no,N,33,,231473,5740,NAP
34,,SING,N6A,H62A,no,N,34,,231473,5740,NAP
35,,SING,N1A,C2A,yes,N,35,,231473,5740,NAP
36,,DOUB,C2A,N3A,yes,N,36,,231473,5740,NAP
37,,SING,C2A,H2A,no,N,37,,231473,5740,NAP
38,,SING,N3A,C4A,yes,N,38,,231473,5740,NAP
39,,SING,O3,PN,no,N,39,,231473,5740,NAP
40,,DOUB,PN,O1N,no,N,40,,231473,5740,NAP
41,,SING,PN,O2N,no,N,41,,231473,5740,NAP
42,,SING,PN,O5D,no,N,42,,231473,5740,NAP
43,,SING,O5D,C5D,no,N,43,,231473,5740,NAP
44,,SING,C5D,C4D,no,N,44,,231473,5740,NAP
45,,SING,C5D,H51N,no,N,45,,231473,5740,NAP
46,,SING,C5D,H52N,no,N,46,,231473,5740,NAP
47,,SING,C4D,O4D,no,N,47,,231473,5740,NAP
48,,SING,C4D,C3D,no,N,48,,231473,5740,NAP
49,,SING,C4D,H4D,no,N,49,,231473,5740,NAP
50,,SING,O4D,C1D,no,N,50,,231473,5740,NAP
51,,SING,C3D,O3D,no,N,51,,231473,5740,NAP
52,,SING,C3D,C2D,no,N,52,,231473,5740,NAP
53,,SING,C3D,H3D,no,N,53,,231473,5740,NAP
54,,SING,O3D,HO3N,no,N,54,,231473,5740,NAP
55,,SING,C2D,O2D,no,N,55,,231473,5740,NAP
56,,SING,C2D,C1D,no,N,56,,231473,5740,NAP
57,,SING,C2D,H2D,no,N,57,,231473,5740,NAP
58,,SING,O2D,HO2N,no,N,58,,231473,5740,NAP
59,,SING,C1D,N1N,no,N,59,,231473,5740,NAP
60,,SING,C1D,H1D,no,N,60,,231473,5740,NAP
61,,SING,N1N,C2N,yes,N,61,,231473,5740,NAP
62,,DOUB,N1N,C6N,yes,N,62,,231473,5740,NAP
63,,DOUB,C2N,C3N,yes,N,63,,231473,5740,NAP
64,,SING,C2N,H2N,no,N,64,,231473,5740,NAP
65,,SING,C3N,C7N,no,N,65,,231473,5740,NAP
66,,SING,C3N,C4N,yes,N,66,,231473,5740,NAP
67,,DOUB,C7N,O7N,no,N,67,,231473,5740,NAP
68,,SING,C7N,N7N,no,N,68,,231473,5740,NAP
69,,SING,N7N,H71N,no,N,69,,231473,5740,NAP
70,,SING,N7N,H72N,no,N,70,,231473,5740,NAP
71,,DOUB,C4N,C5N,yes,N,71,,231473,5740,NAP
72,,SING,C4N,H4N,no,N,72,,231473,5740,NAP
73,,SING,C5N,C6N,yes,N,73,,231473,5740,NAP
74,,SING,C5N,H5N,no,N,74,,231473,5740,NAP
75,,SING,C6N,H6N,no,N,75,,231473,5740,NAP
76,,DOUB,P2B,O1X,no,N,76,,231473,5740,NAP
77,,SING,P2B,O2X,no,N,77,,231473,5740,NAP
78,,SING,P2B,O3X,no,N,78,,231473,5740,NAP
79,,SING,O2X,HOP2,no,N,79,,231473,5740,NAP
80,,SING,O3X,HOP3,no,N,80,,231473,5740,NAP
1,,SING,N1,C2,yes,N,1,,231495,5741,FOL
2,,SING,N1,C8A,yes,N,2,,231495,5741,FOL
3,,SING,N1,HN1,no,N,3,,231495,5741,FOL
4,,SING,C2,NA2,no,N,4,,231495,5741,FOL
5,,DOUB,C2,N3,yes,N,5,,231495,5741,FOL
6,,SING,NA2,HN21,no,N,6,,231495,5741,FOL
7,,SING,NA2,HN22,no,N,7,,231495,5741,FOL
8,,SING,N3,C4,yes,N,8,,231495,5741,FOL
9,,DOUB,C4,O4,no,N,9,,231495,5741,FOL
10,,SING,C4,C4A,yes,N,10,,231495,5741,FOL
11,,SING,C4A,N5,yes,N,11,,231495,5741,FOL
12,,DOUB,C4A,C8A,yes,N,12,,231495,5741,FOL
13,,DOUB,N5,C6,yes,N,13,,231495,5741,FOL
14,,SING,C6,C7,yes,N,14,,231495,5741,FOL
15,,SING,C6,C9,no,N,15,,231495,5741,FOL
16,,DOUB,C7,N8,yes,N,16,,231495,5741,FOL
17,,SING,C7,H7,no,N,17,,231495,5741,FOL
18,,SING,N8,C8A,yes,N,18,,231495,5741,FOL
19,,SING,C9,N10,no,N,19,,231495,5741,FOL
20,,SING,C9,H91,no,N,20,,231495,5741,FOL
21,,SING,C9,H92,no,N,21,,231495,5741,FOL
22,,SING,N10,C14,no,N,22,,231495,5741,FOL
23,,SING,N10,HN0,no,N,23,,231495,5741,FOL
24,,DOUB,C11,C12,yes,N,24,,231495,5741,FOL
25,,SING,C11,C16,yes,N,25,,231495,5741,FOL
26,,SING,C11,C,no,N,26,,231495,5741,FOL
27,,SING,C12,C13,yes,N,27,,231495,5741,FOL
28,,SING,C12,H12,no,N,28,,231495,5741,FOL
29,,DOUB,C13,C14,yes,N,29,,231495,5741,FOL
30,,SING,C13,H13,no,N,30,,231495,5741,FOL
31,,SING,C14,C15,yes,N,31,,231495,5741,FOL
32,,DOUB,C15,C16,yes,N,32,,231495,5741,FOL
33,,SING,C15,H15,no,N,33,,231495,5741,FOL
34,,SING,C16,H16,no,N,34,,231495,5741,FOL
35,,DOUB,C,O,no,N,35,,231495,5741,FOL
36,,SING,C,N,no,N,36,,231495,5741,FOL
37,,SING,N,CA,no,N,37,,231495,5741,FOL
38,,SING,N,HN,no,N,38,,231495,5741,FOL
39,,SING,CA,CB,no,N,39,,231495,5741,FOL
40,,SING,CA,CT,no,N,40,,231495,5741,FOL
41,,SING,CA,HA,no,N,41,,231495,5741,FOL
42,,SING,CB,CG,no,N,42,,231495,5741,FOL
43,,SING,CB,HB1,no,N,43,,231495,5741,FOL
44,,SING,CB,HB2,no,N,44,,231495,5741,FOL
45,,SING,CG,CD,no,N,45,,231495,5741,FOL
46,,SING,CG,HG1,no,N,46,,231495,5741,FOL
47,,SING,CG,HG2,no,N,47,,231495,5741,FOL
48,,DOUB,CD,OE1,no,N,48,,231495,5741,FOL
49,,SING,CD,OE2,no,N,49,,231495,5741,FOL
50,,SING,OE2,HOE2,no,N,50,,231495,5741,FOL
51,,DOUB,CT,O1,no,N,51,,231495,5741,FOL
52,,SING,CT,O2,no,N,52,,231495,5741,FOL
53,,SING,O2,HO2,no,N,53,,231495,5741,FOL
1,,DOUB,PA,O1A,no,N,1,,231496,5741,NDP
2,,SING,PA,O2A,no,N,2,,231496,5741,NDP
3,,SING,PA,O5B,no,N,3,,231496,5741,NDP
4,,SING,PA,O3,no,N,4,,231496,5741,NDP
5,,SING,O2A,HOA2,no,N,5,,231496,5741,NDP
6,,SING,O5B,C5B,no,N,6,,231496,5741,NDP
7,,SING,C5B,C4B,no,N,7,,231496,5741,NDP
8,,SING,C5B,H51A,no,N,8,,231496,5741,NDP
9,,SING,C5B,H52A,no,N,9,,231496,5741,NDP
10,,SING,C4B,O4B,no,N,10,,231496,5741,NDP
11,,SING,C4B,C3B,no,N,11,,231496,5741,NDP
12,,SING,C4B,H4B,no,N,12,,231496,5741,NDP
13,,SING,O4B,C1B,no,N,13,,231496,5741,NDP
14,,SING,C3B,O3B,no,N,14,,231496,5741,NDP
15,,SING,C3B,C2B,no,N,15,,231496,5741,NDP
16,,SING,C3B,H3B,no,N,16,,231496,5741,NDP
17,,SING,O3B,HO3A,no,N,17,,231496,5741,NDP
18,,SING,C2B,O2B,no,N,18,,231496,5741,NDP
19,,SING,C2B,C1B,no,N,19,,231496,5741,NDP
20,,SING,C2B,H2B,no,N,20,,231496,5741,NDP
21,,SING,O2B,P2B,no,N,21,,231496,5741,NDP
22,,SING,C1B,N9A,no,N,22,,231496,5741,NDP
23,,SING,C1B,H1B,no,N,23,,231496,5741,NDP
24,,SING,N9A,C8A,yes,N,24,,231496,5741,NDP
25,,SING,N9A,C4A,yes,N,25,,231496,5741,NDP
26,,DOUB,C8A,N7A,yes,N,26,,231496,5741,NDP
27,,SING,C8A,H8A,no,N,27,,231496,5741,NDP
28,,SING,N7A,C5A,yes,N,28,,231496,5741,NDP
29,,SING,C5A,C6A,yes,N,29,,231496,5741,NDP
30,,DOUB,C5A,C4A,yes,N,30,,231496,5741,NDP
31,,SING,C6A,N6A,no,N,31,,231496,5741,NDP
32,,DOUB,C6A,N1A,yes,N,32,,231496,5741,NDP
33,,SING,N6A,H61A,no,N,33,,231496,5741,NDP
34,,SING,N6A,H62A,no,N,34,,231496,5741,NDP
35,,SING,N1A,C2A,yes,N,35,,231496,5741,NDP
36,,DOUB,C2A,N3A,yes,N,36,,231496,5741,NDP
37,,SING,C2A,H2A,no,N,37,,231496,5741,NDP
38,,SING,N3A,C4A,yes,N,38,,231496,5741,NDP
39,,SING,O3,PN,no,N,39,,231496,5741,NDP
40,,DOUB,PN,O1N,no,N,40,,231496,5741,NDP
41,,SING,PN,O2N,no,N,41,,231496,5741,NDP
42,,SING,PN,O5D,no,N,42,,231496,5741,NDP
43,,SING,O2N,H21N,no,N,43,,231496,5741,NDP
44,,SING,O5D,C5D,no,N,44,,231496,5741,NDP
45,,SING,C5D,C4D,no,N,45,,231496,5741,NDP
46,,SING,C5D,H51N,no,N,46,,231496,5741,NDP
47,,SING,C5D,H52N,no,N,47,,231496,5741,NDP
48,,SING,C4D,O4D,no,N,48,,231496,5741,NDP
49,,SING,C4D,C3D,no,N,49,,231496,5741,NDP
50,,SING,C4D,H4D,no,N,50,,231496,5741,NDP
51,,SING,O4D,C1D,no,N,51,,231496,5741,NDP
52,,SING,C3D,O3D,no,N,52,,231496,5741,NDP
53,,SING,C3D,C2D,no,N,53,,231496,5741,NDP
54,,SING,C3D,H3D,no,N,54,,231496,5741,NDP
55,,SING,O3D,HO3N,no,N,55,,231496,5741,NDP
56,,SING,C2D,O2D,no,N,56,,231496,5741,NDP
57,,SING,C2D,C1D,no,N,57,,231496,5741,NDP
58,,SING,C2D,H2D,no,N,58,,231496,5741,NDP
59,,SING,O2D,HO2N,no,N,59,,231496,5741,NDP
60,,SING,C1D,N1N,no,N,60,,231496,5741,NDP
61,,SING,C1D,H1D,no,N,61,,231496,5741,NDP
62,,SING,N1N,C2N,no,N,62,,231496,5741,NDP
63,,SING,N1N,C6N,no,N,63,,231496,5741,NDP
64,,DOUB,C2N,C3N,no,N,64,,231496,5741,NDP
65,,SING,C2N,H2N,no,N,65,,231496,5741,NDP
66,,SING,C3N,C7N,no,N,66,,231496,5741,NDP
67,,SING,C3N,C4N,no,N,67,,231496,5741,NDP
68,,DOUB,C7N,O7N,no,N,68,,231496,5741,NDP
69,,SING,C7N,N7N,no,N,69,,231496,5741,NDP
70,,SING,N7N,H71N,no,N,70,,231496,5741,NDP
71,,SING,N7N,H72N,no,N,71,,231496,5741,NDP
72,,SING,C4N,C5N,no,N,72,,231496,5741,NDP
73,,SING,C4N,H41N,no,N,73,,231496,5741,NDP
74,,SING,C4N,H42N,no,N,74,,231496,5741,NDP
75,,DOUB,C5N,C6N,no,N,75,,231496,5741,NDP
76,,SING,C5N,H5N,no,N,76,,231496,5741,NDP
77,,SING,C6N,H6N,no,N,77,,231496,5741,NDP
78,,DOUB,P2B,O1X,no,N,78,,231496,5741,NDP
79,,SING,P2B,O2X,no,N,79,,231496,5741,NDP
80,,SING,P2B,O3X,no,N,80,,231496,5741,NDP
81,,SING,O2X,HOP2,no,N,81,,231496,5741,NDP
82,,SING,O3X,HOP3,no,N,82,,231496,5741,NDP
1,,SING,CHA,C1A,yes,N,1,,231588,5745,HEM
2,,DOUB,CHA,C4D,yes,N,2,,231588,5745,HEM
3,,SING,CHA,HHA,no,N,3,,231588,5745,HEM
4,,SING,CHB,C4A,yes,N,4,,231588,5745,HEM
5,,DOUB,CHB,C1B,yes,N,5,,231588,5745,HEM
6,,SING,CHB,HHB,no,N,6,,231588,5745,HEM
7,,SING,CHC,C4B,yes,N,7,,231588,5745,HEM
8,,DOUB,CHC,C1C,yes,N,8,,231588,5745,HEM
9,,SING,CHC,HHC,no,N,9,,231588,5745,HEM
10,,DOUB,CHD,C4C,yes,N,10,,231588,5745,HEM
11,,SING,CHD,C1D,yes,N,11,,231588,5745,HEM
12,,SING,CHD,HHD,no,N,12,,231588,5745,HEM
13,,DOUB,C1A,C2A,yes,N,13,,231588,5745,HEM
14,,SING,C1A,NA,yes,N,14,,231588,5745,HEM
15,,SING,C2A,C3A,yes,N,15,,231588,5745,HEM
16,,SING,C2A,CAA,no,N,16,,231588,5745,HEM
17,,DOUB,C3A,C4A,yes,N,17,,231588,5745,HEM
18,,SING,C3A,CMA,no,N,18,,231588,5745,HEM
19,,SING,C4A,NA,yes,N,19,,231588,5745,HEM
20,,SING,CMA,HMA,no,N,20,,231588,5745,HEM
21,,SING,CMA,HMAA,no,N,21,,231588,5745,HEM
22,,SING,CMA,HMAB,no,N,22,,231588,5745,HEM
23,,SING,CAA,CBA,no,N,23,,231588,5745,HEM
24,,SING,CAA,HAA,no,N,24,,231588,5745,HEM
25,,SING,CAA,HAAA,no,N,25,,231588,5745,HEM
26,,SING,CBA,CGA,no,N,26,,231588,5745,HEM
27,,SING,CBA,HBA,no,N,27,,231588,5745,HEM
28,,SING,CBA,HBAA,no,N,28,,231588,5745,HEM
29,,DOUB,CGA,O1A,no,N,29,,231588,5745,HEM
30,,SING,CGA,O2A,no,N,30,,231588,5745,HEM
31,,SING,C1B,C2B,no,N,31,,231588,5745,HEM
32,,SING,C1B,NB,yes,N,32,,231588,5745,HEM
33,,DOUB,C2B,C3B,yes,N,33,,231588,5745,HEM
34,,SING,C2B,CMB,yes,N,34,,231588,5745,HEM
35,,SING,C3B,C4B,no,N,35,,231588,5745,HEM
36,,SING,C3B,CAB,yes,N,36,,231588,5745,HEM
37,,DOUB,C4B,NB,no,N,37,,231588,5745,HEM
38,,SING,CMB,HMB,yes,N,38,,231588,5745,HEM
39,,SING,CMB,HMBA,no,N,39,,231588,5745,HEM
40,,SING,CMB,HMBB,no,N,40,,231588,5745,HEM
41,,DOUB,CAB,CBB,no,N,41,,231588,5745,HEM
42,,SING,CAB,HAB,no,N,42,,231588,5745,HEM
43,,SING,CBB,HBB,no,N,43,,231588,5745,HEM
44,,SING,CBB,HBBA,no,N,44,,231588,5745,HEM
45,,SING,C1C,C2C,no,N,45,,231588,5745,HEM
46,,SING,C1C,NC,yes,N,46,,231588,5745,HEM
47,,DOUB,C2C,C3C,yes,N,47,,231588,5745,HEM
48,,SING,C2C,CMC,yes,N,48,,231588,5745,HEM
49,,SING,C3C,C4C,no,N,49,,231588,5745,HEM
50,,SING,C3C,CAC,yes,N,50,,231588,5745,HEM
51,,SING,C4C,NC,no,N,51,,231588,5745,HEM
52,,SING,CMC,HMC,yes,N,52,,231588,5745,HEM
53,,SING,CMC,HMCA,no,N,53,,231588,5745,HEM
54,,SING,CMC,HMCB,no,N,54,,231588,5745,HEM
55,,DOUB,CAC,CBC,no,N,55,,231588,5745,HEM
56,,SING,CAC,HAC,no,N,56,,231588,5745,HEM
57,,SING,CBC,HBC,no,N,57,,231588,5745,HEM
58,,SING,CBC,HBCA,no,N,58,,231588,5745,HEM
59,,SING,C1D,C2D,no,N,59,,231588,5745,HEM
60,,DOUB,C1D,ND,yes,N,60,,231588,5745,HEM
61,,DOUB,C2D,C3D,yes,N,61,,231588,5745,HEM
62,,SING,C2D,CMD,yes,N,62,,231588,5745,HEM
63,,SING,C3D,C4D,no,N,63,,231588,5745,HEM
64,,SING,C3D,CAD,yes,N,64,,231588,5745,HEM
65,,SING,C4D,ND,no,N,65,,231588,5745,HEM
66,,SING,CMD,HMD,yes,N,66,,231588,5745,HEM
67,,SING,CMD,HMDA,no,N,67,,231588,5745,HEM
68,,SING,CMD,HMDB,no,N,68,,231588,5745,HEM
69,,SING,CAD,CBD,no,N,69,,231588,5745,HEM
70,,SING,CAD,HAD,no,N,70,,231588,5745,HEM
71,,SING,CAD,HADA,no,N,71,,231588,5745,HEM
72,,SING,CBD,CGD,no,N,72,,231588,5745,HEM
73,,SING,CBD,HBD,no,N,73,,231588,5745,HEM
74,,SING,CBD,HBDA,no,N,74,,231588,5745,HEM
75,,DOUB,CGD,O1D,no,N,75,,231588,5745,HEM
76,,SING,CGD,O2D,no,N,76,,231588,5745,HEM
77,,SING,O2A,H2A,no,N,77,,231588,5745,HEM
78,,SING,O2D,H2D,no,N,78,,231588,5745,HEM
79,,SING,FE,NA,no,N,79,,231588,5745,HEM
80,,SING,FE,NB,no,N,80,,231588,5745,HEM
81,,SING,FE,NC,no,N,81,,231588,5745,HEM
82,,SING,FE,ND,no,N,82,,231588,5745,HEM
1,,DOUB,PA,O1A,no,N,1,,231615,5746,AP5
2,,SING,PA,O2A,no,N,2,,231615,5746,AP5
3,,SING,PA,O3A,no,N,3,,231615,5746,AP5
4,,SING,PA,O5F,no,N,4,,231615,5746,AP5
5,,SING,O2A,HOA2,no,N,5,,231615,5746,AP5
6,,SING,O3A,PB,no,N,6,,231615,5746,AP5
7,,DOUB,PB,O1B,no,N,7,,231615,5746,AP5
8,,SING,PB,O2B,no,N,8,,231615,5746,AP5
9,,SING,PB,O3B,no,N,9,,231615,5746,AP5
10,,SING,O2B,HOB2,no,N,10,,231615,5746,AP5
11,,SING,O3B,PG,no,N,11,,231615,5746,AP5
12,,DOUB,PG,O1G,no,N,12,,231615,5746,AP5
13,,SING,PG,O2G,no,N,13,,231615,5746,AP5
14,,SING,PG,O3G,no,N,14,,231615,5746,AP5
15,,SING,O2G,HOG2,no,N,15,,231615,5746,AP5
16,,SING,O3G,PD,no,N,16,,231615,5746,AP5
17,,DOUB,PD,O1D,no,N,17,,231615,5746,AP5
18,,SING,PD,O2D,no,N,18,,231615,5746,AP5
19,,SING,PD,O3D,no,N,19,,231615,5746,AP5
20,,SING,O2D,HOD2,no,N,20,,231615,5746,AP5
21,,SING,O3D,PE,no,N,21,,231615,5746,AP5
22,,DOUB,PE,O1E,no,N,22,,231615,5746,AP5
23,,SING,PE,O2E,no,N,23,,231615,5746,AP5
24,,SING,PE,O5J,no,N,24,,231615,5746,AP5
25,,SING,O2E,HOE2,no,N,25,,231615,5746,AP5
26,,SING,O5F,C5F,no,N,26,,231615,5746,AP5
27,,SING,C5F,C4F,no,N,27,,231615,5746,AP5
28,,SING,C5F,H51A,no,N,28,,231615,5746,AP5
29,,SING,C5F,H52A,no,N,29,,231615,5746,AP5
30,,SING,C4F,O4F,no,N,30,,231615,5746,AP5
31,,SING,C4F,C3F,no,N,31,,231615,5746,AP5
32,,SING,C4F,H4F,no,N,32,,231615,5746,AP5
33,,SING,O4F,C1F,no,N,33,,231615,5746,AP5
34,,SING,C3F,O3F,no,N,34,,231615,5746,AP5
35,,SING,C3F,C2F,no,N,35,,231615,5746,AP5
36,,SING,C3F,H3F,no,N,36,,231615,5746,AP5
37,,SING,O3F,HO3A,no,N,37,,231615,5746,AP5
38,,SING,C2F,O2F,no,N,38,,231615,5746,AP5
39,,SING,C2F,C1F,no,N,39,,231615,5746,AP5
40,,SING,C2F,H2F,no,N,40,,231615,5746,AP5
41,,SING,O2F,HO2A,no,N,41,,231615,5746,AP5
42,,SING,C1F,N9A,no,N,42,,231615,5746,AP5
43,,SING,C1F,H1F,no,N,43,,231615,5746,AP5
44,,SING,N9A,C8A,yes,N,44,,231615,5746,AP5
45,,SING,N9A,C4A,yes,N,45,,231615,5746,AP5
46,,DOUB,C8A,N7A,yes,N,46,,231615,5746,AP5
47,,SING,C8A,H8A,no,N,47,,231615,5746,AP5
48,,SING,N7A,C5A,yes,N,48,,231615,5746,AP5
49,,SING,C5A,C6A,yes,N,49,,231615,5746,AP5
50,,DOUB,C5A,C4A,yes,N,50,,231615,5746,AP5
51,,SING,C6A,N6A,no,N,51,,231615,5746,AP5
52,,DOUB,C6A,N1A,yes,N,52,,231615,5746,AP5
53,,SING,N6A,H61A,no,N,53,,231615,5746,AP5
54,,SING,N6A,H62A,no,N,54,,231615,5746,AP5
55,,SING,N1A,C2A,yes,N,55,,231615,5746,AP5
56,,DOUB,C2A,N3A,yes,N,56,,231615,5746,AP5
57,,SING,C2A,H2A,no,N,57,,231615,5746,AP5
58,,SING,N3A,C4A,yes,N,58,,231615,5746,AP5
59,,SING,O5J,C5J,no,N,59,,231615,5746,AP5
60,,SING,C5J,C4J,no,N,60,,231615,5746,AP5
61,,SING,C5J,H51B,no,N,61,,231615,5746,AP5
62,,SING,C5J,H52B,no,N,62,,231615,5746,AP5
63,,SING,C4J,O4J,no,N,63,,231615,5746,AP5
64,,SING,C4J,C3J,no,N,64,,231615,5746,AP5
65,,SING,C4J,H4J,no,N,65,,231615,5746,AP5
66,,SING,O4J,C1J,no,N,66,,231615,5746,AP5
67,,SING,C3J,O3J,no,N,67,,231615,5746,AP5
68,,SING,C3J,C2J,no,N,68,,231615,5746,AP5
69,,SING,C3J,H3J,no,N,69,,231615,5746,AP5
70,,SING,O3J,HO3B,no,N,70,,231615,5746,AP5
71,,SING,C2J,O2J,no,N,71,,231615,5746,AP5
72,,SING,C2J,C1J,no,N,72,,231615,5746,AP5
73,,SING,C2J,H2J,no,N,73,,231615,5746,AP5
74,,SING,O2J,HO2B,no,N,74,,231615,5746,AP5
75,,SING,C1J,N9B,no,N,75,,231615,5746,AP5
76,,SING,C1J,H1J,no,N,76,,231615,5746,AP5
77,,SING,N9B,C8B,yes,N,77,,231615,5746,AP5
78,,SING,N9B,C4B,yes,N,78,,231615,5746,AP5
79,,DOUB,C8B,N7B,yes,N,79,,231615,5746,AP5
80,,SING,C8B,H8B,no,N,80,,231615,5746,AP5
81,,SING,N7B,C5B,yes,N,81,,231615,5746,AP5
82,,SING,C5B,C6B,yes,N,82,,231615,5746,AP5
83,,DOUB,C5B,C4B,yes,N,83,,231615,5746,AP5
84,,SING,C6B,N6B,no,N,84,,231615,5746,AP5
85,,DOUB,C6B,N1B,yes,N,85,,231615,5746,AP5
86,,SING,N6B,H61B,no,N,86,,231615,5746,AP5
87,,SING,N6B,H62B,no,N,87,,231615,5746,AP5
88,,SING,N1B,C2B,yes,N,88,,231615,5746,AP5
89,,DOUB,C2B,N3B,yes,N,89,,231615,5746,AP5
90,,SING,C2B,H2B,no,N,90,,231615,5746,AP5
91,,SING,N3B,C4B,yes,N,91,,231615,5746,AP5
1,,DOUB,C,O,no,N,1,,231641,5747,ACE
2,,SING,C,CH3,no,N,2,,231641,5747,ACE
3,,SING,C,H,no,N,3,,231641,5747,ACE
4,,SING,CH3,H1,no,N,4,,231641,5747,ACE
5,,SING,CH3,H2,no,N,5,,231641,5747,ACE
6,,SING,CH3,H3,no,N,6,,231641,5747,ACE
1,,SING,N,HN1,no,N,1,,231642,5747,NH2
2,,SING,N,HN2,no,N,2,,231642,5747,NH2
1,,SING,CHA,C1A,yes,N,1,,231882,5759,HEM
2,,DOUB,CHA,C4D,yes,N,2,,231882,5759,HEM
3,,SING,CHA,HHA,no,N,3,,231882,5759,HEM
4,,SING,CHB,C4A,yes,N,4,,231882,5759,HEM
5,,DOUB,CHB,C1B,yes,N,5,,231882,5759,HEM
6,,SING,CHB,HHB,no,N,6,,231882,5759,HEM
7,,SING,CHC,C4B,yes,N,7,,231882,5759,HEM
8,,DOUB,CHC,C1C,yes,N,8,,231882,5759,HEM
9,,SING,CHC,HHC,no,N,9,,231882,5759,HEM
10,,DOUB,CHD,C4C,yes,N,10,,231882,5759,HEM
11,,SING,CHD,C1D,yes,N,11,,231882,5759,HEM
12,,SING,CHD,HHD,no,N,12,,231882,5759,HEM
13,,DOUB,C1A,C2A,yes,N,13,,231882,5759,HEM
14,,SING,C1A,NA,yes,N,14,,231882,5759,HEM
15,,SING,C2A,C3A,yes,N,15,,231882,5759,HEM
16,,SING,C2A,CAA,no,N,16,,231882,5759,HEM
17,,DOUB,C3A,C4A,yes,N,17,,231882,5759,HEM
18,,SING,C3A,CMA,no,N,18,,231882,5759,HEM
19,,SING,C4A,NA,yes,N,19,,231882,5759,HEM
20,,SING,CMA,HMA,no,N,20,,231882,5759,HEM
21,,SING,CMA,HMAA,no,N,21,,231882,5759,HEM
22,,SING,CMA,HMAB,no,N,22,,231882,5759,HEM
23,,SING,CAA,CBA,no,N,23,,231882,5759,HEM
24,,SING,CAA,HAA,no,N,24,,231882,5759,HEM
25,,SING,CAA,HAAA,no,N,25,,231882,5759,HEM
26,,SING,CBA,CGA,no,N,26,,231882,5759,HEM
27,,SING,CBA,HBA,no,N,27,,231882,5759,HEM
28,,SING,CBA,HBAA,no,N,28,,231882,5759,HEM
29,,DOUB,CGA,O1A,no,N,29,,231882,5759,HEM
30,,SING,CGA,O2A,no,N,30,,231882,5759,HEM
31,,SING,C1B,C2B,no,N,31,,231882,5759,HEM
32,,SING,C1B,NB,yes,N,32,,231882,5759,HEM
33,,DOUB,C2B,C3B,yes,N,33,,231882,5759,HEM
34,,SING,C2B,CMB,yes,N,34,,231882,5759,HEM
35,,SING,C3B,C4B,no,N,35,,231882,5759,HEM
36,,SING,C3B,CAB,yes,N,36,,231882,5759,HEM
37,,DOUB,C4B,NB,no,N,37,,231882,5759,HEM
38,,SING,CMB,HMB,yes,N,38,,231882,5759,HEM
39,,SING,CMB,HMBA,no,N,39,,231882,5759,HEM
40,,SING,CMB,HMBB,no,N,40,,231882,5759,HEM
41,,DOUB,CAB,CBB,no,N,41,,231882,5759,HEM
42,,SING,CAB,HAB,no,N,42,,231882,5759,HEM
43,,SING,CBB,HBB,no,N,43,,231882,5759,HEM
44,,SING,CBB,HBBA,no,N,44,,231882,5759,HEM
45,,SING,C1C,C2C,no,N,45,,231882,5759,HEM
46,,SING,C1C,NC,yes,N,46,,231882,5759,HEM
47,,DOUB,C2C,C3C,yes,N,47,,231882,5759,HEM
48,,SING,C2C,CMC,yes,N,48,,231882,5759,HEM
49,,SING,C3C,C4C,no,N,49,,231882,5759,HEM
50,,SING,C3C,CAC,yes,N,50,,231882,5759,HEM
51,,SING,C4C,NC,no,N,51,,231882,5759,HEM
52,,SING,CMC,HMC,yes,N,52,,231882,5759,HEM
53,,SING,CMC,HMCA,no,N,53,,231882,5759,HEM
54,,SING,CMC,HMCB,no,N,54,,231882,5759,HEM
55,,DOUB,CAC,CBC,no,N,55,,231882,5759,HEM
56,,SING,CAC,HAC,no,N,56,,231882,5759,HEM
57,,SING,CBC,HBC,no,N,57,,231882,5759,HEM
58,,SING,CBC,HBCA,no,N,58,,231882,5759,HEM
59,,SING,C1D,C2D,no,N,59,,231882,5759,HEM
60,,DOUB,C1D,ND,yes,N,60,,231882,5759,HEM
61,,DOUB,C2D,C3D,yes,N,61,,231882,5759,HEM
62,,SING,C2D,CMD,yes,N,62,,231882,5759,HEM
63,,SING,C3D,C4D,no,N,63,,231882,5759,HEM
64,,SING,C3D,CAD,yes,N,64,,231882,5759,HEM
65,,SING,C4D,ND,no,N,65,,231882,5759,HEM
66,,SING,CMD,HMD,yes,N,66,,231882,5759,HEM
67,,SING,CMD,HMDA,no,N,67,,231882,5759,HEM
68,,SING,CMD,HMDB,no,N,68,,231882,5759,HEM
69,,SING,CAD,CBD,no,N,69,,231882,5759,HEM
70,,SING,CAD,HAD,no,N,70,,231882,5759,HEM
71,,SING,CAD,HADA,no,N,71,,231882,5759,HEM
72,,SING,CBD,CGD,no,N,72,,231882,5759,HEM
73,,SING,CBD,HBD,no,N,73,,231882,5759,HEM
74,,SING,CBD,HBDA,no,N,74,,231882,5759,HEM
75,,DOUB,CGD,O1D,no,N,75,,231882,5759,HEM
76,,SING,CGD,O2D,no,N,76,,231882,5759,HEM
77,,SING,O2A,H2A,no,N,77,,231882,5759,HEM
78,,SING,O2D,H2D,no,N,78,,231882,5759,HEM
79,,SING,FE,NA,no,N,79,,231882,5759,HEM
80,,SING,FE,NB,no,N,80,,231882,5759,HEM
81,,SING,FE,NC,no,N,81,,231882,5759,HEM
82,,SING,FE,ND,no,N,82,,231882,5759,HEM
1,,SING,OP3,P,no,N,1,,232231,5775,DU
2,,SING,OP3,HOP3,no,N,2,,232231,5775,DU
3,,DOUB,P,OP1,no,N,3,,232231,5775,DU
4,,SING,P,OP2,no,N,4,,232231,5775,DU
5,,SING,P,O5',no,N,5,,232231,5775,DU
6,,SING,OP2,HOP2,no,N,6,,232231,5775,DU
7,,SING,O5',C5',no,N,7,,232231,5775,DU
8,,SING,C5',C4',no,N,8,,232231,5775,DU
9,,SING,C5',H5',no,N,9,,232231,5775,DU
10,,SING,C5',H5'',no,N,10,,232231,5775,DU
11,,SING,C4',O4',no,N,11,,232231,5775,DU
12,,SING,C4',C3',no,N,12,,232231,5775,DU
13,,SING,C4',H4',no,N,13,,232231,5775,DU
14,,SING,O4',C1',no,N,14,,232231,5775,DU
15,,SING,C3',O3',no,N,15,,232231,5775,DU
16,,SING,C3',C2',no,N,16,,232231,5775,DU
17,,SING,C3',H3',no,N,17,,232231,5775,DU
18,,SING,O3',HO3',no,N,18,,232231,5775,DU
19,,SING,C2',C1',no,N,19,,232231,5775,DU
20,,SING,C2',H2',no,N,20,,232231,5775,DU
21,,SING,C2',H2'',no,N,21,,232231,5775,DU
22,,SING,C1',N1,no,N,22,,232231,5775,DU
23,,SING,C1',H1',no,N,23,,232231,5775,DU
24,,SING,N1,C2,no,N,24,,232231,5775,DU
25,,SING,N1,C6,no,N,25,,232231,5775,DU
26,,DOUB,C2,O2,no,N,26,,232231,5775,DU
27,,SING,C2,N3,no,N,27,,232231,5775,DU
28,,SING,N3,C4,no,N,28,,232231,5775,DU
29,,SING,N3,H3,no,N,29,,232231,5775,DU
30,,DOUB,C4,O4,no,N,30,,232231,5775,DU
31,,SING,C4,C5,no,N,31,,232231,5775,DU
32,,DOUB,C5,C6,no,N,32,,232231,5775,DU
33,,SING,C5,H5,no,N,33,,232231,5775,DU
34,,SING,C6,H6,no,N,34,,232231,5775,DU
1,,SING,OP3,P,no,N,1,,232251,5776,PDU
2,,SING,OP3,HOP3,no,N,2,,232251,5776,PDU
3,,DOUB,P,OP1,no,N,3,,232251,5776,PDU
4,,SING,P,OP2,no,N,4,,232251,5776,PDU
5,,SING,P,O5',no,N,5,,232251,5776,PDU
6,,SING,OP2,HOP2,no,N,6,,232251,5776,PDU
7,,SING,O5',C5',no,N,7,,232251,5776,PDU
8,,SING,C5',C4',no,N,8,,232251,5776,PDU
9,,SING,C5',H5',no,N,9,,232251,5776,PDU
10,,SING,C5',H5'',no,N,10,,232251,5776,PDU
11,,SING,C4',O4',no,N,11,,232251,5776,PDU
12,,SING,C4',C3',no,N,12,,232251,5776,PDU
13,,SING,C4',H4',no,N,13,,232251,5776,PDU
14,,SING,O4',C1',no,N,14,,232251,5776,PDU
15,,SING,C3',O3',no,N,15,,232251,5776,PDU
16,,SING,C3',C2',no,N,16,,232251,5776,PDU
17,,SING,C3',H3',no,N,17,,232251,5776,PDU
18,,SING,O3',HO3',no,N,18,,232251,5776,PDU
19,,SING,C2',C1',no,N,19,,232251,5776,PDU
20,,SING,C2',H2'',no,N,20,,232251,5776,PDU
21,,SING,C2',H2',no,N,21,,232251,5776,PDU
22,,SING,C1',N1,no,N,22,,232251,5776,PDU
23,,SING,C1',H1',no,N,23,,232251,5776,PDU
24,,SING,N1,C2,no,N,24,,232251,5776,PDU
25,,SING,N1,C6,no,N,25,,232251,5776,PDU
26,,DOUB,C2,O2,no,N,26,,232251,5776,PDU
27,,SING,C2,N3,no,N,27,,232251,5776,PDU
28,,SING,N3,C4,no,N,28,,232251,5776,PDU
29,,SING,N3,H3,no,N,29,,232251,5776,PDU
30,,DOUB,C4,O4,no,N,30,,232251,5776,PDU
31,,SING,C4,C5,no,N,31,,232251,5776,PDU
32,,SING,C5,C5A,no,N,32,,232251,5776,PDU
33,,DOUB,C5,C6,no,N,33,,232251,5776,PDU
34,,SING,C5A,C5B,no,N,34,,232251,5776,PDU
35,,SING,C5A,H5A1,no,N,35,,232251,5776,PDU
36,,SING,C5A,H5A2,no,N,36,,232251,5776,PDU
37,,SING,C5B,C5M,no,N,37,,232251,5776,PDU
38,,SING,C5B,H5B1,no,N,38,,232251,5776,PDU
39,,SING,C5B,H5B2,no,N,39,,232251,5776,PDU
40,,SING,C5M,H71,no,N,40,,232251,5776,PDU
41,,SING,C5M,H72,no,N,41,,232251,5776,PDU
42,,SING,C5M,H73,no,N,42,,232251,5776,PDU
43,,SING,C6,H6,no,N,43,,232251,5776,PDU
1,,SING,OP3,P,no,N,1,,232252,5776,5PC
2,,SING,OP3,HOP3,no,N,2,,232252,5776,5PC
3,,DOUB,P,OP1,no,N,3,,232252,5776,5PC
4,,SING,P,OP2,no,N,4,,232252,5776,5PC
5,,SING,P,O5',no,N,5,,232252,5776,5PC
6,,SING,OP2,HOP2,no,N,6,,232252,5776,5PC
7,,SING,C5',O5',no,N,7,,232252,5776,5PC
8,,SING,C5',C4',no,N,8,,232252,5776,5PC
9,,SING,C5',H5',no,N,9,,232252,5776,5PC
10,,SING,C5',H5'',no,N,10,,232252,5776,5PC
11,,SING,C4',O4',no,N,11,,232252,5776,5PC
12,,SING,C4',C3',no,N,12,,232252,5776,5PC
13,,SING,C4',H4',no,N,13,,232252,5776,5PC
14,,SING,O4',C1',no,N,14,,232252,5776,5PC
15,,SING,C3',O3',no,N,15,,232252,5776,5PC
16,,SING,C3',C2',no,N,16,,232252,5776,5PC
17,,SING,C3',H3',no,N,17,,232252,5776,5PC
18,,SING,O3',HO3',no,N,18,,232252,5776,5PC
19,,SING,C2',C1',no,N,19,,232252,5776,5PC
20,,SING,C2',H2',no,N,20,,232252,5776,5PC
21,,SING,C2',H2'',no,N,21,,232252,5776,5PC
22,,SING,C1',N1,no,N,22,,232252,5776,5PC
23,,SING,C1',H1',no,N,23,,232252,5776,5PC
24,,SING,N1,C2,no,N,24,,232252,5776,5PC
25,,SING,N1,C6,no,N,25,,232252,5776,5PC
26,,DOUB,C2,O2,no,N,26,,232252,5776,5PC
27,,SING,C2,N3,no,N,27,,232252,5776,5PC
28,,DOUB,N3,C4,no,N,28,,232252,5776,5PC
29,,SING,C4,N4,no,N,29,,232252,5776,5PC
30,,SING,C4,C5,no,N,30,,232252,5776,5PC
31,,SING,N4,H41,no,N,31,,232252,5776,5PC
32,,SING,N4,H42,no,N,32,,232252,5776,5PC
33,,DOUB,C5,C6,no,N,33,,232252,5776,5PC
34,,SING,C5,C7,no,N,34,,232252,5776,5PC
35,,SING,C6,H6,no,N,35,,232252,5776,5PC
36,,TRIP,C7,C8,no,N,36,,232252,5776,5PC
37,,SING,C8,C9,no,N,37,,232252,5776,5PC
38,,SING,C9,H91,no,N,38,,232252,5776,5PC
39,,SING,C9,H92,no,N,39,,232252,5776,5PC
40,,SING,C9,H93,no,N,40,,232252,5776,5PC
1,,SING,OP3,P,no,N,1,,232273,5777,PDU
2,,SING,OP3,HOP3,no,N,2,,232273,5777,PDU
3,,DOUB,P,OP1,no,N,3,,232273,5777,PDU
4,,SING,P,OP2,no,N,4,,232273,5777,PDU
5,,SING,P,O5',no,N,5,,232273,5777,PDU
6,,SING,OP2,HOP2,no,N,6,,232273,5777,PDU
7,,SING,O5',C5',no,N,7,,232273,5777,PDU
8,,SING,C5',C4',no,N,8,,232273,5777,PDU
9,,SING,C5',H5',no,N,9,,232273,5777,PDU
10,,SING,C5',H5'',no,N,10,,232273,5777,PDU
11,,SING,C4',O4',no,N,11,,232273,5777,PDU
12,,SING,C4',C3',no,N,12,,232273,5777,PDU
13,,SING,C4',H4',no,N,13,,232273,5777,PDU
14,,SING,O4',C1',no,N,14,,232273,5777,PDU
15,,SING,C3',O3',no,N,15,,232273,5777,PDU
16,,SING,C3',C2',no,N,16,,232273,5777,PDU
17,,SING,C3',H3',no,N,17,,232273,5777,PDU
18,,SING,O3',HO3',no,N,18,,232273,5777,PDU
19,,SING,C2',C1',no,N,19,,232273,5777,PDU
20,,SING,C2',H2'',no,N,20,,232273,5777,PDU
21,,SING,C2',H2',no,N,21,,232273,5777,PDU
22,,SING,C1',N1,no,N,22,,232273,5777,PDU
23,,SING,C1',H1',no,N,23,,232273,5777,PDU
24,,SING,N1,C2,no,N,24,,232273,5777,PDU
25,,SING,N1,C6,no,N,25,,232273,5777,PDU
26,,DOUB,C2,O2,no,N,26,,232273,5777,PDU
27,,SING,C2,N3,no,N,27,,232273,5777,PDU
28,,SING,N3,C4,no,N,28,,232273,5777,PDU
29,,SING,N3,H3,no,N,29,,232273,5777,PDU
30,,DOUB,C4,O4,no,N,30,,232273,5777,PDU
31,,SING,C4,C5,no,N,31,,232273,5777,PDU
32,,SING,C5,C5A,no,N,32,,232273,5777,PDU
33,,DOUB,C5,C6,no,N,33,,232273,5777,PDU
34,,SING,C5A,C5B,no,N,34,,232273,5777,PDU
35,,SING,C5A,H5A1,no,N,35,,232273,5777,PDU
36,,SING,C5A,H5A2,no,N,36,,232273,5777,PDU
37,,SING,C5B,C5M,no,N,37,,232273,5777,PDU
38,,SING,C5B,H5B1,no,N,38,,232273,5777,PDU
39,,SING,C5B,H5B2,no,N,39,,232273,5777,PDU
40,,SING,C5M,H71,no,N,40,,232273,5777,PDU
41,,SING,C5M,H72,no,N,41,,232273,5777,PDU
42,,SING,C5M,H73,no,N,42,,232273,5777,PDU
43,,SING,C6,H6,no,N,43,,232273,5777,PDU
1,,SING,OP3,P,no,N,1,,232274,5777,5PC
2,,SING,OP3,HOP3,no,N,2,,232274,5777,5PC
3,,DOUB,P,OP1,no,N,3,,232274,5777,5PC
4,,SING,P,OP2,no,N,4,,232274,5777,5PC
5,,SING,P,O5',no,N,5,,232274,5777,5PC
6,,SING,OP2,HOP2,no,N,6,,232274,5777,5PC
7,,SING,C5',O5',no,N,7,,232274,5777,5PC
8,,SING,C5',C4',no,N,8,,232274,5777,5PC
9,,SING,C5',H5',no,N,9,,232274,5777,5PC
10,,SING,C5',H5'',no,N,10,,232274,5777,5PC
11,,SING,C4',O4',no,N,11,,232274,5777,5PC
12,,SING,C4',C3',no,N,12,,232274,5777,5PC
13,,SING,C4',H4',no,N,13,,232274,5777,5PC
14,,SING,O4',C1',no,N,14,,232274,5777,5PC
15,,SING,C3',O3',no,N,15,,232274,5777,5PC
16,,SING,C3',C2',no,N,16,,232274,5777,5PC
17,,SING,C3',H3',no,N,17,,232274,5777,5PC
18,,SING,O3',HO3',no,N,18,,232274,5777,5PC
19,,SING,C2',C1',no,N,19,,232274,5777,5PC
20,,SING,C2',H2',no,N,20,,232274,5777,5PC
21,,SING,C2',H2'',no,N,21,,232274,5777,5PC
22,,SING,C1',N1,no,N,22,,232274,5777,5PC
23,,SING,C1',H1',no,N,23,,232274,5777,5PC
24,,SING,N1,C2,no,N,24,,232274,5777,5PC
25,,SING,N1,C6,no,N,25,,232274,5777,5PC
26,,DOUB,C2,O2,no,N,26,,232274,5777,5PC
27,,SING,C2,N3,no,N,27,,232274,5777,5PC
28,,DOUB,N3,C4,no,N,28,,232274,5777,5PC
29,,SING,C4,N4,no,N,29,,232274,5777,5PC
30,,SING,C4,C5,no,N,30,,232274,5777,5PC
31,,SING,N4,H41,no,N,31,,232274,5777,5PC
32,,SING,N4,H42,no,N,32,,232274,5777,5PC
33,,DOUB,C5,C6,no,N,33,,232274,5777,5PC
34,,SING,C5,C7,no,N,34,,232274,5777,5PC
35,,SING,C6,H6,no,N,35,,232274,5777,5PC
36,,TRIP,C7,C8,no,N,36,,232274,5777,5PC
37,,SING,C8,C9,no,N,37,,232274,5777,5PC
38,,SING,C9,H91,no,N,38,,232274,5777,5PC
39,,SING,C9,H92,no,N,39,,232274,5777,5PC
40,,SING,C9,H93,no,N,40,,232274,5777,5PC
1,,SING,N,CA,no,N,1,,232473,5787,PCA
2,,SING,N,CD,no,N,2,,232473,5787,PCA
3,,SING,N,H,no,N,3,,232473,5787,PCA
4,,SING,CA,CB,no,N,4,,232473,5787,PCA
5,,SING,CA,C,no,N,5,,232473,5787,PCA
6,,SING,CA,HA,no,N,6,,232473,5787,PCA
7,,SING,CB,CG,no,N,7,,232473,5787,PCA
8,,SING,CB,HB2,no,N,8,,232473,5787,PCA
9,,SING,CB,HB3,no,N,9,,232473,5787,PCA
10,,SING,CG,CD,no,N,10,,232473,5787,PCA
11,,SING,CG,HG2,no,N,11,,232473,5787,PCA
12,,SING,CG,HG3,no,N,12,,232473,5787,PCA
13,,DOUB,CD,OE,no,N,13,,232473,5787,PCA
14,,DOUB,C,O,no,N,14,,232473,5787,PCA
15,,SING,C,OXT,no,N,15,,232473,5787,PCA
16,,SING,OXT,HXT,no,N,16,,232473,5787,PCA
1,,SING,N,CA,no,N,1,,232667,5795,PCA
2,,SING,N,CD,no,N,2,,232667,5795,PCA
3,,SING,N,H,no,N,3,,232667,5795,PCA
4,,SING,CA,CB,no,N,4,,232667,5795,PCA
5,,SING,CA,C,no,N,5,,232667,5795,PCA
6,,SING,CA,HA,no,N,6,,232667,5795,PCA
7,,SING,CB,CG,no,N,7,,232667,5795,PCA
8,,SING,CB,HB2,no,N,8,,232667,5795,PCA
9,,SING,CB,HB3,no,N,9,,232667,5795,PCA
10,,SING,CG,CD,no,N,10,,232667,5795,PCA
11,,SING,CG,HG2,no,N,11,,232667,5795,PCA
12,,SING,CG,HG3,no,N,12,,232667,5795,PCA
13,,DOUB,CD,OE,no,N,13,,232667,5795,PCA
14,,DOUB,C,O,no,N,14,,232667,5795,PCA
15,,SING,C,OXT,no,N,15,,232667,5795,PCA
16,,SING,OXT,HXT,no,N,16,,232667,5795,PCA
1,,SING,CHA,C1A,yes,N,1,,232842,5802,HEM
2,,DOUB,CHA,C4D,yes,N,2,,232842,5802,HEM
3,,SING,CHA,HHA,no,N,3,,232842,5802,HEM
4,,SING,CHB,C4A,yes,N,4,,232842,5802,HEM
5,,DOUB,CHB,C1B,yes,N,5,,232842,5802,HEM
6,,SING,CHB,HHB,no,N,6,,232842,5802,HEM
7,,SING,CHC,C4B,yes,N,7,,232842,5802,HEM
8,,DOUB,CHC,C1C,yes,N,8,,232842,5802,HEM
9,,SING,CHC,HHC,no,N,9,,232842,5802,HEM
10,,DOUB,CHD,C4C,yes,N,10,,232842,5802,HEM
11,,SING,CHD,C1D,yes,N,11,,232842,5802,HEM
12,,SING,CHD,HHD,no,N,12,,232842,5802,HEM
13,,DOUB,C1A,C2A,yes,N,13,,232842,5802,HEM
14,,SING,C1A,NA,yes,N,14,,232842,5802,HEM
15,,SING,C2A,C3A,yes,N,15,,232842,5802,HEM
16,,SING,C2A,CAA,no,N,16,,232842,5802,HEM
17,,DOUB,C3A,C4A,yes,N,17,,232842,5802,HEM
18,,SING,C3A,CMA,no,N,18,,232842,5802,HEM
19,,SING,C4A,NA,yes,N,19,,232842,5802,HEM
20,,SING,CMA,HMA,no,N,20,,232842,5802,HEM
21,,SING,CMA,HMAA,no,N,21,,232842,5802,HEM
22,,SING,CMA,HMAB,no,N,22,,232842,5802,HEM
23,,SING,CAA,CBA,no,N,23,,232842,5802,HEM
24,,SING,CAA,HAA,no,N,24,,232842,5802,HEM
25,,SING,CAA,HAAA,no,N,25,,232842,5802,HEM
26,,SING,CBA,CGA,no,N,26,,232842,5802,HEM
27,,SING,CBA,HBA,no,N,27,,232842,5802,HEM
28,,SING,CBA,HBAA,no,N,28,,232842,5802,HEM
29,,DOUB,CGA,O1A,no,N,29,,232842,5802,HEM
30,,SING,CGA,O2A,no,N,30,,232842,5802,HEM
31,,SING,C1B,C2B,no,N,31,,232842,5802,HEM
32,,SING,C1B,NB,yes,N,32,,232842,5802,HEM
33,,DOUB,C2B,C3B,yes,N,33,,232842,5802,HEM
34,,SING,C2B,CMB,yes,N,34,,232842,5802,HEM
35,,SING,C3B,C4B,no,N,35,,232842,5802,HEM
36,,SING,C3B,CAB,yes,N,36,,232842,5802,HEM
37,,DOUB,C4B,NB,no,N,37,,232842,5802,HEM
38,,SING,CMB,HMB,yes,N,38,,232842,5802,HEM
39,,SING,CMB,HMBA,no,N,39,,232842,5802,HEM
40,,SING,CMB,HMBB,no,N,40,,232842,5802,HEM
41,,DOUB,CAB,CBB,no,N,41,,232842,5802,HEM
42,,SING,CAB,HAB,no,N,42,,232842,5802,HEM
43,,SING,CBB,HBB,no,N,43,,232842,5802,HEM
44,,SING,CBB,HBBA,no,N,44,,232842,5802,HEM
45,,SING,C1C,C2C,no,N,45,,232842,5802,HEM
46,,SING,C1C,NC,yes,N,46,,232842,5802,HEM
47,,DOUB,C2C,C3C,yes,N,47,,232842,5802,HEM
48,,SING,C2C,CMC,yes,N,48,,232842,5802,HEM
49,,SING,C3C,C4C,no,N,49,,232842,5802,HEM
50,,SING,C3C,CAC,yes,N,50,,232842,5802,HEM
51,,SING,C4C,NC,no,N,51,,232842,5802,HEM
52,,SING,CMC,HMC,yes,N,52,,232842,5802,HEM
53,,SING,CMC,HMCA,no,N,53,,232842,5802,HEM
54,,SING,CMC,HMCB,no,N,54,,232842,5802,HEM
55,,DOUB,CAC,CBC,no,N,55,,232842,5802,HEM
56,,SING,CAC,HAC,no,N,56,,232842,5802,HEM
57,,SING,CBC,HBC,no,N,57,,232842,5802,HEM
58,,SING,CBC,HBCA,no,N,58,,232842,5802,HEM
59,,SING,C1D,C2D,no,N,59,,232842,5802,HEM
60,,DOUB,C1D,ND,yes,N,60,,232842,5802,HEM
61,,DOUB,C2D,C3D,yes,N,61,,232842,5802,HEM
62,,SING,C2D,CMD,yes,N,62,,232842,5802,HEM
63,,SING,C3D,C4D,no,N,63,,232842,5802,HEM
64,,SING,C3D,CAD,yes,N,64,,232842,5802,HEM
65,,SING,C4D,ND,no,N,65,,232842,5802,HEM
66,,SING,CMD,HMD,yes,N,66,,232842,5802,HEM
67,,SING,CMD,HMDA,no,N,67,,232842,5802,HEM
68,,SING,CMD,HMDB,no,N,68,,232842,5802,HEM
69,,SING,CAD,CBD,no,N,69,,232842,5802,HEM
70,,SING,CAD,HAD,no,N,70,,232842,5802,HEM
71,,SING,CAD,HADA,no,N,71,,232842,5802,HEM
72,,SING,CBD,CGD,no,N,72,,232842,5802,HEM
73,,SING,CBD,HBD,no,N,73,,232842,5802,HEM
74,,SING,CBD,HBDA,no,N,74,,232842,5802,HEM
75,,DOUB,CGD,O1D,no,N,75,,232842,5802,HEM
76,,SING,CGD,O2D,no,N,76,,232842,5802,HEM
77,,SING,O2A,H2A,no,N,77,,232842,5802,HEM
78,,SING,O2D,H2D,no,N,78,,232842,5802,HEM
79,,SING,FE,NA,no,N,79,,232842,5802,HEM
80,,SING,FE,NB,no,N,80,,232842,5802,HEM
81,,SING,FE,NC,no,N,81,,232842,5802,HEM
82,,SING,FE,ND,no,N,82,,232842,5802,HEM
1,,TRIP,C,N,no,N,1,,233002,5809,CYN
1,,SING,FE,NA,,,,,233003,5809,HEM_ox
2,,SING,FE,NB,,,,,233003,5809,HEM_ox
3,,SING,FE,NC,,,,,233003,5809,HEM_ox
4,,SING,FE,ND,,,,,233003,5809,HEM_ox
5,,DOUB,CHA,C1A,,,,,233003,5809,HEM_ox
6,,SING,CHA,C4D,,,,,233003,5809,HEM_ox
7,,SING,CHA,HHA,,,,,233003,5809,HEM_ox
8,,DOUB,CHB,C4A,,,,,233003,5809,HEM_ox
9,,SING,CHB,C1B,,,,,233003,5809,HEM_ox
10,,SING,CHB,HHB,,,,,233003,5809,HEM_ox
11,,DOUB,CHC,C4B,,,,,233003,5809,HEM_ox
12,,SING,CHC,C1C,,,,,233003,5809,HEM_ox
13,,SING,CHC,HHC,,,,,233003,5809,HEM_ox
14,,SING,CHD,C4C,,,,,233003,5809,HEM_ox
15,,DOUB,CHD,C1D,,,,,233003,5809,HEM_ox
16,,SING,CHD,HHD,,,,,233003,5809,HEM_ox
17,,SING,NA,C1A,,,,,233003,5809,HEM_ox
18,,SING,NA,C4A,,,,,233003,5809,HEM_ox
19,,SING,C1A,C2A,,,,,233003,5809,HEM_ox
20,,DOUB,C2A,C3A,,,,,233003,5809,HEM_ox
21,,SING,C2A,CAA,,,,,233003,5809,HEM_ox
22,,SING,C3A,C4A,,,,,233003,5809,HEM_ox
23,,SING,C3A,CMA,,,,,233003,5809,HEM_ox
24,,SING,CMA,1HMA,,,,,233003,5809,HEM_ox
25,,SING,CMA,2HMA,,,,,233003,5809,HEM_ox
26,,SING,CMA,3HMA,,,,,233003,5809,HEM_ox
27,,SING,CAA,CBA,,,,,233003,5809,HEM_ox
28,,SING,CAA,1HAA,,,,,233003,5809,HEM_ox
29,,SING,CAA,2HAA,,,,,233003,5809,HEM_ox
30,,SING,CBA,CGA,,,,,233003,5809,HEM_ox
31,,SING,CBA,1HBA,,,,,233003,5809,HEM_ox
32,,SING,CBA,2HBA,,,,,233003,5809,HEM_ox
33,,DOUB,CGA,O1A,,,,,233003,5809,HEM_ox
34,,SING,CGA,O2A,,,,,233003,5809,HEM_ox
35,,SING,O2A,H2A,,,,,233003,5809,HEM_ox
36,,DOUB,NB,C1B,,,,,233003,5809,HEM_ox
37,,SING,NB,C4B,,,,,233003,5809,HEM_ox
38,,SING,C1B,C2B,,,,,233003,5809,HEM_ox
39,,DOUB,C2B,C3B,,,,,233003,5809,HEM_ox
40,,SING,C2B,CMB,,,,,233003,5809,HEM_ox
41,,SING,C3B,C4B,,,,,233003,5809,HEM_ox
42,,SING,C3B,CAB,,,,,233003,5809,HEM_ox
43,,SING,CMB,1HMB,,,,,233003,5809,HEM_ox
44,,SING,CMB,2HMB,,,,,233003,5809,HEM_ox
45,,SING,CMB,3HMB,,,,,233003,5809,HEM_ox
46,,DOUB,CAB,CBB,,,,,233003,5809,HEM_ox
47,,SING,CAB,HAB,,,,,233003,5809,HEM_ox
48,,SING,CBB,1HBB,,,,,233003,5809,HEM_ox
49,,SING,CBB,2HBB,,,,,233003,5809,HEM_ox
50,,SING,NC,C1C,,,,,233003,5809,HEM_ox
51,,SING,NC,C4C,,,,,233003,5809,HEM_ox
52,,DOUB,C1C,C2C,,,,,233003,5809,HEM_ox
53,,SING,C2C,C3C,,,,,233003,5809,HEM_ox
54,,SING,C2C,CMC,,,,,233003,5809,HEM_ox
55,,DOUB,C3C,C4C,,,,,233003,5809,HEM_ox
56,,SING,C3C,CAC,,,,,233003,5809,HEM_ox
57,,SING,CMC,1HMC,,,,,233003,5809,HEM_ox
58,,SING,CMC,2HMC,,,,,233003,5809,HEM_ox
59,,SING,CMC,3HMC,,,,,233003,5809,HEM_ox
60,,DOUB,CAC,CBC,,,,,233003,5809,HEM_ox
61,,SING,CAC,HAC,,,,,233003,5809,HEM_ox
62,,SING,CBC,1HBC,,,,,233003,5809,HEM_ox
63,,SING,CBC,2HBC,,,,,233003,5809,HEM_ox
64,,SING,ND,C1D,,,,,233003,5809,HEM_ox
65,,DOUB,ND,C4D,,,,,233003,5809,HEM_ox
66,,SING,C1D,C2D,,,,,233003,5809,HEM_ox
67,,DOUB,C2D,C3D,,,,,233003,5809,HEM_ox
68,,SING,C2D,CMD,,,,,233003,5809,HEM_ox
69,,SING,C3D,C4D,,,,,233003,5809,HEM_ox
70,,SING,C3D,CAD,,,,,233003,5809,HEM_ox
71,,SING,CMD,1HMD,,,,,233003,5809,HEM_ox
72,,SING,CMD,2HMD,,,,,233003,5809,HEM_ox
73,,SING,CMD,3HMD,,,,,233003,5809,HEM_ox
74,,SING,CAD,CBD,,,,,233003,5809,HEM_ox
75,,SING,CAD,1HAD,,,,,233003,5809,HEM_ox
76,,SING,CAD,2HAD,,,,,233003,5809,HEM_ox
77,,SING,CBD,CGD,,,,,233003,5809,HEM_ox
78,,SING,CBD,1HBD,,,,,233003,5809,HEM_ox
79,,SING,CBD,2HBD,,,,,233003,5809,HEM_ox
80,,DOUB,CGD,O1D,,,,,233003,5809,HEM_ox
81,,SING,CGD,O2D,,,,,233003,5809,HEM_ox
82,,SING,O2D,H2D,,,,,233003,5809,HEM_ox
1,,SING,CHA,C1A,yes,N,1,,233388,5827,HEM
2,,DOUB,CHA,C4D,yes,N,2,,233388,5827,HEM
3,,SING,CHA,HHA,no,N,3,,233388,5827,HEM
4,,SING,CHB,C4A,yes,N,4,,233388,5827,HEM
5,,DOUB,CHB,C1B,yes,N,5,,233388,5827,HEM
6,,SING,CHB,HHB,no,N,6,,233388,5827,HEM
7,,SING,CHC,C4B,yes,N,7,,233388,5827,HEM
8,,DOUB,CHC,C1C,yes,N,8,,233388,5827,HEM
9,,SING,CHC,HHC,no,N,9,,233388,5827,HEM
10,,DOUB,CHD,C4C,yes,N,10,,233388,5827,HEM
11,,SING,CHD,C1D,yes,N,11,,233388,5827,HEM
12,,SING,CHD,HHD,no,N,12,,233388,5827,HEM
13,,DOUB,C1A,C2A,yes,N,13,,233388,5827,HEM
14,,SING,C1A,NA,yes,N,14,,233388,5827,HEM
15,,SING,C2A,C3A,yes,N,15,,233388,5827,HEM
16,,SING,C2A,CAA,no,N,16,,233388,5827,HEM
17,,DOUB,C3A,C4A,yes,N,17,,233388,5827,HEM
18,,SING,C3A,CMA,no,N,18,,233388,5827,HEM
19,,SING,C4A,NA,yes,N,19,,233388,5827,HEM
20,,SING,CMA,HMA,no,N,20,,233388,5827,HEM
21,,SING,CMA,HMAA,no,N,21,,233388,5827,HEM
22,,SING,CMA,HMAB,no,N,22,,233388,5827,HEM
23,,SING,CAA,CBA,no,N,23,,233388,5827,HEM
24,,SING,CAA,HAA,no,N,24,,233388,5827,HEM
25,,SING,CAA,HAAA,no,N,25,,233388,5827,HEM
26,,SING,CBA,CGA,no,N,26,,233388,5827,HEM
27,,SING,CBA,HBA,no,N,27,,233388,5827,HEM
28,,SING,CBA,HBAA,no,N,28,,233388,5827,HEM
29,,DOUB,CGA,O1A,no,N,29,,233388,5827,HEM
30,,SING,CGA,O2A,no,N,30,,233388,5827,HEM
31,,SING,C1B,C2B,no,N,31,,233388,5827,HEM
32,,SING,C1B,NB,yes,N,32,,233388,5827,HEM
33,,DOUB,C2B,C3B,yes,N,33,,233388,5827,HEM
34,,SING,C2B,CMB,yes,N,34,,233388,5827,HEM
35,,SING,C3B,C4B,no,N,35,,233388,5827,HEM
36,,SING,C3B,CAB,yes,N,36,,233388,5827,HEM
37,,DOUB,C4B,NB,no,N,37,,233388,5827,HEM
38,,SING,CMB,HMB,yes,N,38,,233388,5827,HEM
39,,SING,CMB,HMBA,no,N,39,,233388,5827,HEM
40,,SING,CMB,HMBB,no,N,40,,233388,5827,HEM
41,,DOUB,CAB,CBB,no,N,41,,233388,5827,HEM
42,,SING,CAB,HAB,no,N,42,,233388,5827,HEM
43,,SING,CBB,HBB,no,N,43,,233388,5827,HEM
44,,SING,CBB,HBBA,no,N,44,,233388,5827,HEM
45,,SING,C1C,C2C,no,N,45,,233388,5827,HEM
46,,SING,C1C,NC,yes,N,46,,233388,5827,HEM
47,,DOUB,C2C,C3C,yes,N,47,,233388,5827,HEM
48,,SING,C2C,CMC,yes,N,48,,233388,5827,HEM
49,,SING,C3C,C4C,no,N,49,,233388,5827,HEM
50,,SING,C3C,CAC,yes,N,50,,233388,5827,HEM
51,,SING,C4C,NC,no,N,51,,233388,5827,HEM
52,,SING,CMC,HMC,yes,N,52,,233388,5827,HEM
53,,SING,CMC,HMCA,no,N,53,,233388,5827,HEM
54,,SING,CMC,HMCB,no,N,54,,233388,5827,HEM
55,,DOUB,CAC,CBC,no,N,55,,233388,5827,HEM
56,,SING,CAC,HAC,no,N,56,,233388,5827,HEM
57,,SING,CBC,HBC,no,N,57,,233388,5827,HEM
58,,SING,CBC,HBCA,no,N,58,,233388,5827,HEM
59,,SING,C1D,C2D,no,N,59,,233388,5827,HEM
60,,DOUB,C1D,ND,yes,N,60,,233388,5827,HEM
61,,DOUB,C2D,C3D,yes,N,61,,233388,5827,HEM
62,,SING,C2D,CMD,yes,N,62,,233388,5827,HEM
63,,SING,C3D,C4D,no,N,63,,233388,5827,HEM
64,,SING,C3D,CAD,yes,N,64,,233388,5827,HEM
65,,SING,C4D,ND,no,N,65,,233388,5827,HEM
66,,SING,CMD,HMD,yes,N,66,,233388,5827,HEM
67,,SING,CMD,HMDA,no,N,67,,233388,5827,HEM
68,,SING,CMD,HMDB,no,N,68,,233388,5827,HEM
69,,SING,CAD,CBD,no,N,69,,233388,5827,HEM
70,,SING,CAD,HAD,no,N,70,,233388,5827,HEM
71,,SING,CAD,HADA,no,N,71,,233388,5827,HEM
72,,SING,CBD,CGD,no,N,72,,233388,5827,HEM
73,,SING,CBD,HBD,no,N,73,,233388,5827,HEM
74,,SING,CBD,HBDA,no,N,74,,233388,5827,HEM
75,,DOUB,CGD,O1D,no,N,75,,233388,5827,HEM
76,,SING,CGD,O2D,no,N,76,,233388,5827,HEM
77,,SING,O2A,H2A,no,N,77,,233388,5827,HEM
78,,SING,O2D,H2D,no,N,78,,233388,5827,HEM
79,,SING,FE,NA,no,N,79,,233388,5827,HEM
80,,SING,FE,NB,no,N,80,,233388,5827,HEM
81,,SING,FE,NC,no,N,81,,233388,5827,HEM
82,,SING,FE,ND,no,N,82,,233388,5827,HEM
1,,SING,CHA,C1A,yes,N,1,,233409,5828,HEM
2,,DOUB,CHA,C4D,yes,N,2,,233409,5828,HEM
3,,SING,CHA,HHA,no,N,3,,233409,5828,HEM
4,,SING,CHB,C4A,yes,N,4,,233409,5828,HEM
5,,DOUB,CHB,C1B,yes,N,5,,233409,5828,HEM
6,,SING,CHB,HHB,no,N,6,,233409,5828,HEM
7,,SING,CHC,C4B,yes,N,7,,233409,5828,HEM
8,,DOUB,CHC,C1C,yes,N,8,,233409,5828,HEM
9,,SING,CHC,HHC,no,N,9,,233409,5828,HEM
10,,DOUB,CHD,C4C,yes,N,10,,233409,5828,HEM
11,,SING,CHD,C1D,yes,N,11,,233409,5828,HEM
12,,SING,CHD,HHD,no,N,12,,233409,5828,HEM
13,,DOUB,C1A,C2A,yes,N,13,,233409,5828,HEM
14,,SING,C1A,NA,yes,N,14,,233409,5828,HEM
15,,SING,C2A,C3A,yes,N,15,,233409,5828,HEM
16,,SING,C2A,CAA,no,N,16,,233409,5828,HEM
17,,DOUB,C3A,C4A,yes,N,17,,233409,5828,HEM
18,,SING,C3A,CMA,no,N,18,,233409,5828,HEM
19,,SING,C4A,NA,yes,N,19,,233409,5828,HEM
20,,SING,CMA,HMA,no,N,20,,233409,5828,HEM
21,,SING,CMA,HMAA,no,N,21,,233409,5828,HEM
22,,SING,CMA,HMAB,no,N,22,,233409,5828,HEM
23,,SING,CAA,CBA,no,N,23,,233409,5828,HEM
24,,SING,CAA,HAA,no,N,24,,233409,5828,HEM
25,,SING,CAA,HAAA,no,N,25,,233409,5828,HEM
26,,SING,CBA,CGA,no,N,26,,233409,5828,HEM
27,,SING,CBA,HBA,no,N,27,,233409,5828,HEM
28,,SING,CBA,HBAA,no,N,28,,233409,5828,HEM
29,,DOUB,CGA,O1A,no,N,29,,233409,5828,HEM
30,,SING,CGA,O2A,no,N,30,,233409,5828,HEM
31,,SING,C1B,C2B,no,N,31,,233409,5828,HEM
32,,SING,C1B,NB,yes,N,32,,233409,5828,HEM
33,,DOUB,C2B,C3B,yes,N,33,,233409,5828,HEM
34,,SING,C2B,CMB,yes,N,34,,233409,5828,HEM
35,,SING,C3B,C4B,no,N,35,,233409,5828,HEM
36,,SING,C3B,CAB,yes,N,36,,233409,5828,HEM
37,,DOUB,C4B,NB,no,N,37,,233409,5828,HEM
38,,SING,CMB,HMB,yes,N,38,,233409,5828,HEM
39,,SING,CMB,HMBA,no,N,39,,233409,5828,HEM
40,,SING,CMB,HMBB,no,N,40,,233409,5828,HEM
41,,DOUB,CAB,CBB,no,N,41,,233409,5828,HEM
42,,SING,CAB,HAB,no,N,42,,233409,5828,HEM
43,,SING,CBB,HBB,no,N,43,,233409,5828,HEM
44,,SING,CBB,HBBA,no,N,44,,233409,5828,HEM
45,,SING,C1C,C2C,no,N,45,,233409,5828,HEM
46,,SING,C1C,NC,yes,N,46,,233409,5828,HEM
47,,DOUB,C2C,C3C,yes,N,47,,233409,5828,HEM
48,,SING,C2C,CMC,yes,N,48,,233409,5828,HEM
49,,SING,C3C,C4C,no,N,49,,233409,5828,HEM
50,,SING,C3C,CAC,yes,N,50,,233409,5828,HEM
51,,SING,C4C,NC,no,N,51,,233409,5828,HEM
52,,SING,CMC,HMC,yes,N,52,,233409,5828,HEM
53,,SING,CMC,HMCA,no,N,53,,233409,5828,HEM
54,,SING,CMC,HMCB,no,N,54,,233409,5828,HEM
55,,DOUB,CAC,CBC,no,N,55,,233409,5828,HEM
56,,SING,CAC,HAC,no,N,56,,233409,5828,HEM
57,,SING,CBC,HBC,no,N,57,,233409,5828,HEM
58,,SING,CBC,HBCA,no,N,58,,233409,5828,HEM
59,,SING,C1D,C2D,no,N,59,,233409,5828,HEM
60,,DOUB,C1D,ND,yes,N,60,,233409,5828,HEM
61,,DOUB,C2D,C3D,yes,N,61,,233409,5828,HEM
62,,SING,C2D,CMD,yes,N,62,,233409,5828,HEM
63,,SING,C3D,C4D,no,N,63,,233409,5828,HEM
64,,SING,C3D,CAD,yes,N,64,,233409,5828,HEM
65,,SING,C4D,ND,no,N,65,,233409,5828,HEM
66,,SING,CMD,HMD,yes,N,66,,233409,5828,HEM
67,,SING,CMD,HMDA,no,N,67,,233409,5828,HEM
68,,SING,CMD,HMDB,no,N,68,,233409,5828,HEM
69,,SING,CAD,CBD,no,N,69,,233409,5828,HEM
70,,SING,CAD,HAD,no,N,70,,233409,5828,HEM
71,,SING,CAD,HADA,no,N,71,,233409,5828,HEM
72,,SING,CBD,CGD,no,N,72,,233409,5828,HEM
73,,SING,CBD,HBD,no,N,73,,233409,5828,HEM
74,,SING,CBD,HBDA,no,N,74,,233409,5828,HEM
75,,DOUB,CGD,O1D,no,N,75,,233409,5828,HEM
76,,SING,CGD,O2D,no,N,76,,233409,5828,HEM
77,,SING,O2A,H2A,no,N,77,,233409,5828,HEM
78,,SING,O2D,H2D,no,N,78,,233409,5828,HEM
79,,SING,FE,NA,no,N,79,,233409,5828,HEM
80,,SING,FE,NB,no,N,80,,233409,5828,HEM
81,,SING,FE,NC,no,N,81,,233409,5828,HEM
82,,SING,FE,ND,no,N,82,,233409,5828,HEM
1,,SING,CHA,C1A,yes,N,1,,233430,5829,HEM
2,,DOUB,CHA,C4D,yes,N,2,,233430,5829,HEM
3,,SING,CHA,HHA,no,N,3,,233430,5829,HEM
4,,SING,CHB,C4A,yes,N,4,,233430,5829,HEM
5,,DOUB,CHB,C1B,yes,N,5,,233430,5829,HEM
6,,SING,CHB,HHB,no,N,6,,233430,5829,HEM
7,,SING,CHC,C4B,yes,N,7,,233430,5829,HEM
8,,DOUB,CHC,C1C,yes,N,8,,233430,5829,HEM
9,,SING,CHC,HHC,no,N,9,,233430,5829,HEM
10,,DOUB,CHD,C4C,yes,N,10,,233430,5829,HEM
11,,SING,CHD,C1D,yes,N,11,,233430,5829,HEM
12,,SING,CHD,HHD,no,N,12,,233430,5829,HEM
13,,DOUB,C1A,C2A,yes,N,13,,233430,5829,HEM
14,,SING,C1A,NA,yes,N,14,,233430,5829,HEM
15,,SING,C2A,C3A,yes,N,15,,233430,5829,HEM
16,,SING,C2A,CAA,no,N,16,,233430,5829,HEM
17,,DOUB,C3A,C4A,yes,N,17,,233430,5829,HEM
18,,SING,C3A,CMA,no,N,18,,233430,5829,HEM
19,,SING,C4A,NA,yes,N,19,,233430,5829,HEM
20,,SING,CMA,HMA,no,N,20,,233430,5829,HEM
21,,SING,CMA,HMAA,no,N,21,,233430,5829,HEM
22,,SING,CMA,HMAB,no,N,22,,233430,5829,HEM
23,,SING,CAA,CBA,no,N,23,,233430,5829,HEM
24,,SING,CAA,HAA,no,N,24,,233430,5829,HEM
25,,SING,CAA,HAAA,no,N,25,,233430,5829,HEM
26,,SING,CBA,CGA,no,N,26,,233430,5829,HEM
27,,SING,CBA,HBA,no,N,27,,233430,5829,HEM
28,,SING,CBA,HBAA,no,N,28,,233430,5829,HEM
29,,DOUB,CGA,O1A,no,N,29,,233430,5829,HEM
30,,SING,CGA,O2A,no,N,30,,233430,5829,HEM
31,,SING,C1B,C2B,no,N,31,,233430,5829,HEM
32,,SING,C1B,NB,yes,N,32,,233430,5829,HEM
33,,DOUB,C2B,C3B,yes,N,33,,233430,5829,HEM
34,,SING,C2B,CMB,yes,N,34,,233430,5829,HEM
35,,SING,C3B,C4B,no,N,35,,233430,5829,HEM
36,,SING,C3B,CAB,yes,N,36,,233430,5829,HEM
37,,DOUB,C4B,NB,no,N,37,,233430,5829,HEM
38,,SING,CMB,HMB,yes,N,38,,233430,5829,HEM
39,,SING,CMB,HMBA,no,N,39,,233430,5829,HEM
40,,SING,CMB,HMBB,no,N,40,,233430,5829,HEM
41,,DOUB,CAB,CBB,no,N,41,,233430,5829,HEM
42,,SING,CAB,HAB,no,N,42,,233430,5829,HEM
43,,SING,CBB,HBB,no,N,43,,233430,5829,HEM
44,,SING,CBB,HBBA,no,N,44,,233430,5829,HEM
45,,SING,C1C,C2C,no,N,45,,233430,5829,HEM
46,,SING,C1C,NC,yes,N,46,,233430,5829,HEM
47,,DOUB,C2C,C3C,yes,N,47,,233430,5829,HEM
48,,SING,C2C,CMC,yes,N,48,,233430,5829,HEM
49,,SING,C3C,C4C,no,N,49,,233430,5829,HEM
50,,SING,C3C,CAC,yes,N,50,,233430,5829,HEM
51,,SING,C4C,NC,no,N,51,,233430,5829,HEM
52,,SING,CMC,HMC,yes,N,52,,233430,5829,HEM
53,,SING,CMC,HMCA,no,N,53,,233430,5829,HEM
54,,SING,CMC,HMCB,no,N,54,,233430,5829,HEM
55,,DOUB,CAC,CBC,no,N,55,,233430,5829,HEM
56,,SING,CAC,HAC,no,N,56,,233430,5829,HEM
57,,SING,CBC,HBC,no,N,57,,233430,5829,HEM
58,,SING,CBC,HBCA,no,N,58,,233430,5829,HEM
59,,SING,C1D,C2D,no,N,59,,233430,5829,HEM
60,,DOUB,C1D,ND,yes,N,60,,233430,5829,HEM
61,,DOUB,C2D,C3D,yes,N,61,,233430,5829,HEM
62,,SING,C2D,CMD,yes,N,62,,233430,5829,HEM
63,,SING,C3D,C4D,no,N,63,,233430,5829,HEM
64,,SING,C3D,CAD,yes,N,64,,233430,5829,HEM
65,,SING,C4D,ND,no,N,65,,233430,5829,HEM
66,,SING,CMD,HMD,yes,N,66,,233430,5829,HEM
67,,SING,CMD,HMDA,no,N,67,,233430,5829,HEM
68,,SING,CMD,HMDB,no,N,68,,233430,5829,HEM
69,,SING,CAD,CBD,no,N,69,,233430,5829,HEM
70,,SING,CAD,HAD,no,N,70,,233430,5829,HEM
71,,SING,CAD,HADA,no,N,71,,233430,5829,HEM
72,,SING,CBD,CGD,no,N,72,,233430,5829,HEM
73,,SING,CBD,HBD,no,N,73,,233430,5829,HEM
74,,SING,CBD,HBDA,no,N,74,,233430,5829,HEM
75,,DOUB,CGD,O1D,no,N,75,,233430,5829,HEM
76,,SING,CGD,O2D,no,N,76,,233430,5829,HEM
77,,SING,O2A,H2A,no,N,77,,233430,5829,HEM
78,,SING,O2D,H2D,no,N,78,,233430,5829,HEM
79,,SING,FE,NA,no,N,79,,233430,5829,HEM
80,,SING,FE,NB,no,N,80,,233430,5829,HEM
81,,SING,FE,NC,no,N,81,,233430,5829,HEM
82,,SING,FE,ND,no,N,82,,233430,5829,HEM
1,,SING,CHA,C1A,yes,N,1,,233447,5830,HEM
2,,DOUB,CHA,C4D,yes,N,2,,233447,5830,HEM
3,,SING,CHA,HHA,no,N,3,,233447,5830,HEM
4,,SING,CHB,C4A,yes,N,4,,233447,5830,HEM
5,,DOUB,CHB,C1B,yes,N,5,,233447,5830,HEM
6,,SING,CHB,HHB,no,N,6,,233447,5830,HEM
7,,SING,CHC,C4B,yes,N,7,,233447,5830,HEM
8,,DOUB,CHC,C1C,yes,N,8,,233447,5830,HEM
9,,SING,CHC,HHC,no,N,9,,233447,5830,HEM
10,,DOUB,CHD,C4C,yes,N,10,,233447,5830,HEM
11,,SING,CHD,C1D,yes,N,11,,233447,5830,HEM
12,,SING,CHD,HHD,no,N,12,,233447,5830,HEM
13,,DOUB,C1A,C2A,yes,N,13,,233447,5830,HEM
14,,SING,C1A,NA,yes,N,14,,233447,5830,HEM
15,,SING,C2A,C3A,yes,N,15,,233447,5830,HEM
16,,SING,C2A,CAA,no,N,16,,233447,5830,HEM
17,,DOUB,C3A,C4A,yes,N,17,,233447,5830,HEM
18,,SING,C3A,CMA,no,N,18,,233447,5830,HEM
19,,SING,C4A,NA,yes,N,19,,233447,5830,HEM
20,,SING,CMA,HMA,no,N,20,,233447,5830,HEM
21,,SING,CMA,HMAA,no,N,21,,233447,5830,HEM
22,,SING,CMA,HMAB,no,N,22,,233447,5830,HEM
23,,SING,CAA,CBA,no,N,23,,233447,5830,HEM
24,,SING,CAA,HAA,no,N,24,,233447,5830,HEM
25,,SING,CAA,HAAA,no,N,25,,233447,5830,HEM
26,,SING,CBA,CGA,no,N,26,,233447,5830,HEM
27,,SING,CBA,HBA,no,N,27,,233447,5830,HEM
28,,SING,CBA,HBAA,no,N,28,,233447,5830,HEM
29,,DOUB,CGA,O1A,no,N,29,,233447,5830,HEM
30,,SING,CGA,O2A,no,N,30,,233447,5830,HEM
31,,SING,C1B,C2B,no,N,31,,233447,5830,HEM
32,,SING,C1B,NB,yes,N,32,,233447,5830,HEM
33,,DOUB,C2B,C3B,yes,N,33,,233447,5830,HEM
34,,SING,C2B,CMB,yes,N,34,,233447,5830,HEM
35,,SING,C3B,C4B,no,N,35,,233447,5830,HEM
36,,SING,C3B,CAB,yes,N,36,,233447,5830,HEM
37,,DOUB,C4B,NB,no,N,37,,233447,5830,HEM
38,,SING,CMB,HMB,yes,N,38,,233447,5830,HEM
39,,SING,CMB,HMBA,no,N,39,,233447,5830,HEM
40,,SING,CMB,HMBB,no,N,40,,233447,5830,HEM
41,,DOUB,CAB,CBB,no,N,41,,233447,5830,HEM
42,,SING,CAB,HAB,no,N,42,,233447,5830,HEM
43,,SING,CBB,HBB,no,N,43,,233447,5830,HEM
44,,SING,CBB,HBBA,no,N,44,,233447,5830,HEM
45,,SING,C1C,C2C,no,N,45,,233447,5830,HEM
46,,SING,C1C,NC,yes,N,46,,233447,5830,HEM
47,,DOUB,C2C,C3C,yes,N,47,,233447,5830,HEM
48,,SING,C2C,CMC,yes,N,48,,233447,5830,HEM
49,,SING,C3C,C4C,no,N,49,,233447,5830,HEM
50,,SING,C3C,CAC,yes,N,50,,233447,5830,HEM
51,,SING,C4C,NC,no,N,51,,233447,5830,HEM
52,,SING,CMC,HMC,yes,N,52,,233447,5830,HEM
53,,SING,CMC,HMCA,no,N,53,,233447,5830,HEM
54,,SING,CMC,HMCB,no,N,54,,233447,5830,HEM
55,,DOUB,CAC,CBC,no,N,55,,233447,5830,HEM
56,,SING,CAC,HAC,no,N,56,,233447,5830,HEM
57,,SING,CBC,HBC,no,N,57,,233447,5830,HEM
58,,SING,CBC,HBCA,no,N,58,,233447,5830,HEM
59,,SING,C1D,C2D,no,N,59,,233447,5830,HEM
60,,DOUB,C1D,ND,yes,N,60,,233447,5830,HEM
61,,DOUB,C2D,C3D,yes,N,61,,233447,5830,HEM
62,,SING,C2D,CMD,yes,N,62,,233447,5830,HEM
63,,SING,C3D,C4D,no,N,63,,233447,5830,HEM
64,,SING,C3D,CAD,yes,N,64,,233447,5830,HEM
65,,SING,C4D,ND,no,N,65,,233447,5830,HEM
66,,SING,CMD,HMD,yes,N,66,,233447,5830,HEM
67,,SING,CMD,HMDA,no,N,67,,233447,5830,HEM
68,,SING,CMD,HMDB,no,N,68,,233447,5830,HEM
69,,SING,CAD,CBD,no,N,69,,233447,5830,HEM
70,,SING,CAD,HAD,no,N,70,,233447,5830,HEM
71,,SING,CAD,HADA,no,N,71,,233447,5830,HEM
72,,SING,CBD,CGD,no,N,72,,233447,5830,HEM
73,,SING,CBD,HBD,no,N,73,,233447,5830,HEM
74,,SING,CBD,HBDA,no,N,74,,233447,5830,HEM
75,,DOUB,CGD,O1D,no,N,75,,233447,5830,HEM
76,,SING,CGD,O2D,no,N,76,,233447,5830,HEM
77,,SING,O2A,H2A,no,N,77,,233447,5830,HEM
78,,SING,O2D,H2D,no,N,78,,233447,5830,HEM
79,,SING,FE,NA,no,N,79,,233447,5830,HEM
80,,SING,FE,NB,no,N,80,,233447,5830,HEM
81,,SING,FE,NC,no,N,81,,233447,5830,HEM
82,,SING,FE,ND,no,N,82,,233447,5830,HEM
1,,SING,CD1,CG,no,N,1,,233462,5832,NLW
2,,SING,CG,CD2,no,N,2,,233462,5832,NLW
3,,SING,CG,CB,no,N,3,,233462,5832,NLW
4,,SING,CB,CA,no,N,4,,233462,5832,NLW
5,,SING,N,CA,no,N,5,,233462,5832,NLW
6,,SING,CA,C,no,N,6,,233462,5832,NLW
7,,SING,C,NH2,no,N,7,,233462,5832,NLW
8,,DOUB,C,O,no,N,8,,233462,5832,NLW
9,,SING,CD2,H1,no,N,9,,233462,5832,NLW
10,,SING,CD2,H2,no,N,10,,233462,5832,NLW
11,,SING,CD2,H3,no,N,11,,233462,5832,NLW
12,,SING,CG,H4,no,N,12,,233462,5832,NLW
13,,SING,CD1,H5,no,N,13,,233462,5832,NLW
14,,SING,CD1,H6,no,N,14,,233462,5832,NLW
15,,SING,CD1,H7,no,N,15,,233462,5832,NLW
16,,SING,CB,H8,no,N,16,,233462,5832,NLW
17,,SING,CB,H9,no,N,17,,233462,5832,NLW
18,,SING,CA,H10,no,N,18,,233462,5832,NLW
19,,SING,N,H11,no,N,19,,233462,5832,NLW
20,,SING,N,H12,no,N,20,,233462,5832,NLW
21,,SING,NH2,H14,no,N,21,,233462,5832,NLW
22,,SING,NH2,H15,no,N,22,,233462,5832,NLW
1,,SING,CHA,C1A,yes,N,1,,234055,5856,HEM
2,,DOUB,CHA,C4D,yes,N,2,,234055,5856,HEM
3,,SING,CHA,HHA,no,N,3,,234055,5856,HEM
4,,SING,CHB,C4A,yes,N,4,,234055,5856,HEM
5,,DOUB,CHB,C1B,yes,N,5,,234055,5856,HEM
6,,SING,CHB,HHB,no,N,6,,234055,5856,HEM
7,,SING,CHC,C4B,yes,N,7,,234055,5856,HEM
8,,DOUB,CHC,C1C,yes,N,8,,234055,5856,HEM
9,,SING,CHC,HHC,no,N,9,,234055,5856,HEM
10,,DOUB,CHD,C4C,yes,N,10,,234055,5856,HEM
11,,SING,CHD,C1D,yes,N,11,,234055,5856,HEM
12,,SING,CHD,HHD,no,N,12,,234055,5856,HEM
13,,DOUB,C1A,C2A,yes,N,13,,234055,5856,HEM
14,,SING,C1A,NA,yes,N,14,,234055,5856,HEM
15,,SING,C2A,C3A,yes,N,15,,234055,5856,HEM
16,,SING,C2A,CAA,no,N,16,,234055,5856,HEM
17,,DOUB,C3A,C4A,yes,N,17,,234055,5856,HEM
18,,SING,C3A,CMA,no,N,18,,234055,5856,HEM
19,,SING,C4A,NA,yes,N,19,,234055,5856,HEM
20,,SING,CMA,HMA,no,N,20,,234055,5856,HEM
21,,SING,CMA,HMAA,no,N,21,,234055,5856,HEM
22,,SING,CMA,HMAB,no,N,22,,234055,5856,HEM
23,,SING,CAA,CBA,no,N,23,,234055,5856,HEM
24,,SING,CAA,HAA,no,N,24,,234055,5856,HEM
25,,SING,CAA,HAAA,no,N,25,,234055,5856,HEM
26,,SING,CBA,CGA,no,N,26,,234055,5856,HEM
27,,SING,CBA,HBA,no,N,27,,234055,5856,HEM
28,,SING,CBA,HBAA,no,N,28,,234055,5856,HEM
29,,DOUB,CGA,O1A,no,N,29,,234055,5856,HEM
30,,SING,CGA,O2A,no,N,30,,234055,5856,HEM
31,,SING,C1B,C2B,no,N,31,,234055,5856,HEM
32,,SING,C1B,NB,yes,N,32,,234055,5856,HEM
33,,DOUB,C2B,C3B,yes,N,33,,234055,5856,HEM
34,,SING,C2B,CMB,yes,N,34,,234055,5856,HEM
35,,SING,C3B,C4B,no,N,35,,234055,5856,HEM
36,,SING,C3B,CAB,yes,N,36,,234055,5856,HEM
37,,DOUB,C4B,NB,no,N,37,,234055,5856,HEM
38,,SING,CMB,HMB,yes,N,38,,234055,5856,HEM
39,,SING,CMB,HMBA,no,N,39,,234055,5856,HEM
40,,SING,CMB,HMBB,no,N,40,,234055,5856,HEM
41,,DOUB,CAB,CBB,no,N,41,,234055,5856,HEM
42,,SING,CAB,HAB,no,N,42,,234055,5856,HEM
43,,SING,CBB,HBB,no,N,43,,234055,5856,HEM
44,,SING,CBB,HBBA,no,N,44,,234055,5856,HEM
45,,SING,C1C,C2C,no,N,45,,234055,5856,HEM
46,,SING,C1C,NC,yes,N,46,,234055,5856,HEM
47,,DOUB,C2C,C3C,yes,N,47,,234055,5856,HEM
48,,SING,C2C,CMC,yes,N,48,,234055,5856,HEM
49,,SING,C3C,C4C,no,N,49,,234055,5856,HEM
50,,SING,C3C,CAC,yes,N,50,,234055,5856,HEM
51,,SING,C4C,NC,no,N,51,,234055,5856,HEM
52,,SING,CMC,HMC,yes,N,52,,234055,5856,HEM
53,,SING,CMC,HMCA,no,N,53,,234055,5856,HEM
54,,SING,CMC,HMCB,no,N,54,,234055,5856,HEM
55,,DOUB,CAC,CBC,no,N,55,,234055,5856,HEM
56,,SING,CAC,HAC,no,N,56,,234055,5856,HEM
57,,SING,CBC,HBC,no,N,57,,234055,5856,HEM
58,,SING,CBC,HBCA,no,N,58,,234055,5856,HEM
59,,SING,C1D,C2D,no,N,59,,234055,5856,HEM
60,,DOUB,C1D,ND,yes,N,60,,234055,5856,HEM
61,,DOUB,C2D,C3D,yes,N,61,,234055,5856,HEM
62,,SING,C2D,CMD,yes,N,62,,234055,5856,HEM
63,,SING,C3D,C4D,no,N,63,,234055,5856,HEM
64,,SING,C3D,CAD,yes,N,64,,234055,5856,HEM
65,,SING,C4D,ND,no,N,65,,234055,5856,HEM
66,,SING,CMD,HMD,yes,N,66,,234055,5856,HEM
67,,SING,CMD,HMDA,no,N,67,,234055,5856,HEM
68,,SING,CMD,HMDB,no,N,68,,234055,5856,HEM
69,,SING,CAD,CBD,no,N,69,,234055,5856,HEM
70,,SING,CAD,HAD,no,N,70,,234055,5856,HEM
71,,SING,CAD,HADA,no,N,71,,234055,5856,HEM
72,,SING,CBD,CGD,no,N,72,,234055,5856,HEM
73,,SING,CBD,HBD,no,N,73,,234055,5856,HEM
74,,SING,CBD,HBDA,no,N,74,,234055,5856,HEM
75,,DOUB,CGD,O1D,no,N,75,,234055,5856,HEM
76,,SING,CGD,O2D,no,N,76,,234055,5856,HEM
77,,SING,O2A,H2A,no,N,77,,234055,5856,HEM
78,,SING,O2D,H2D,no,N,78,,234055,5856,HEM
79,,SING,FE,NA,no,N,79,,234055,5856,HEM
80,,SING,FE,NB,no,N,80,,234055,5856,HEM
81,,SING,FE,NC,no,N,81,,234055,5856,HEM
82,,SING,FE,ND,no,N,82,,234055,5856,HEM
1,,TRIP,C,O,no,N,1,,234056,5856,CMO
1,,SING,OP3,P,no,N,1,,234336,5866,8OG
2,,SING,OP3,HOP3,no,N,2,,234336,5866,8OG
3,,DOUB,P,OP1,no,N,3,,234336,5866,8OG
4,,SING,P,OP2,no,N,4,,234336,5866,8OG
5,,SING,P,O5',no,N,5,,234336,5866,8OG
6,,SING,OP2,HOP2,no,N,6,,234336,5866,8OG
7,,SING,O5',C5',no,N,7,,234336,5866,8OG
8,,SING,C5',C4',no,N,8,,234336,5866,8OG
9,,SING,C5',H5',no,N,9,,234336,5866,8OG
10,,SING,C5',H5'',no,N,10,,234336,5866,8OG
11,,SING,C4',O4',no,N,11,,234336,5866,8OG
12,,SING,C4',C3',no,N,12,,234336,5866,8OG
13,,SING,C4',H4',no,N,13,,234336,5866,8OG
14,,SING,O4',C1',no,N,14,,234336,5866,8OG
15,,SING,C3',O3',no,N,15,,234336,5866,8OG
16,,SING,C3',C2',no,N,16,,234336,5866,8OG
17,,SING,C3',H3',no,N,17,,234336,5866,8OG
18,,SING,O3',HO3',no,N,18,,234336,5866,8OG
19,,SING,C2',C1',no,N,19,,234336,5866,8OG
20,,SING,C2',H2',no,N,20,,234336,5866,8OG
21,,SING,C2',H2'',no,N,21,,234336,5866,8OG
22,,SING,C1',N9,no,N,22,,234336,5866,8OG
23,,SING,C1',H1',no,N,23,,234336,5866,8OG
24,,SING,N9,C8,no,N,24,,234336,5866,8OG
25,,SING,N9,C4,no,N,25,,234336,5866,8OG
26,,SING,C8,N7,no,N,26,,234336,5866,8OG
27,,DOUB,C8,O8,no,N,27,,234336,5866,8OG
28,,SING,N7,C5,no,N,28,,234336,5866,8OG
29,,SING,N7,H7,no,N,29,,234336,5866,8OG
30,,SING,C5,C6,no,N,30,,234336,5866,8OG
31,,DOUB,C5,C4,no,N,31,,234336,5866,8OG
32,,DOUB,C6,O6,no,N,32,,234336,5866,8OG
33,,SING,C6,N1,no,N,33,,234336,5866,8OG
34,,SING,N1,C2,no,N,34,,234336,5866,8OG
35,,SING,N1,H1,no,N,35,,234336,5866,8OG
36,,SING,C2,N2,no,N,36,,234336,5866,8OG
37,,DOUB,C2,N3,no,N,37,,234336,5866,8OG
38,,SING,N2,H21,no,N,38,,234336,5866,8OG
39,,SING,N2,H22,no,N,39,,234336,5866,8OG
40,,SING,N3,C4,no,N,40,,234336,5866,8OG
1,,SING,N,CA,no,N,1,,234403,5869,HYP
2,,SING,N,CD,no,N,2,,234403,5869,HYP
3,,SING,N,H,no,N,3,,234403,5869,HYP
4,,SING,CA,C,no,N,4,,234403,5869,HYP
5,,SING,CA,CB,no,N,5,,234403,5869,HYP
6,,SING,CA,HA,no,N,6,,234403,5869,HYP
7,,DOUB,C,O,no,N,7,,234403,5869,HYP
8,,SING,C,OXT,no,N,8,,234403,5869,HYP
9,,SING,CB,CG,no,N,9,,234403,5869,HYP
10,,SING,CB,HB2,no,N,10,,234403,5869,HYP
11,,SING,CB,HB3,no,N,11,,234403,5869,HYP
12,,SING,CG,CD,no,N,12,,234403,5869,HYP
13,,SING,CG,OD1,no,N,13,,234403,5869,HYP
14,,SING,CG,HG,no,N,14,,234403,5869,HYP
15,,SING,CD,HD22,no,N,15,,234403,5869,HYP
16,,SING,CD,HD23,no,N,16,,234403,5869,HYP
17,,SING,OD1,HD1,no,N,17,,234403,5869,HYP
18,,SING,OXT,HXT,no,N,18,,234403,5869,HYP
1,,SING,N,HN1,no,N,1,,234404,5869,NH2
2,,SING,N,HN2,no,N,2,,234404,5869,NH2
1,,SING,NA,C1,no,N,1,,234423,5870,BLM
2,,SING,NA,HA2,no,N,2,,234423,5870,BLM
3,,SING,NA,HA1,no,N,3,,234423,5870,BLM
4,,SING,C2,C1,no,N,4,,234423,5870,BLM
5,,SING,C2,C3,no,N,5,,234423,5870,BLM
6,,SING,C2,NB,no,N,6,,234423,5870,BLM
7,,SING,C2,H2,no,N,7,,234423,5870,BLM
8,,DOUB,C1,O1,no,N,8,,234423,5870,BLM
9,,SING,NC,C3,no,N,9,,234423,5870,BLM
10,,SING,NC,C6,no,N,10,,234423,5870,BLM
11,,SING,NC,HNC,no,N,11,,234423,5870,BLM
12,,SING,C3,H3E,no,N,12,,234423,5870,BLM
13,,SING,C3,H3X,no,N,13,,234423,5870,BLM
14,,SING,NB,HB1,no,N,14,,234423,5870,BLM
15,,SING,NB,HB2,no,N,15,,234423,5870,BLM
16,,SING,ND,C4,no,N,16,,234423,5870,BLM
17,,SING,ND,HD2,no,N,17,,234423,5870,BLM
18,,SING,ND,HD1,no,N,18,,234423,5870,BLM
19,,SING,C5,C4,no,N,19,,234423,5870,BLM
20,,SING,C5,C6,no,N,20,,234423,5870,BLM
21,,SING,C5,H5E,no,N,21,,234423,5870,BLM
22,,SING,C5,H5X,no,N,22,,234423,5870,BLM
23,,DOUB,C4,O4,no,N,23,,234423,5870,BLM
24,,DOUB,C8,C9,yes,N,24,,234423,5870,BLM
25,,SING,C8,NE,yes,N,25,,234423,5870,BLM
26,,SING,C8,NF,no,N,26,,234423,5870,BLM
27,,SING,C9,C10,yes,N,27,,234423,5870,BLM
28,,SING,C9,CA,no,N,28,,234423,5870,BLM
29,,DOUB,C10,NG,yes,N,29,,234423,5870,BLM
30,,SING,C10,C12,no,N,30,,234423,5870,BLM
31,,SING,NG,C7,yes,N,31,,234423,5870,BLM
32,,DOUB,C7,NE,yes,N,32,,234423,5870,BLM
33,,SING,C7,C6,no,N,33,,234423,5870,BLM
34,,SING,C6,H6,no,N,34,,234423,5870,BLM
35,,SING,NF,HF2,no,N,35,,234423,5870,BLM
36,,SING,NF,HF1,no,N,36,,234423,5870,BLM
37,,SING,CA,HAA,no,N,37,,234423,5870,BLM
38,,SING,CA,HAB,no,N,38,,234423,5870,BLM
39,,SING,CA,HAC,no,N,39,,234423,5870,BLM
40,,DOUB,C12,O12,no,N,40,,234423,5870,BLM
41,,SING,C12,NH,no,N,41,,234423,5870,BLM
42,,SING,NH,C13,no,N,42,,234423,5870,BLM
43,,SING,NH,HNH,no,N,43,,234423,5870,BLM
44,,SING,C13,C30,no,N,44,,234423,5870,BLM
45,,SING,C13,C14,no,N,45,,234423,5870,BLM
46,,SING,C13,H13,no,N,46,,234423,5870,BLM
47,,DOUB,C30,O30,no,N,47,,234423,5870,BLM
48,,SING,C30,NK,no,N,48,,234423,5870,BLM
49,,SING,C14,C27,no,N,49,,234423,5870,BLM
50,,SING,C14,OH1,no,N,50,,234423,5870,BLM
51,,SING,C14,H14,no,N,51,,234423,5870,BLM
52,,SING,C27,NJ,yes,N,52,,234423,5870,BLM
53,,DOUB,C27,C28,yes,N,53,,234423,5870,BLM
54,,SING,OH1,C63,no,N,54,,234423,5870,BLM
55,,DOUB,NJ,C29,yes,N,55,,234423,5870,BLM
56,,SING,C28,NI,yes,N,56,,234423,5870,BLM
57,,SING,C28,H28,no,N,57,,234423,5870,BLM
58,,SING,C29,NI,yes,N,58,,234423,5870,BLM
59,,SING,C29,H29,no,N,59,,234423,5870,BLM
60,,SING,NI,HNI,no,N,60,,234423,5870,BLM
61,,SING,NK,C31,no,N,61,,234423,5870,BLM
62,,SING,NK,HNK,no,N,62,,234423,5870,BLM
63,,SING,C34,C36,no,N,63,,234423,5870,BLM
64,,SING,C34,C33,no,N,64,,234423,5870,BLM
65,,SING,C34,CC,no,N,65,,234423,5870,BLM
66,,SING,C34,H34,no,N,66,,234423,5870,BLM
67,,DOUB,C36,O36,no,N,67,,234423,5870,BLM
68,,SING,C36,NL,no,N,68,,234423,5870,BLM
69,,SING,OH2,C33,no,N,69,,234423,5870,BLM
70,,SING,OH2,HO2,no,N,70,,234423,5870,BLM
71,,SING,C31,CB,no,N,71,,234423,5870,BLM
72,,SING,C31,C33,no,N,72,,234423,5870,BLM
73,,SING,C31,H31,no,N,73,,234423,5870,BLM
74,,SING,CB,HBA,no,N,74,,234423,5870,BLM
75,,SING,CB,HBB,no,N,75,,234423,5870,BLM
76,,SING,CB,HBC,no,N,76,,234423,5870,BLM
77,,SING,C33,H33,no,N,77,,234423,5870,BLM
78,,SING,CC,HCB,no,N,78,,234423,5870,BLM
79,,SING,CC,HCC,no,N,79,,234423,5870,BLM
80,,SING,CC,HCA,no,N,80,,234423,5870,BLM
81,,SING,NL,C37,no,N,81,,234423,5870,BLM
82,,SING,NL,HNL,no,N,82,,234423,5870,BLM
83,,SING,C37,C40,no,N,83,,234423,5870,BLM
84,,SING,C37,C38,no,N,84,,234423,5870,BLM
85,,SING,C37,H37,no,N,85,,234423,5870,BLM
86,,DOUB,C40,O40,no,N,86,,234423,5870,BLM
87,,SING,C40,NM,no,N,87,,234423,5870,BLM
88,,SING,C38,OH3,no,N,88,,234423,5870,BLM
89,,SING,C38,CD,no,N,89,,234423,5870,BLM
90,,SING,C38,H38,no,N,90,,234423,5870,BLM
91,,SING,OH3,HO3,no,N,91,,234423,5870,BLM
92,,SING,CD,HDB,no,N,92,,234423,5870,BLM
93,,SING,CD,HDC,no,N,93,,234423,5870,BLM
94,,SING,CD,HDA,no,N,94,,234423,5870,BLM
95,,SING,NM,C41,no,N,95,,234423,5870,BLM
96,,SING,NM,HNM,no,N,96,,234423,5870,BLM
97,,SING,C42,C43,no,N,97,,234423,5870,BLM
98,,SING,C42,C41,no,N,98,,234423,5870,BLM
99,,SING,C42,H2E,no,N,99,,234423,5870,BLM
100,,SING,C42,H2X,no,N,100,,234423,5870,BLM
101,,DOUB,C49,O49,no,N,101,,234423,5870,BLM
102,,SING,C49,C48,no,N,102,,234423,5870,BLM
103,,SING,C49,NP,no,N,103,,234423,5870,BLM
104,,SING,C43,S43,yes,N,104,,234423,5870,BLM
105,,DOUB,C43,NN,yes,N,105,,234423,5870,BLM
106,,SING,C41,H1E,no,N,106,,234423,5870,BLM
107,,SING,C41,H1X,no,N,107,,234423,5870,BLM
108,,SING,S43,C44,yes,N,108,,234423,5870,BLM
109,,DOUB,C44,C45,yes,N,109,,234423,5870,BLM
110,,SING,C44,H44,no,N,110,,234423,5870,BLM
111,,SING,C45,NN,yes,N,111,,234423,5870,BLM
112,,SING,C45,C46,yes,N,112,,234423,5870,BLM
113,,DOUB,C47,C48,yes,N,113,,234423,5870,BLM
114,,SING,C47,S46,yes,N,114,,234423,5870,BLM
115,,SING,C47,H47,no,N,115,,234423,5870,BLM
116,,SING,C48,NO,yes,N,116,,234423,5870,BLM
117,,DOUB,NO,C46,yes,N,117,,234423,5870,BLM
118,,SING,C46,S46,yes,N,118,,234423,5870,BLM
119,,SING,NP,C50,no,N,119,,234423,5870,BLM
120,,SING,NP,HNP,no,N,120,,234423,5870,BLM
121,,SING,C50,C51,no,N,121,,234423,5870,BLM
122,,SING,C50,H501,no,N,122,,234423,5870,BLM
123,,SING,C50,H502,no,N,123,,234423,5870,BLM
124,,SING,C51,C52,no,N,124,,234423,5870,BLM
125,,SING,C51,H511,no,N,125,,234423,5870,BLM
126,,SING,C51,H512,no,N,126,,234423,5870,BLM
127,,SING,C52,S53,no,N,127,,234423,5870,BLM
128,,SING,C52,H521,no,N,128,,234423,5870,BLM
129,,SING,C52,H522,no,N,129,,234423,5870,BLM
130,,SING,S53,C55,no,N,130,,234423,5870,BLM
131,,SING,S53,C54,no,N,131,,234423,5870,BLM
132,,SING,S53,H53,no,N,132,,234423,5870,BLM
133,,SING,C55,H551,no,N,133,,234423,5870,BLM
134,,SING,C55,H552,no,N,134,,234423,5870,BLM
135,,SING,C55,H553,no,N,135,,234423,5870,BLM
136,,SING,C54,H541,no,N,136,,234423,5870,BLM
137,,SING,C54,H542,no,N,137,,234423,5870,BLM
138,,SING,C54,H543,no,N,138,,234423,5870,BLM
139,,SING,O59,C59,no,N,139,,234423,5870,BLM
140,,SING,O59,HO59,no,N,140,,234423,5870,BLM
141,,SING,O58,C58,no,N,141,,234423,5870,BLM
142,,SING,O58,HO58,no,N,142,,234423,5870,BLM
143,,SING,C61,O61,no,N,143,,234423,5870,BLM
144,,SING,C61,C60,no,N,144,,234423,5870,BLM
145,,SING,C61,H611,no,N,145,,234423,5870,BLM
146,,SING,C61,H612,no,N,146,,234423,5870,BLM
147,,SING,O61,HO61,no,N,147,,234423,5870,BLM
148,,SING,O56,C57,no,N,148,,234423,5870,BLM
149,,SING,O56,C64,no,N,149,,234423,5870,BLM
150,,SING,C60,O62,no,N,150,,234423,5870,BLM
151,,SING,C60,C59,no,N,151,,234423,5870,BLM
152,,SING,C60,H60,no,N,152,,234423,5870,BLM
153,,SING,O62,C63,no,N,153,,234423,5870,BLM
154,,SING,C63,C57,no,N,154,,234423,5870,BLM
155,,SING,C63,H63,no,N,155,,234423,5870,BLM
156,,SING,C57,C58,no,N,156,,234423,5870,BLM
157,,SING,C57,H57,no,N,157,,234423,5870,BLM
158,,SING,C58,C59,no,N,158,,234423,5870,BLM
159,,SING,C58,H58,no,N,159,,234423,5870,BLM
160,,SING,C59,H59,no,N,160,,234423,5870,BLM
161,,SING,C69,C68,no,N,161,,234423,5870,BLM
162,,SING,C69,C64,no,N,162,,234423,5870,BLM
163,,SING,C69,O69,no,N,163,,234423,5870,BLM
164,,SING,C69,H69,no,N,164,,234423,5870,BLM
165,,SING,C68,C67,no,N,165,,234423,5870,BLM
166,,SING,C68,O68,no,N,166,,234423,5870,BLM
167,,SING,C68,H68,no,N,167,,234423,5870,BLM
168,,SING,C67,C65,no,N,168,,234423,5870,BLM
169,,SING,C67,O67,no,N,169,,234423,5870,BLM
170,,SING,C67,H67,no,N,170,,234423,5870,BLM
171,,SING,C65,O64,no,N,171,,234423,5870,BLM
172,,SING,C65,C66,no,N,172,,234423,5870,BLM
173,,SING,C65,H65,no,N,173,,234423,5870,BLM
174,,SING,O64,C64,no,N,174,,234423,5870,BLM
175,,SING,C64,H64,no,N,175,,234423,5870,BLM
176,,SING,O68,C70,no,N,176,,234423,5870,BLM
177,,SING,O67,HO67,no,N,177,,234423,5870,BLM
178,,SING,O69,HO69,no,N,178,,234423,5870,BLM
179,,SING,NQ,C70,no,N,179,,234423,5870,BLM
180,,SING,NQ,HNQ1,no,N,180,,234423,5870,BLM
181,,SING,NQ,HNQ2,no,N,181,,234423,5870,BLM
182,,DOUB,C70,O70,no,N,182,,234423,5870,BLM
183,,SING,O66,C66,no,N,183,,234423,5870,BLM
184,,SING,O66,HO66,no,N,184,,234423,5870,BLM
185,,SING,C66,H661,no,N,185,,234423,5870,BLM
186,,SING,C66,H662,no,N,186,,234423,5870,BLM
1,,SING,N,CA,no,N,1,,234681,5881,PCA
2,,SING,N,CD,no,N,2,,234681,5881,PCA
3,,SING,N,H,no,N,3,,234681,5881,PCA
4,,SING,CA,CB,no,N,4,,234681,5881,PCA
5,,SING,CA,C,no,N,5,,234681,5881,PCA
6,,SING,CA,HA,no,N,6,,234681,5881,PCA
7,,SING,CB,CG,no,N,7,,234681,5881,PCA
8,,SING,CB,HB2,no,N,8,,234681,5881,PCA
9,,SING,CB,HB3,no,N,9,,234681,5881,PCA
10,,SING,CG,CD,no,N,10,,234681,5881,PCA
11,,SING,CG,HG2,no,N,11,,234681,5881,PCA
12,,SING,CG,HG3,no,N,12,,234681,5881,PCA
13,,DOUB,CD,OE,no,N,13,,234681,5881,PCA
14,,DOUB,C,O,no,N,14,,234681,5881,PCA
15,,SING,C,OXT,no,N,15,,234681,5881,PCA
16,,SING,OXT,HXT,no,N,16,,234681,5881,PCA
1,,SING,CD1,CG,no,N,1,,234723,5883,NLW
2,,SING,CG,CD2,no,N,2,,234723,5883,NLW
3,,SING,CG,CB,no,N,3,,234723,5883,NLW
4,,SING,CB,CA,no,N,4,,234723,5883,NLW
5,,SING,N,CA,no,N,5,,234723,5883,NLW
6,,SING,CA,C,no,N,6,,234723,5883,NLW
7,,SING,C,NH2,no,N,7,,234723,5883,NLW
8,,DOUB,C,O,no,N,8,,234723,5883,NLW
9,,SING,CD2,H1,no,N,9,,234723,5883,NLW
10,,SING,CD2,H2,no,N,10,,234723,5883,NLW
11,,SING,CD2,H3,no,N,11,,234723,5883,NLW
12,,SING,CG,H4,no,N,12,,234723,5883,NLW
13,,SING,CD1,H5,no,N,13,,234723,5883,NLW
14,,SING,CD1,H6,no,N,14,,234723,5883,NLW
15,,SING,CD1,H7,no,N,15,,234723,5883,NLW
16,,SING,CB,H8,no,N,16,,234723,5883,NLW
17,,SING,CB,H9,no,N,17,,234723,5883,NLW
18,,SING,CA,H10,no,N,18,,234723,5883,NLW
19,,SING,N,H11,no,N,19,,234723,5883,NLW
20,,SING,N,H12,no,N,20,,234723,5883,NLW
21,,SING,NH2,H14,no,N,21,,234723,5883,NLW
22,,SING,NH2,H15,no,N,22,,234723,5883,NLW
1,,SING,O1,P1,no,N,1,,235480,5915,PX4
2,,SING,O1,H1P,no,N,2,,235480,5915,PX4
3,,DOUB,O2,P1,no,N,3,,235480,5915,PX4
4,,SING,P1,O3,no,N,4,,235480,5915,PX4
5,,SING,P1,O4,no,N,5,,235480,5915,PX4
6,,SING,O3,C1,no,N,6,,235480,5915,PX4
7,,SING,C1,C2,no,N,7,,235480,5915,PX4
8,,SING,C1,H1,no,N,8,,235480,5915,PX4
9,,SING,C1,H2,no,N,9,,235480,5915,PX4
10,,SING,C2,N1,no,N,10,,235480,5915,PX4
11,,SING,C2,H3,no,N,11,,235480,5915,PX4
12,,SING,C2,H4,no,N,12,,235480,5915,PX4
13,,SING,N1,C3,no,N,13,,235480,5915,PX4
14,,SING,N1,C4,no,N,14,,235480,5915,PX4
15,,SING,N1,C5,no,N,15,,235480,5915,PX4
16,,SING,C3,H5,no,N,16,,235480,5915,PX4
17,,SING,C3,H6,no,N,17,,235480,5915,PX4
18,,SING,C3,H7,no,N,18,,235480,5915,PX4
19,,SING,C4,H8,no,N,19,,235480,5915,PX4
20,,SING,C4,H9,no,N,20,,235480,5915,PX4
21,,SING,C4,H10,no,N,21,,235480,5915,PX4
22,,SING,C5,H11,no,N,22,,235480,5915,PX4
23,,SING,C5,H12,no,N,23,,235480,5915,PX4
24,,SING,C5,H13,no,N,24,,235480,5915,PX4
25,,SING,O4,C6,no,N,25,,235480,5915,PX4
26,,SING,C6,C7,no,N,26,,235480,5915,PX4
27,,SING,C6,H14,no,N,27,,235480,5915,PX4
28,,SING,C6,H15,no,N,28,,235480,5915,PX4
29,,SING,C7,C8,no,N,29,,235480,5915,PX4
30,,SING,C7,O7,no,N,30,,235480,5915,PX4
31,,SING,C7,H16,no,N,31,,235480,5915,PX4
32,,SING,C8,O5,no,N,32,,235480,5915,PX4
33,,SING,C8,H17,no,N,33,,235480,5915,PX4
34,,SING,C8,H18,no,N,34,,235480,5915,PX4
35,,SING,O5,C9,no,N,35,,235480,5915,PX4
36,,DOUB,C9,O6,no,N,36,,235480,5915,PX4
37,,SING,C9,C10,no,N,37,,235480,5915,PX4
38,,SING,C10,C11,no,N,38,,235480,5915,PX4
39,,SING,C10,H19,no,N,39,,235480,5915,PX4
40,,SING,C10,H20,no,N,40,,235480,5915,PX4
41,,SING,C11,C12,no,N,41,,235480,5915,PX4
42,,SING,C11,H21,no,N,42,,235480,5915,PX4
43,,SING,C11,H22,no,N,43,,235480,5915,PX4
44,,SING,C12,C13,no,N,44,,235480,5915,PX4
45,,SING,C12,H23,no,N,45,,235480,5915,PX4
46,,SING,C12,H24,no,N,46,,235480,5915,PX4
47,,SING,C13,C14,no,N,47,,235480,5915,PX4
48,,SING,C13,H25,no,N,48,,235480,5915,PX4
49,,SING,C13,H26,no,N,49,,235480,5915,PX4
50,,SING,C14,C15,no,N,50,,235480,5915,PX4
51,,SING,C14,H27,no,N,51,,235480,5915,PX4
52,,SING,C14,H28,no,N,52,,235480,5915,PX4
53,,SING,C15,C16,no,N,53,,235480,5915,PX4
54,,SING,C15,H29,no,N,54,,235480,5915,PX4
55,,SING,C15,H30,no,N,55,,235480,5915,PX4
56,,SING,C16,C17,no,N,56,,235480,5915,PX4
57,,SING,C16,H31,no,N,57,,235480,5915,PX4
58,,SING,C16,H32,no,N,58,,235480,5915,PX4
59,,SING,C17,C18,no,N,59,,235480,5915,PX4
60,,SING,C17,H33,no,N,60,,235480,5915,PX4
61,,SING,C17,H34,no,N,61,,235480,5915,PX4
62,,SING,C18,C19,no,N,62,,235480,5915,PX4
63,,SING,C18,H35,no,N,63,,235480,5915,PX4
64,,SING,C18,H36,no,N,64,,235480,5915,PX4
65,,SING,C19,C20,no,N,65,,235480,5915,PX4
66,,SING,C19,H37,no,N,66,,235480,5915,PX4
67,,SING,C19,H38,no,N,67,,235480,5915,PX4
68,,SING,C20,C21,no,N,68,,235480,5915,PX4
69,,SING,C20,H39,no,N,69,,235480,5915,PX4
70,,SING,C20,H40,no,N,70,,235480,5915,PX4
71,,SING,C21,C22,no,N,71,,235480,5915,PX4
72,,SING,C21,H41,no,N,72,,235480,5915,PX4
73,,SING,C21,H42,no,N,73,,235480,5915,PX4
74,,SING,C22,H43,no,N,74,,235480,5915,PX4
75,,SING,C22,H44,no,N,75,,235480,5915,PX4
76,,SING,C22,H45,no,N,76,,235480,5915,PX4
77,,SING,O7,C23,no,N,77,,235480,5915,PX4
78,,DOUB,C23,O8,no,N,78,,235480,5915,PX4
79,,SING,C23,C24,no,N,79,,235480,5915,PX4
80,,SING,C24,C25,no,N,80,,235480,5915,PX4
81,,SING,C24,H46,no,N,81,,235480,5915,PX4
82,,SING,C24,H47,no,N,82,,235480,5915,PX4
83,,SING,C25,C26,no,N,83,,235480,5915,PX4
84,,SING,C25,H48,no,N,84,,235480,5915,PX4
85,,SING,C25,H49,no,N,85,,235480,5915,PX4
86,,SING,C26,C27,no,N,86,,235480,5915,PX4
87,,SING,C26,H50,no,N,87,,235480,5915,PX4
88,,SING,C26,H51,no,N,88,,235480,5915,PX4
89,,SING,C27,C28,no,N,89,,235480,5915,PX4
90,,SING,C27,H52,no,N,90,,235480,5915,PX4
91,,SING,C27,H53,no,N,91,,235480,5915,PX4
92,,SING,C28,C29,no,N,92,,235480,5915,PX4
93,,SING,C28,H54,no,N,93,,235480,5915,PX4
94,,SING,C28,H55,no,N,94,,235480,5915,PX4
95,,SING,C29,C30,no,N,95,,235480,5915,PX4
96,,SING,C29,H56,no,N,96,,235480,5915,PX4
97,,SING,C29,H57,no,N,97,,235480,5915,PX4
98,,SING,C30,C31,no,N,98,,235480,5915,PX4
99,,SING,C30,H58,no,N,99,,235480,5915,PX4
100,,SING,C30,H59,no,N,100,,235480,5915,PX4
101,,SING,C31,C32,no,N,101,,235480,5915,PX4
102,,SING,C31,H60,no,N,102,,235480,5915,PX4
103,,SING,C31,H61,no,N,103,,235480,5915,PX4
104,,SING,C32,C33,no,N,104,,235480,5915,PX4
105,,SING,C32,H62,no,N,105,,235480,5915,PX4
106,,SING,C32,H63,no,N,106,,235480,5915,PX4
107,,SING,C33,C34,no,N,107,,235480,5915,PX4
108,,SING,C33,H64,no,N,108,,235480,5915,PX4
109,,SING,C33,H65,no,N,109,,235480,5915,PX4
110,,SING,C34,C35,no,N,110,,235480,5915,PX4
111,,SING,C34,H66,no,N,111,,235480,5915,PX4
112,,SING,C34,H67,no,N,112,,235480,5915,PX4
113,,SING,C35,C36,no,N,113,,235480,5915,PX4
114,,SING,C35,H68,no,N,114,,235480,5915,PX4
115,,SING,C35,H69,no,N,115,,235480,5915,PX4
116,,SING,C36,H70,no,N,116,,235480,5915,PX4
117,,SING,C36,H71,no,N,117,,235480,5915,PX4
118,,SING,C36,H72,no,N,118,,235480,5915,PX4
1,,SING,N,CA,no,N,1,,235621,5922,NLE
2,,SING,N,H,no,N,2,,235621,5922,NLE
3,,SING,N,HN2,no,N,3,,235621,5922,NLE
4,,SING,CA,C,no,N,4,,235621,5922,NLE
5,,SING,CA,CB,no,N,5,,235621,5922,NLE
6,,SING,CA,HA,no,N,6,,235621,5922,NLE
7,,DOUB,C,O,no,N,7,,235621,5922,NLE
8,,SING,C,OXT,no,N,8,,235621,5922,NLE
9,,SING,OXT,HXT,no,N,9,,235621,5922,NLE
10,,SING,CB,CG,no,N,10,,235621,5922,NLE
11,,SING,CB,HB2,no,N,11,,235621,5922,NLE
12,,SING,CB,HB3,no,N,12,,235621,5922,NLE
13,,SING,CG,CD,no,N,13,,235621,5922,NLE
14,,SING,CG,HG2,no,N,14,,235621,5922,NLE
15,,SING,CG,HG3,no,N,15,,235621,5922,NLE
16,,SING,CD,CE,no,N,16,,235621,5922,NLE
17,,SING,CD,HD2,no,N,17,,235621,5922,NLE
18,,SING,CD,HD3,no,N,18,,235621,5922,NLE
19,,SING,CE,HE1,no,N,19,,235621,5922,NLE
20,,SING,CE,HE2,no,N,20,,235621,5922,NLE
21,,SING,CE,HE3,no,N,21,,235621,5922,NLE
1,,SING,N16,C2,no,N,1,,235723,5927,CYE
2,,SING,N16,H55,no,N,2,,235723,5927,CYE
3,,SING,N16,H56,no,N,3,,235723,5927,CYE
4,,SING,C2,C3,no,N,4,,235723,5927,CYE
5,,SING,C2,H2,no,N,5,,235723,5927,CYE
6,,SING,C2,H3,no,N,6,,235723,5927,CYE
7,,SING,C3,C39,no,N,7,,235723,5927,CYE
8,,SING,C3,H4,no,N,8,,235723,5927,CYE
9,,SING,C3,H5,no,N,9,,235723,5927,CYE
10,,SING,C39,N14,no,N,10,,235723,5927,CYE
11,,SING,C39,H43,no,N,11,,235723,5927,CYE
12,,SING,C39,H44,no,N,12,,235723,5927,CYE
13,,SING,N14,C38,yes,N,13,,235723,5927,CYE
14,,SING,N14,C40,yes,N,14,,235723,5927,CYE
15,,DOUB,C38,C36,yes,N,15,,235723,5927,CYE
16,,SING,C38,H42,no,N,16,,235723,5927,CYE
17,,SING,C36,N13,no,N,17,,235723,5927,CYE
18,,SING,C36,C37,yes,N,18,,235723,5927,CYE
19,,SING,N13,C35,no,N,19,,235723,5927,CYE
20,,SING,N13,H40,no,N,20,,235723,5927,CYE
21,,DOUB,C35,O7,no,N,21,,235723,5927,CYE
22,,SING,C35,C34,no,N,22,,235723,5927,CYE
23,,DOUB,C34,C31,yes,N,23,,235723,5927,CYE
24,,SING,C34,N12,yes,N,24,,235723,5927,CYE
25,,SING,C31,C30,yes,N,25,,235723,5927,CYE
26,,SING,C31,H35,no,N,26,,235723,5927,CYE
27,,SING,C30,N11,no,N,27,,235723,5927,CYE
28,,DOUB,C30,C32,yes,N,28,,235723,5927,CYE
29,,SING,N11,C29,no,N,29,,235723,5927,CYE
30,,SING,N11,H34,no,N,30,,235723,5927,CYE
31,,DOUB,C29,O6,no,N,31,,235723,5927,CYE
32,,SING,C29,C28,no,N,32,,235723,5927,CYE
33,,DOUB,C28,C25,no,N,33,,235723,5927,CYE
34,,SING,C28,N10,no,N,34,,235723,5927,CYE
35,,SING,C25,C24,no,N,35,,235723,5927,CYE
36,,SING,C25,H29,no,N,36,,235723,5927,CYE
37,,SING,C24,N9,no,N,37,,235723,5927,CYE
38,,DOUB,C24,C26,no,N,38,,235723,5927,CYE
39,,SING,N9,C23,no,N,39,,235723,5927,CYE
40,,SING,N9,H28,no,N,40,,235723,5927,CYE
41,,DOUB,C23,O5,no,N,41,,235723,5927,CYE
42,,SING,C23,C41,no,N,42,,235723,5927,CYE
43,,SING,C41,C21,no,N,43,,235723,5927,CYE
44,,SING,C41,H45,no,N,44,,235723,5927,CYE
45,,SING,C41,H46,no,N,45,,235723,5927,CYE
46,,SING,C21,C20,no,N,46,,235723,5927,CYE
47,,SING,C21,H26,no,N,47,,235723,5927,CYE
48,,SING,C21,H27,no,N,48,,235723,5927,CYE
49,,SING,C20,N8,no,N,49,,235723,5927,CYE
50,,SING,C20,H24,no,N,50,,235723,5927,CYE
51,,SING,C20,H25,no,N,51,,235723,5927,CYE
52,,SING,N8,C22,no,N,52,,235723,5927,CYE
53,,SING,N8,H23,no,N,53,,235723,5927,CYE
54,,DOUB,C22,O4,no,N,54,,235723,5927,CYE
55,,SING,C22,C19,no,N,55,,235723,5927,CYE
56,,DOUB,C19,C16,yes,N,56,,235723,5927,CYE
57,,SING,C19,N7,yes,N,57,,235723,5927,CYE
58,,SING,C16,C15,yes,N,58,,235723,5927,CYE
59,,SING,C16,H17,no,N,59,,235723,5927,CYE
60,,SING,C15,N6,no,N,60,,235723,5927,CYE
61,,DOUB,C15,C17,yes,N,61,,235723,5927,CYE
62,,SING,N6,C14,no,N,62,,235723,5927,CYE
63,,SING,N6,H16,no,N,63,,235723,5927,CYE
64,,DOUB,C14,O3,no,N,64,,235723,5927,CYE
65,,SING,C14,C13,no,N,65,,235723,5927,CYE
66,,DOUB,C13,C10,yes,N,66,,235723,5927,CYE
67,,SING,C13,N5,yes,N,67,,235723,5927,CYE
68,,SING,C10,C9,yes,N,68,,235723,5927,CYE
69,,SING,C10,H11,no,N,69,,235723,5927,CYE
70,,SING,C9,N4,no,N,70,,235723,5927,CYE
71,,DOUB,C9,C11,yes,N,71,,235723,5927,CYE
72,,SING,N4,C8,no,N,72,,235723,5927,CYE
73,,SING,N4,H10,no,N,73,,235723,5927,CYE
74,,DOUB,C8,O2,no,N,74,,235723,5927,CYE
75,,SING,C8,C7,no,N,75,,235723,5927,CYE
76,,DOUB,C7,N2,yes,N,76,,235723,5927,CYE
77,,SING,C7,N3,yes,N,77,,235723,5927,CYE
78,,SING,N2,C4,yes,N,78,,235723,5927,CYE
79,,SING,C4,N15,no,N,79,,235723,5927,CYE
80,,DOUB,C4,C5,yes,N,80,,235723,5927,CYE
81,,SING,N15,C44,no,N,81,,235723,5927,CYE
82,,SING,N15,H51,no,N,82,,235723,5927,CYE
83,,DOUB,C44,O8,no,N,83,,235723,5927,CYE
84,,SING,C44,C45,no,N,84,,235723,5927,CYE
85,,SING,C45,C43,no,N,85,,235723,5927,CYE
86,,SING,C45,H52,no,N,86,,235723,5927,CYE
87,,SING,C45,H53,no,N,87,,235723,5927,CYE
88,,SING,C43,C42,no,N,88,,235723,5927,CYE
89,,SING,C43,H49,no,N,89,,235723,5927,CYE
90,,SING,C43,H50,no,N,90,,235723,5927,CYE
91,,SING,C42,N1,no,N,91,,235723,5927,CYE
92,,SING,C42,H47,no,N,92,,235723,5927,CYE
93,,SING,C42,H48,no,N,93,,235723,5927,CYE
94,,SING,N1,C1,no,N,94,,235723,5927,CYE
95,,SING,N1,H1,no,N,95,,235723,5927,CYE
96,,DOUB,C1,O1,no,N,96,,235723,5927,CYE
97,,SING,C1,C40,no,N,97,,235723,5927,CYE
98,,DOUB,C40,C37,yes,N,98,,235723,5927,CYE
99,,SING,C37,H41,no,N,99,,235723,5927,CYE
100,,SING,C5,N3,yes,N,100,,235723,5927,CYE
101,,SING,C5,H6,no,N,101,,235723,5927,CYE
102,,SING,N3,C6,no,N,102,,235723,5927,CYE
103,,SING,C6,H7,no,N,103,,235723,5927,CYE
104,,SING,C6,H8,no,N,104,,235723,5927,CYE
105,,SING,C6,H9,no,N,105,,235723,5927,CYE
106,,SING,C11,N5,yes,N,106,,235723,5927,CYE
107,,SING,C11,H12,no,N,107,,235723,5927,CYE
108,,SING,N5,C12,no,N,108,,235723,5927,CYE
109,,SING,C12,H13,no,N,109,,235723,5927,CYE
110,,SING,C12,H14,no,N,110,,235723,5927,CYE
111,,SING,C12,H15,no,N,111,,235723,5927,CYE
112,,SING,C17,N7,yes,N,112,,235723,5927,CYE
113,,SING,C17,H18,no,N,113,,235723,5927,CYE
114,,SING,N7,C18,no,N,114,,235723,5927,CYE
115,,SING,C18,H19,no,N,115,,235723,5927,CYE
116,,SING,C18,H20,no,N,116,,235723,5927,CYE
117,,SING,C18,H22,no,N,117,,235723,5927,CYE
118,,SING,C26,N10,no,N,118,,235723,5927,CYE
119,,SING,C26,H30,no,N,119,,235723,5927,CYE
120,,SING,N10,C27,no,N,120,,235723,5927,CYE
121,,SING,N10,H21,no,N,121,,235723,5927,CYE
122,,SING,C27,H31,no,N,122,,235723,5927,CYE
123,,SING,C27,H32,no,N,123,,235723,5927,CYE
124,,SING,C27,H33,no,N,124,,235723,5927,CYE
125,,SING,C32,N12,yes,N,125,,235723,5927,CYE
126,,SING,C32,H36,no,N,126,,235723,5927,CYE
127,,SING,N12,C33,no,N,127,,235723,5927,CYE
128,,SING,C33,H37,no,N,128,,235723,5927,CYE
129,,SING,C33,H38,no,N,129,,235723,5927,CYE
130,,SING,C33,H39,no,N,130,,235723,5927,CYE
1,,DOUB,P,O1P,no,N,1,,235820,5931,AMP
2,,SING,P,O2P,no,N,2,,235820,5931,AMP
3,,SING,P,O3P,no,N,3,,235820,5931,AMP
4,,SING,P,O5',no,N,4,,235820,5931,AMP
5,,SING,O2P,HOP2,no,N,5,,235820,5931,AMP
6,,SING,O3P,HOP3,no,N,6,,235820,5931,AMP
7,,SING,O5',C5',no,N,7,,235820,5931,AMP
8,,SING,C5',C4',no,N,8,,235820,5931,AMP
9,,SING,C5',H5'1,no,N,9,,235820,5931,AMP
10,,SING,C5',H5'2,no,N,10,,235820,5931,AMP
11,,SING,C4',O4',no,N,11,,235820,5931,AMP
12,,SING,C4',C3',no,N,12,,235820,5931,AMP
13,,SING,C4',H4',no,N,13,,235820,5931,AMP
14,,SING,O4',C1',no,N,14,,235820,5931,AMP
15,,SING,C3',O3',no,N,15,,235820,5931,AMP
16,,SING,C3',C2',no,N,16,,235820,5931,AMP
17,,SING,C3',H3',no,N,17,,235820,5931,AMP
18,,SING,O3',HO3',no,N,18,,235820,5931,AMP
19,,SING,C2',O2',no,N,19,,235820,5931,AMP
20,,SING,C2',C1',no,N,20,,235820,5931,AMP
21,,SING,C2',H2',no,N,21,,235820,5931,AMP
22,,SING,O2',HO2',no,N,22,,235820,5931,AMP
23,,SING,C1',N9,no,N,23,,235820,5931,AMP
24,,SING,C1',H1',no,N,24,,235820,5931,AMP
25,,SING,N9,C8,yes,N,25,,235820,5931,AMP
26,,SING,N9,C4,yes,N,26,,235820,5931,AMP
27,,DOUB,C8,N7,yes,N,27,,235820,5931,AMP
28,,SING,C8,H8,no,N,28,,235820,5931,AMP
29,,SING,N7,C5,yes,N,29,,235820,5931,AMP
30,,SING,C5,C6,yes,N,30,,235820,5931,AMP
31,,DOUB,C5,C4,yes,N,31,,235820,5931,AMP
32,,SING,C6,N6,no,N,32,,235820,5931,AMP
33,,DOUB,C6,N1,yes,N,33,,235820,5931,AMP
34,,SING,N6,HN61,no,N,34,,235820,5931,AMP
35,,SING,N6,HN62,no,N,35,,235820,5931,AMP
36,,SING,N1,C2,yes,N,36,,235820,5931,AMP
37,,DOUB,C2,N3,yes,N,37,,235820,5931,AMP
38,,SING,C2,H2,no,N,38,,235820,5931,AMP
39,,SING,N3,C4,yes,N,39,,235820,5931,AMP
1,,SING,N,HN1,no,N,1,,235990,5938,NH2
2,,SING,N,HN2,no,N,2,,235990,5938,NH2
1,,SING,N,HN1,no,N,1,,236055,5941,NH2
2,,SING,N,HN2,no,N,2,,236055,5941,NH2
1,,DOUB,C1,O1,no,N,1,,236470,5960,MYR
2,,SING,C1,O2,no,N,2,,236470,5960,MYR
3,,SING,C1,C2,no,N,3,,236470,5960,MYR
4,,SING,O2,HO2,no,N,4,,236470,5960,MYR
5,,SING,C2,C3,no,N,5,,236470,5960,MYR
6,,SING,C2,H21,no,N,6,,236470,5960,MYR
7,,SING,C2,H22,no,N,7,,236470,5960,MYR
8,,SING,C3,C4,no,N,8,,236470,5960,MYR
9,,SING,C3,H31,no,N,9,,236470,5960,MYR
10,,SING,C3,H32,no,N,10,,236470,5960,MYR
11,,SING,C4,C5,no,N,11,,236470,5960,MYR
12,,SING,C4,H41,no,N,12,,236470,5960,MYR
13,,SING,C4,H42,no,N,13,,236470,5960,MYR
14,,SING,C5,C6,no,N,14,,236470,5960,MYR
15,,SING,C5,H51,no,N,15,,236470,5960,MYR
16,,SING,C5,H52,no,N,16,,236470,5960,MYR
17,,SING,C6,C7,no,N,17,,236470,5960,MYR
18,,SING,C6,H61,no,N,18,,236470,5960,MYR
19,,SING,C6,H62,no,N,19,,236470,5960,MYR
20,,SING,C7,C8,no,N,20,,236470,5960,MYR
21,,SING,C7,H71,no,N,21,,236470,5960,MYR
22,,SING,C7,H72,no,N,22,,236470,5960,MYR
23,,SING,C8,C9,no,N,23,,236470,5960,MYR
24,,SING,C8,H81,no,N,24,,236470,5960,MYR
25,,SING,C8,H82,no,N,25,,236470,5960,MYR
26,,SING,C9,C10,no,N,26,,236470,5960,MYR
27,,SING,C9,H91,no,N,27,,236470,5960,MYR
28,,SING,C9,H92,no,N,28,,236470,5960,MYR
29,,SING,C10,C11,no,N,29,,236470,5960,MYR
30,,SING,C10,H101,no,N,30,,236470,5960,MYR
31,,SING,C10,H102,no,N,31,,236470,5960,MYR
32,,SING,C11,C12,no,N,32,,236470,5960,MYR
33,,SING,C11,H111,no,N,33,,236470,5960,MYR
34,,SING,C11,H112,no,N,34,,236470,5960,MYR
35,,SING,C12,C13,no,N,35,,236470,5960,MYR
36,,SING,C12,H121,no,N,36,,236470,5960,MYR
37,,SING,C12,H122,no,N,37,,236470,5960,MYR
38,,SING,C13,C14,no,N,38,,236470,5960,MYR
39,,SING,C13,H131,no,N,39,,236470,5960,MYR
40,,SING,C13,H132,no,N,40,,236470,5960,MYR
41,,SING,C14,H141,no,N,41,,236470,5960,MYR
42,,SING,C14,H142,no,N,42,,236470,5960,MYR
43,,SING,C14,H143,no,N,43,,236470,5960,MYR
1,,DOUB,C,O,no,N,1,,236539,5964,ACE
2,,SING,C,CH3,no,N,2,,236539,5964,ACE
3,,SING,C,H,no,N,3,,236539,5964,ACE
4,,SING,CH3,H1,no,N,4,,236539,5964,ACE
5,,SING,CH3,H2,no,N,5,,236539,5964,ACE
6,,SING,CH3,H3,no,N,6,,236539,5964,ACE
1,,DOUB,C,O,no,N,1,,236554,5965,ACE
2,,SING,C,CH3,no,N,2,,236554,5965,ACE
3,,SING,C,H,no,N,3,,236554,5965,ACE
4,,SING,CH3,H1,no,N,4,,236554,5965,ACE
5,,SING,CH3,H2,no,N,5,,236554,5965,ACE
6,,SING,CH3,H3,no,N,6,,236554,5965,ACE
1,,DOUB,C,O,no,N,1,,236569,5966,ACE
2,,SING,C,CH3,no,N,2,,236569,5966,ACE
3,,SING,C,H,no,N,3,,236569,5966,ACE
4,,SING,CH3,H1,no,N,4,,236569,5966,ACE
5,,SING,CH3,H2,no,N,5,,236569,5966,ACE
6,,SING,CH3,H3,no,N,6,,236569,5966,ACE
1,,SING,C1,C2,no,N,1,,236633,5969,CHR
2,,SING,C1,C9,no,N,2,,236633,5969,CHR
3,,DOUB,C1,C12,no,N,3,,236633,5969,CHR
4,,TRIP,C2,C3,no,N,4,,236633,5969,CHR
5,,SING,C3,C4,no,N,5,,236633,5969,CHR
6,,SING,C4,O2,no,N,6,,236633,5969,CHR
7,,SING,C4,C5,no,N,7,,236633,5969,CHR
8,,SING,C4,C33,no,N,8,,236633,5969,CHR
9,,SING,O2,C5,no,N,9,,236633,5969,CHR
10,,SING,C5,C6,no,N,10,,236633,5969,CHR
11,,SING,C5,H5,no,N,11,,236633,5969,CHR
12,,TRIP,C6,C7,no,N,12,,236633,5969,CHR
13,,SING,C7,C8,no,N,13,,236633,5969,CHR
14,,DOUB,C8,C9,no,E,14,,236633,5969,CHR
15,,SING,C8,H8,no,N,15,,236633,5969,CHR
16,,SING,C9,C10,no,N,16,,236633,5969,CHR
17,,SING,C10,O1,no,N,17,,236633,5969,CHR
18,,SING,C10,C11,no,N,18,,236633,5969,CHR
19,,SING,C10,H10,no,N,19,,236633,5969,CHR
20,,SING,O1,C13,no,N,20,,236633,5969,CHR
21,,SING,C11,O6,no,N,21,,236633,5969,CHR
22,,SING,C11,C12,no,N,22,,236633,5969,CHR
23,,SING,C11,H11,no,N,23,,236633,5969,CHR
24,,SING,O6,C20,no,N,24,,236633,5969,CHR
25,,SING,C12,H12,no,N,25,,236633,5969,CHR
26,,SING,C13,O3,no,N,26,,236633,5969,CHR
27,,SING,C13,C14,no,N,27,,236633,5969,CHR
28,,SING,C13,H13,no,N,28,,236633,5969,CHR
29,,SING,O3,C17,no,N,29,,236633,5969,CHR
30,,SING,C14,N1,no,N,30,,236633,5969,CHR
31,,SING,C14,C15,no,N,31,,236633,5969,CHR
32,,SING,C14,H14,no,N,32,,236633,5969,CHR
33,,SING,N1,C19,no,N,33,,236633,5969,CHR
34,,SING,N1,HN1,no,N,34,,236633,5969,CHR
35,,SING,C19,H191,no,N,35,,236633,5969,CHR
36,,SING,C19,H192,no,N,36,,236633,5969,CHR
37,,SING,C19,H193,no,N,37,,236633,5969,CHR
38,,SING,C15,O4,no,N,38,,236633,5969,CHR
39,,SING,C15,C16,no,N,39,,236633,5969,CHR
40,,SING,C15,H15,no,N,40,,236633,5969,CHR
41,,SING,O4,HO4,no,N,41,,236633,5969,CHR
42,,SING,C16,O5,no,N,42,,236633,5969,CHR
43,,SING,C16,C17,no,N,43,,236633,5969,CHR
44,,SING,C16,H16,no,N,44,,236633,5969,CHR
45,,SING,O5,HO5,no,N,45,,236633,5969,CHR
46,,SING,C17,C18,no,N,46,,236633,5969,CHR
47,,SING,C17,H17,no,N,47,,236633,5969,CHR
48,,SING,C18,H181,no,N,48,,236633,5969,CHR
49,,SING,C18,H182,no,N,49,,236633,5969,CHR
50,,SING,C18,H183,no,N,50,,236633,5969,CHR
51,,DOUB,C20,O7,no,N,51,,236633,5969,CHR
52,,SING,C20,C21,no,N,52,,236633,5969,CHR
53,,DOUB,C21,C22,yes,N,53,,236633,5969,CHR
54,,SING,C21,C26,yes,N,54,,236633,5969,CHR
55,,SING,C22,O9,no,N,55,,236633,5969,CHR
56,,SING,C22,C23,yes,N,56,,236633,5969,CHR
57,,SING,O9,HO9,no,N,57,,236633,5969,CHR
58,,DOUB,C23,C24,yes,N,58,,236633,5969,CHR
59,,SING,C23,H23,no,N,59,,236633,5969,CHR
60,,SING,C24,C25,yes,N,60,,236633,5969,CHR
61,,SING,C24,H24,no,N,61,,236633,5969,CHR
62,,DOUB,C25,C26,yes,N,62,,236633,5969,CHR
63,,SING,C25,C30,yes,N,63,,236633,5969,CHR
64,,SING,C26,C27,yes,N,64,,236633,5969,CHR
65,,DOUB,C27,C28,yes,N,65,,236633,5969,CHR
66,,SING,C27,H27,no,N,66,,236633,5969,CHR
67,,SING,C28,O8,no,N,67,,236633,5969,CHR
68,,SING,C28,C29,yes,N,68,,236633,5969,CHR
69,,SING,O8,C31,no,N,69,,236633,5969,CHR
70,,SING,C31,H311,no,N,70,,236633,5969,CHR
71,,SING,C31,H312,no,N,71,,236633,5969,CHR
72,,SING,C31,H313,no,N,72,,236633,5969,CHR
73,,DOUB,C29,C30,yes,N,73,,236633,5969,CHR
74,,SING,C29,H29,no,N,74,,236633,5969,CHR
75,,SING,C30,C32,no,N,75,,236633,5969,CHR
76,,SING,C32,H321,no,N,76,,236633,5969,CHR
77,,SING,C32,H322,no,N,77,,236633,5969,CHR
78,,SING,C32,H323,no,N,78,,236633,5969,CHR
79,,SING,C33,O10,no,N,79,,236633,5969,CHR
80,,SING,C33,C35,no,N,80,,236633,5969,CHR
81,,SING,C33,H33,no,N,81,,236633,5969,CHR
82,,SING,O10,C34,no,N,82,,236633,5969,CHR
83,,DOUB,C34,O11,no,N,83,,236633,5969,CHR
84,,SING,C34,O12,no,N,84,,236633,5969,CHR
85,,SING,O12,C35,no,N,85,,236633,5969,CHR
86,,SING,C35,H351,no,N,86,,236633,5969,CHR
87,,SING,C35,H352,no,N,87,,236633,5969,CHR
1,,DOUB,C,O,no,N,1,,236719,5972,ACE
2,,SING,C,CH3,no,N,2,,236719,5972,ACE
3,,SING,C,H,no,N,3,,236719,5972,ACE
4,,SING,CH3,H1,no,N,4,,236719,5972,ACE
5,,SING,CH3,H2,no,N,5,,236719,5972,ACE
6,,SING,CH3,H3,no,N,6,,236719,5972,ACE
1,,SING,N,HN1,no,N,1,,236720,5972,NH2
2,,SING,N,HN2,no,N,2,,236720,5972,NH2
1,,SING,C1,C2,no,N,1,,236721,5972,CAM
2,,SING,C1,C6,no,N,2,,236721,5972,CAM
3,,SING,C1,C7,no,N,3,,236721,5972,CAM
4,,SING,C1,C10,no,N,4,,236721,5972,CAM
5,,DOUB,C2,O,no,N,5,,236721,5972,CAM
6,,SING,C2,C3,no,N,6,,236721,5972,CAM
7,,SING,C3,C4,no,N,7,,236721,5972,CAM
8,,SING,C3,H31,no,N,8,,236721,5972,CAM
9,,SING,C3,H32,no,N,9,,236721,5972,CAM
10,,SING,C4,C5,no,N,10,,236721,5972,CAM
11,,SING,C4,C7,no,N,11,,236721,5972,CAM
12,,SING,C4,H4,no,N,12,,236721,5972,CAM
13,,SING,C5,C6,no,N,13,,236721,5972,CAM
14,,SING,C5,H51,no,N,14,,236721,5972,CAM
15,,SING,C5,H52,no,N,15,,236721,5972,CAM
16,,SING,C6,H61,no,N,16,,236721,5972,CAM
17,,SING,C6,H62,no,N,17,,236721,5972,CAM
18,,SING,C7,C8,no,N,18,,236721,5972,CAM
19,,SING,C7,C9,no,N,19,,236721,5972,CAM
20,,SING,C8,H81,no,N,20,,236721,5972,CAM
21,,SING,C8,H82,no,N,21,,236721,5972,CAM
22,,SING,C8,H83,no,N,22,,236721,5972,CAM
23,,SING,C9,H91,no,N,23,,236721,5972,CAM
24,,SING,C9,H92,no,N,24,,236721,5972,CAM
25,,SING,C9,H93,no,N,25,,236721,5972,CAM
26,,SING,C10,H101,no,N,26,,236721,5972,CAM
27,,SING,C10,H102,no,N,27,,236721,5972,CAM
28,,SING,C10,H103,no,N,28,,236721,5972,CAM
1,,DOUB,PA,O1A,no,N,1,,236915,5981,NAP
2,,SING,PA,O2A,no,N,2,,236915,5981,NAP
3,,SING,PA,O5B,no,N,3,,236915,5981,NAP
4,,SING,PA,O3,no,N,4,,236915,5981,NAP
5,,SING,O2A,HOA2,no,N,5,,236915,5981,NAP
6,,SING,O5B,C5B,no,N,6,,236915,5981,NAP
7,,SING,C5B,C4B,no,N,7,,236915,5981,NAP
8,,SING,C5B,H51A,no,N,8,,236915,5981,NAP
9,,SING,C5B,H52A,no,N,9,,236915,5981,NAP
10,,SING,C4B,O4B,no,N,10,,236915,5981,NAP
11,,SING,C4B,C3B,no,N,11,,236915,5981,NAP
12,,SING,C4B,H4B,no,N,12,,236915,5981,NAP
13,,SING,O4B,C1B,no,N,13,,236915,5981,NAP
14,,SING,C3B,O3B,no,N,14,,236915,5981,NAP
15,,SING,C3B,C2B,no,N,15,,236915,5981,NAP
16,,SING,C3B,H3B,no,N,16,,236915,5981,NAP
17,,SING,O3B,HO3A,no,N,17,,236915,5981,NAP
18,,SING,C2B,O2B,no,N,18,,236915,5981,NAP
19,,SING,C2B,C1B,no,N,19,,236915,5981,NAP
20,,SING,C2B,H2B,no,N,20,,236915,5981,NAP
21,,SING,O2B,P2B,no,N,21,,236915,5981,NAP
22,,SING,C1B,N9A,no,N,22,,236915,5981,NAP
23,,SING,C1B,H1B,no,N,23,,236915,5981,NAP
24,,SING,N9A,C8A,yes,N,24,,236915,5981,NAP
25,,SING,N9A,C4A,yes,N,25,,236915,5981,NAP
26,,DOUB,C8A,N7A,yes,N,26,,236915,5981,NAP
27,,SING,C8A,H8A,no,N,27,,236915,5981,NAP
28,,SING,N7A,C5A,yes,N,28,,236915,5981,NAP
29,,SING,C5A,C6A,yes,N,29,,236915,5981,NAP
30,,DOUB,C5A,C4A,yes,N,30,,236915,5981,NAP
31,,SING,C6A,N6A,no,N,31,,236915,5981,NAP
32,,DOUB,C6A,N1A,yes,N,32,,236915,5981,NAP
33,,SING,N6A,H61A,no,N,33,,236915,5981,NAP
34,,SING,N6A,H62A,no,N,34,,236915,5981,NAP
35,,SING,N1A,C2A,yes,N,35,,236915,5981,NAP
36,,DOUB,C2A,N3A,yes,N,36,,236915,5981,NAP
37,,SING,C2A,H2A,no,N,37,,236915,5981,NAP
38,,SING,N3A,C4A,yes,N,38,,236915,5981,NAP
39,,SING,O3,PN,no,N,39,,236915,5981,NAP
40,,DOUB,PN,O1N,no,N,40,,236915,5981,NAP
41,,SING,PN,O2N,no,N,41,,236915,5981,NAP
42,,SING,PN,O5D,no,N,42,,236915,5981,NAP
43,,SING,O5D,C5D,no,N,43,,236915,5981,NAP
44,,SING,C5D,C4D,no,N,44,,236915,5981,NAP
45,,SING,C5D,H51N,no,N,45,,236915,5981,NAP
46,,SING,C5D,H52N,no,N,46,,236915,5981,NAP
47,,SING,C4D,O4D,no,N,47,,236915,5981,NAP
48,,SING,C4D,C3D,no,N,48,,236915,5981,NAP
49,,SING,C4D,H4D,no,N,49,,236915,5981,NAP
50,,SING,O4D,C1D,no,N,50,,236915,5981,NAP
51,,SING,C3D,O3D,no,N,51,,236915,5981,NAP
52,,SING,C3D,C2D,no,N,52,,236915,5981,NAP
53,,SING,C3D,H3D,no,N,53,,236915,5981,NAP
54,,SING,O3D,HO3N,no,N,54,,236915,5981,NAP
55,,SING,C2D,O2D,no,N,55,,236915,5981,NAP
56,,SING,C2D,C1D,no,N,56,,236915,5981,NAP
57,,SING,C2D,H2D,no,N,57,,236915,5981,NAP
58,,SING,O2D,HO2N,no,N,58,,236915,5981,NAP
59,,SING,C1D,N1N,no,N,59,,236915,5981,NAP
60,,SING,C1D,H1D,no,N,60,,236915,5981,NAP
61,,SING,N1N,C2N,yes,N,61,,236915,5981,NAP
62,,DOUB,N1N,C6N,yes,N,62,,236915,5981,NAP
63,,DOUB,C2N,C3N,yes,N,63,,236915,5981,NAP
64,,SING,C2N,H2N,no,N,64,,236915,5981,NAP
65,,SING,C3N,C7N,no,N,65,,236915,5981,NAP
66,,SING,C3N,C4N,yes,N,66,,236915,5981,NAP
67,,DOUB,C7N,O7N,no,N,67,,236915,5981,NAP
68,,SING,C7N,N7N,no,N,68,,236915,5981,NAP
69,,SING,N7N,H71N,no,N,69,,236915,5981,NAP
70,,SING,N7N,H72N,no,N,70,,236915,5981,NAP
71,,DOUB,C4N,C5N,yes,N,71,,236915,5981,NAP
72,,SING,C4N,H4N,no,N,72,,236915,5981,NAP
73,,SING,C5N,C6N,yes,N,73,,236915,5981,NAP
74,,SING,C5N,H5N,no,N,74,,236915,5981,NAP
75,,SING,C6N,H6N,no,N,75,,236915,5981,NAP
76,,DOUB,P2B,O1X,no,N,76,,236915,5981,NAP
77,,SING,P2B,O2X,no,N,77,,236915,5981,NAP
78,,SING,P2B,O3X,no,N,78,,236915,5981,NAP
79,,SING,O2X,HOP2,no,N,79,,236915,5981,NAP
80,,SING,O3X,HOP3,no,N,80,,236915,5981,NAP
1,,DOUB,C1,N2,yes,N,1,,236916,5981,TOP
2,,SING,C1,C8,yes,N,2,,236916,5981,TOP
3,,SING,C1,H1,no,N,3,,236916,5981,TOP
4,,SING,N2,C3,yes,N,4,,236916,5981,TOP
5,,SING,C3,N4,no,N,5,,236916,5981,TOP
6,,DOUB,C3,N5,yes,N,6,,236916,5981,TOP
7,,SING,N4,HN41,no,N,7,,236916,5981,TOP
8,,SING,N4,HN42,no,N,8,,236916,5981,TOP
9,,SING,N5,C6,yes,N,9,,236916,5981,TOP
10,,SING,C6,N7,no,N,10,,236916,5981,TOP
11,,DOUB,C6,C8,yes,N,11,,236916,5981,TOP
12,,SING,N7,HN71,no,N,12,,236916,5981,TOP
13,,SING,N7,HN72,no,N,13,,236916,5981,TOP
14,,SING,C8,C9,no,N,14,,236916,5981,TOP
15,,SING,C9,C10,no,N,15,,236916,5981,TOP
16,,SING,C9,H91,no,N,16,,236916,5981,TOP
17,,SING,C9,H92,no,N,17,,236916,5981,TOP
18,,DOUB,C10,C11,yes,N,18,,236916,5981,TOP
19,,SING,C10,C21,yes,N,19,,236916,5981,TOP
20,,SING,C11,C12,yes,N,20,,236916,5981,TOP
21,,SING,C11,H11,no,N,21,,236916,5981,TOP
22,,SING,C12,O13,no,N,22,,236916,5981,TOP
23,,DOUB,C12,C15,yes,N,23,,236916,5981,TOP
24,,SING,O13,C14,no,N,24,,236916,5981,TOP
25,,SING,C14,H141,no,N,25,,236916,5981,TOP
26,,SING,C14,H142,no,N,26,,236916,5981,TOP
27,,SING,C14,H143,no,N,27,,236916,5981,TOP
28,,SING,C15,O16,no,N,28,,236916,5981,TOP
29,,SING,C15,C18,yes,N,29,,236916,5981,TOP
30,,SING,O16,C17,no,N,30,,236916,5981,TOP
31,,SING,C17,H171,no,N,31,,236916,5981,TOP
32,,SING,C17,H172,no,N,32,,236916,5981,TOP
33,,SING,C17,H173,no,N,33,,236916,5981,TOP
34,,SING,C18,O19,no,N,34,,236916,5981,TOP
35,,DOUB,C18,C21,yes,N,35,,236916,5981,TOP
36,,SING,O19,C20,no,N,36,,236916,5981,TOP
37,,SING,C20,H201,no,N,37,,236916,5981,TOP
38,,SING,C20,H202,no,N,38,,236916,5981,TOP
39,,SING,C20,H203,no,N,39,,236916,5981,TOP
40,,SING,C21,H21,no,N,40,,236916,5981,TOP
1,,SING,N1,C2,yes,N,1,,236972,5983,FON
2,,SING,N1,C8A,yes,N,2,,236972,5983,FON
3,,SING,N1,HN1,no,N,3,,236972,5983,FON
4,,SING,C2,NA2,no,N,4,,236972,5983,FON
5,,DOUB,C2,N3,yes,N,5,,236972,5983,FON
6,,SING,NA2,HN21,no,N,6,,236972,5983,FON
7,,SING,NA2,HN22,no,N,7,,236972,5983,FON
8,,SING,N3,C4,yes,N,8,,236972,5983,FON
9,,DOUB,C4,O4,no,N,9,,236972,5983,FON
10,,SING,C4,C4A,yes,N,10,,236972,5983,FON
11,,SING,C4A,N5,no,N,11,,236972,5983,FON
12,,DOUB,C4A,C8A,yes,N,12,,236972,5983,FON
13,,SING,N5,C6,no,N,13,,236972,5983,FON
14,,SING,N5,CP1,no,N,14,,236972,5983,FON
15,,SING,C6,C7,no,N,15,,236972,5983,FON
16,,SING,C6,C9,no,N,16,,236972,5983,FON
17,,SING,C6,H61,no,N,17,,236972,5983,FON
18,,SING,C7,N8,no,N,18,,236972,5983,FON
19,,SING,C7,H7,no,N,19,,236972,5983,FON
20,,SING,C7,HC72,no,N,20,,236972,5983,FON
21,,SING,N8,C8A,no,N,21,,236972,5983,FON
22,,SING,N8,HN8,no,N,22,,236972,5983,FON
23,,SING,C9,N10,no,N,23,,236972,5983,FON
24,,SING,C9,H91,no,N,24,,236972,5983,FON
25,,SING,C9,H92,no,N,25,,236972,5983,FON
26,,SING,N10,C14,no,N,26,,236972,5983,FON
27,,SING,N10,HN0,no,N,27,,236972,5983,FON
28,,DOUB,C11,C12,yes,N,28,,236972,5983,FON
29,,SING,C11,C16,yes,N,29,,236972,5983,FON
30,,SING,C11,C,no,N,30,,236972,5983,FON
31,,SING,C12,C13,yes,N,31,,236972,5983,FON
32,,SING,C12,H12,no,N,32,,236972,5983,FON
33,,DOUB,C13,C14,yes,N,33,,236972,5983,FON
34,,SING,C13,H13,no,N,34,,236972,5983,FON
35,,SING,C14,C15,yes,N,35,,236972,5983,FON
36,,DOUB,C15,C16,yes,N,36,,236972,5983,FON
37,,SING,C15,H15,no,N,37,,236972,5983,FON
38,,SING,C16,H16,no,N,38,,236972,5983,FON
39,,DOUB,C,O,no,N,39,,236972,5983,FON
40,,SING,C,N,no,N,40,,236972,5983,FON
41,,SING,N,CA,no,N,41,,236972,5983,FON
42,,SING,N,HN,no,N,42,,236972,5983,FON
43,,SING,CA,CB,no,N,43,,236972,5983,FON
44,,SING,CA,CT,no,N,44,,236972,5983,FON
45,,SING,CA,HA,no,N,45,,236972,5983,FON
46,,SING,CB,CG,no,N,46,,236972,5983,FON
47,,SING,CB,HB1,no,N,47,,236972,5983,FON
48,,SING,CB,HB2,no,N,48,,236972,5983,FON
49,,SING,CG,CD,no,N,49,,236972,5983,FON
50,,SING,CG,HG1,no,N,50,,236972,5983,FON
51,,SING,CG,HG2,no,N,51,,236972,5983,FON
52,,DOUB,CD,OE1,no,N,52,,236972,5983,FON
53,,SING,CD,OE2,no,N,53,,236972,5983,FON
54,,SING,OE2,HOE2,no,N,54,,236972,5983,FON
55,,DOUB,CT,O1,no,N,55,,236972,5983,FON
56,,SING,CT,O2,no,N,56,,236972,5983,FON
57,,SING,O2,HO2,no,N,57,,236972,5983,FON
58,,DOUB,CP1,O3,no,N,58,,236972,5983,FON
59,,SING,CP1,HCP1,no,N,59,,236972,5983,FON
1,,SING,N,HN1,no,N,1,,237026,5985,NH2
2,,SING,N,HN2,no,N,2,,237026,5985,NH2
1,covalent,SING,O1,C6,,,,,237212,5993,1
2,covalent,SING,O1,H13,,,,,237212,5993,1
3,covalent,DOUB,O2,C7,,,,,237212,5993,1
4,covalent,DOUB,O3,C9,,,,,237212,5993,1
5,covalent,SING,N4,C7,,,,,237212,5993,1
6,covalent,SING,N4,C9,,,,,237212,5993,1
7,covalent,SING,N4,H11,,,,,237212,5993,1
8,covalent,SING,N5,C8,,,,,237212,5993,1
9,covalent,SING,N5,C9,,,,,237212,5993,1
10,covalent,SING,N5,H12,,,,,237212,5993,1
11,covalent,SING,C6,C7,,,,,237212,5993,1
12,covalent,DOUB,C6,C8,,,,,237212,5993,1
13,covalent,SING,C8,H10,,,,,237212,5993,1
1,,SING,S1,C2,no,N,1,,237298,5996,ZBT
2,,SING,S1,C5,no,N,2,,237298,5996,ZBT
3,,DOUB,C2,N3,no,N,3,,237298,5996,ZBT
4,,SING,C2,C6,no,N,4,,237298,5996,ZBT
5,,SING,N3,C4,no,N,5,,237298,5996,ZBT
6,,SING,C4,C5,no,N,6,,237298,5996,ZBT
7,,SING,C4,H4,no,N,7,,237298,5996,ZBT
8,,SING,C5,H5,no,N,8,,237298,5996,ZBT
9,,SING,C6,C7,no,N,9,,237298,5996,ZBT
10,,SING,C6,C9,no,N,10,,237298,5996,ZBT
11,,SING,C6,H6,no,N,11,,237298,5996,ZBT
12,,SING,C7,C8,no,N,12,,237298,5996,ZBT
13,,SING,C7,H7,no,N,13,,237298,5996,ZBT
14,,SING,C7,H7A,no,N,14,,237298,5996,ZBT
15,,SING,C8,H8,no,N,15,,237298,5996,ZBT
16,,SING,C8,H8A,no,N,16,,237298,5996,ZBT
17,,SING,C8,H8B,no,N,17,,237298,5996,ZBT
18,,SING,C9,H9,no,N,18,,237298,5996,ZBT
19,,SING,C9,H9A,no,N,19,,237298,5996,ZBT
20,,SING,C9,H9B,no,N,20,,237298,5996,ZBT
21,,SING,C4,H12,no,N,21,,237298,5996,ZBT
22,,SING,C5,H13,no,N,22,,237298,5996,ZBT
1,,SING,N,HN1,no,N,1,,237626,6006,NH2
2,,SING,N,HN2,no,N,2,,237626,6006,NH2
1,,SING,C3,C2,yes,N,1,,237776,6014,MDW
2,,DOUB,C3,C4,yes,N,2,,237776,6014,MDW
3,,SING,C3,H28,no,N,3,,237776,6014,MDW
4,,SING,C2,O1,no,N,4,,237776,6014,MDW
5,,DOUB,C2,C7,yes,N,5,,237776,6014,MDW
6,,SING,O1,H27,no,N,6,,237776,6014,MDW
7,,SING,C7,O12,no,N,7,,237776,6014,MDW
8,,SING,C7,C6,yes,N,8,,237776,6014,MDW
9,,SING,O12,C13,no,N,9,,237776,6014,MDW
10,,SING,C13,H35,no,N,10,,237776,6014,MDW
11,,SING,C13,H36,no,N,11,,237776,6014,MDW
12,,SING,C13,H37,no,N,12,,237776,6014,MDW
13,,DOUB,C6,C5,yes,N,13,,237776,6014,MDW
14,,SING,C6,H29,no,N,14,,237776,6014,MDW
15,,SING,C5,C8,no,N,15,,237776,6014,MDW
16,,SING,C5,C4,yes,N,16,,237776,6014,MDW
17,,SING,C8,C14,no,N,17,,237776,6014,MDW
18,,SING,C8,N9,no,N,18,,237776,6014,MDW
19,,SING,C8,H30,no,N,19,,237776,6014,MDW
20,,DOUB,C14,O15,no,N,20,,237776,6014,MDW
21,,SING,C14,N16,no,N,21,,237776,6014,MDW
22,,SING,N16,O17,no,N,22,,237776,6014,MDW
23,,SING,N16,H38,no,N,23,,237776,6014,MDW
24,,SING,O17,H39,no,N,24,,237776,6014,MDW
25,,SING,C4,C10,no,N,25,,237776,6014,MDW
26,,SING,C10,C11,no,N,26,,237776,6014,MDW
27,,SING,C10,H31,no,N,27,,237776,6014,MDW
28,,SING,C10,H32,no,N,28,,237776,6014,MDW
29,,SING,C11,N9,no,N,29,,237776,6014,MDW
30,,SING,C11,H33,no,N,30,,237776,6014,MDW
31,,SING,C11,H34,no,N,31,,237776,6014,MDW
32,,SING,N9,S18,no,N,32,,237776,6014,MDW
33,,DOUB,S18,O40,no,N,33,,237776,6014,MDW
34,,DOUB,S18,O41,no,N,34,,237776,6014,MDW
35,,SING,S18,C19,no,N,35,,237776,6014,MDW
36,,SING,C19,C20,yes,N,36,,237776,6014,MDW
37,,DOUB,C19,C24,yes,N,37,,237776,6014,MDW
38,,DOUB,C20,C21,yes,N,38,,237776,6014,MDW
39,,SING,C20,H48,no,N,39,,237776,6014,MDW
40,,SING,C21,C22,yes,N,40,,237776,6014,MDW
41,,SING,C21,H42,no,N,41,,237776,6014,MDW
42,,SING,C22,O25,no,N,42,,237776,6014,MDW
43,,DOUB,C22,C23,yes,N,43,,237776,6014,MDW
44,,SING,O25,C26,no,N,44,,237776,6014,MDW
45,,SING,C26,H45,no,N,45,,237776,6014,MDW
46,,SING,C26,H46,no,N,46,,237776,6014,MDW
47,,SING,C26,H47,no,N,47,,237776,6014,MDW
48,,SING,C23,C24,yes,N,48,,237776,6014,MDW
49,,SING,C23,H43,no,N,49,,237776,6014,MDW
50,,SING,C24,H44,no,N,50,,237776,6014,MDW
1,,SING,N,CA,,,,,237866,6018,TPO
2,,SING,N,H,,,,,237866,6018,TPO
3,,SING,N,H2,,,,,237866,6018,TPO
4,,SING,CA,CB,,,,,237866,6018,TPO
5,,SING,CA,C,,,,,237866,6018,TPO
6,,SING,CA,HA,,,,,237866,6018,TPO
7,,SING,CB,CG2,,,,,237866,6018,TPO
8,,SING,CB,OG1,,,,,237866,6018,TPO
9,,SING,CB,HB,,,,,237866,6018,TPO
10,,SING,CG2,HG21,,,,,237866,6018,TPO
11,,SING,CG2,HG22,,,,,237866,6018,TPO
12,,SING,CG2,HG23,,,,,237866,6018,TPO
13,,SING,OG1,P,,,,,237866,6018,TPO
14,,DOUB,P,O1P,,,,,237866,6018,TPO
15,,SING,P,O2P,,,,,237866,6018,TPO
16,,SING,P,O3P,,,,,237866,6018,TPO
17,,SING,O2P,HOP2,,,,,237866,6018,TPO
18,,SING,O3P,HOP3,,,,,237866,6018,TPO
19,,DOUB,C,O,,,,,237866,6018,TPO
20,,SING,C,OXT,,,,,237866,6018,TPO
21,,SING,OXT,HXT,,,,,237866,6018,TPO
1,,SING,N,HN1,no,N,1,,237897,6020,NH2
2,,SING,N,HN2,no,N,2,,237897,6020,NH2
1,,SING,FE1,S1,no,N,1,,238032,6026,FES
2,,SING,FE1,S2,no,N,2,,238032,6026,FES
3,,SING,FE2,S1,no,N,3,,238032,6026,FES
4,,SING,FE2,S2,no,N,4,,238032,6026,FES
1,,SING,N,CA,no,N,1,,238064,6027,PCA
2,,SING,N,CD,no,N,2,,238064,6027,PCA
3,,SING,N,H,no,N,3,,238064,6027,PCA
4,,SING,CA,CB,no,N,4,,238064,6027,PCA
5,,SING,CA,C,no,N,5,,238064,6027,PCA
6,,SING,CA,HA,no,N,6,,238064,6027,PCA
7,,SING,CB,CG,no,N,7,,238064,6027,PCA
8,,SING,CB,HB2,no,N,8,,238064,6027,PCA
9,,SING,CB,HB3,no,N,9,,238064,6027,PCA
10,,SING,CG,CD,no,N,10,,238064,6027,PCA
11,,SING,CG,HG2,no,N,11,,238064,6027,PCA
12,,SING,CG,HG3,no,N,12,,238064,6027,PCA
13,,DOUB,CD,OE,no,N,13,,238064,6027,PCA
14,,DOUB,C,O,no,N,14,,238064,6027,PCA
15,,SING,C,OXT,no,N,15,,238064,6027,PCA
16,,SING,OXT,HXT,no,N,16,,238064,6027,PCA
1,,SING,N,CA,no,N,1,,238065,6027,HYP
2,,SING,N,CD,no,N,2,,238065,6027,HYP
3,,SING,N,H,no,N,3,,238065,6027,HYP
4,,SING,CA,C,no,N,4,,238065,6027,HYP
5,,SING,CA,CB,no,N,5,,238065,6027,HYP
6,,SING,CA,HA,no,N,6,,238065,6027,HYP
7,,DOUB,C,O,no,N,7,,238065,6027,HYP
8,,SING,C,OXT,no,N,8,,238065,6027,HYP
9,,SING,CB,CG,no,N,9,,238065,6027,HYP
10,,SING,CB,HB2,no,N,10,,238065,6027,HYP
11,,SING,CB,HB3,no,N,11,,238065,6027,HYP
12,,SING,CG,CD,no,N,12,,238065,6027,HYP
13,,SING,CG,OD1,no,N,13,,238065,6027,HYP
14,,SING,CG,HG,no,N,14,,238065,6027,HYP
15,,SING,CD,HD22,no,N,15,,238065,6027,HYP
16,,SING,CD,HD23,no,N,16,,238065,6027,HYP
17,,SING,OD1,HD1,no,N,17,,238065,6027,HYP
18,,SING,OXT,HXT,no,N,18,,238065,6027,HYP
1,,SING,N,CA,no,N,1,,238066,6027,CY3
2,,SING,N,H,no,N,2,,238066,6027,CY3
3,,SING,N,H2,no,N,3,,238066,6027,CY3
4,,SING,CA,C,no,N,4,,238066,6027,CY3
5,,SING,CA,CB,no,N,5,,238066,6027,CY3
6,,SING,CA,HA,no,N,6,,238066,6027,CY3
7,,DOUB,C,O,no,N,7,,238066,6027,CY3
8,,SING,C,N1,no,N,8,,238066,6027,CY3
9,,SING,CB,SG,no,N,9,,238066,6027,CY3
10,,SING,CB,HB2,no,N,10,,238066,6027,CY3
11,,SING,CB,HB3,no,N,11,,238066,6027,CY3
12,,SING,SG,HG,no,N,12,,238066,6027,CY3
13,,SING,N1,HN11,no,N,13,,238066,6027,CY3
14,,SING,N1,HN12,no,N,14,,238066,6027,CY3
1,,SING,N,HN1,no,N,1,,238067,6027,NH2
2,,SING,N,HN2,no,N,2,,238067,6027,NH2
1,,DOUB,PG,O1G,no,N,1,,238145,6030,ANP
2,,SING,PG,O2G,no,N,2,,238145,6030,ANP
3,,SING,PG,O3G,no,N,3,,238145,6030,ANP
4,,SING,PG,N3B,no,N,4,,238145,6030,ANP
5,,SING,O2G,HOG2,no,N,5,,238145,6030,ANP
6,,SING,O3G,HOG3,no,N,6,,238145,6030,ANP
7,,DOUB,PB,O1B,no,N,7,,238145,6030,ANP
8,,SING,PB,O2B,no,N,8,,238145,6030,ANP
9,,SING,PB,N3B,no,N,9,,238145,6030,ANP
10,,SING,PB,O3A,no,N,10,,238145,6030,ANP
11,,SING,O2B,HOB2,no,N,11,,238145,6030,ANP
12,,SING,N3B,HNB1,no,N,12,,238145,6030,ANP
13,,DOUB,PA,O1A,no,N,13,,238145,6030,ANP
14,,SING,PA,O2A,no,N,14,,238145,6030,ANP
15,,SING,PA,O3A,no,N,15,,238145,6030,ANP
16,,SING,PA,O5',no,N,16,,238145,6030,ANP
17,,SING,O2A,HOA2,no,N,17,,238145,6030,ANP
18,,SING,O5',C5',no,N,18,,238145,6030,ANP
19,,SING,C5',C4',no,N,19,,238145,6030,ANP
20,,SING,C5',H5'1,no,N,20,,238145,6030,ANP
21,,SING,C5',H5'2,no,N,21,,238145,6030,ANP
22,,SING,C4',O4',no,N,22,,238145,6030,ANP
23,,SING,C4',C3',no,N,23,,238145,6030,ANP
24,,SING,C4',H4',no,N,24,,238145,6030,ANP
25,,SING,O4',C1',no,N,25,,238145,6030,ANP
26,,SING,C3',O3',no,N,26,,238145,6030,ANP
27,,SING,C3',C2',no,N,27,,238145,6030,ANP
28,,SING,C3',H3',no,N,28,,238145,6030,ANP
29,,SING,O3',HO3',no,N,29,,238145,6030,ANP
30,,SING,C2',O2',no,N,30,,238145,6030,ANP
31,,SING,C2',C1',no,N,31,,238145,6030,ANP
32,,SING,C2',H2',no,N,32,,238145,6030,ANP
33,,SING,O2',HO2',no,N,33,,238145,6030,ANP
34,,SING,C1',N9,no,N,34,,238145,6030,ANP
35,,SING,C1',H1',no,N,35,,238145,6030,ANP
36,,SING,N9,C8,yes,N,36,,238145,6030,ANP
37,,SING,N9,C4,yes,N,37,,238145,6030,ANP
38,,DOUB,C8,N7,yes,N,38,,238145,6030,ANP
39,,SING,C8,H8,no,N,39,,238145,6030,ANP
40,,SING,N7,C5,yes,N,40,,238145,6030,ANP
41,,SING,C5,C6,yes,N,41,,238145,6030,ANP
42,,DOUB,C5,C4,yes,N,42,,238145,6030,ANP
43,,SING,C6,N6,no,N,43,,238145,6030,ANP
44,,DOUB,C6,N1,yes,N,44,,238145,6030,ANP
45,,SING,N6,HN61,no,N,45,,238145,6030,ANP
46,,SING,N6,HN62,no,N,46,,238145,6030,ANP
47,,SING,N1,C2,yes,N,47,,238145,6030,ANP
48,,DOUB,C2,N3,yes,N,48,,238145,6030,ANP
49,,SING,C2,H2,no,N,49,,238145,6030,ANP
50,,SING,N3,C4,yes,N,50,,238145,6030,ANP
1,,SING,CHA,C1A,yes,N,1,,238213,6033,HEM
2,,DOUB,CHA,C4D,yes,N,2,,238213,6033,HEM
3,,SING,CHA,HHA,no,N,3,,238213,6033,HEM
4,,SING,CHB,C4A,yes,N,4,,238213,6033,HEM
5,,DOUB,CHB,C1B,yes,N,5,,238213,6033,HEM
6,,SING,CHB,HHB,no,N,6,,238213,6033,HEM
7,,SING,CHC,C4B,yes,N,7,,238213,6033,HEM
8,,DOUB,CHC,C1C,yes,N,8,,238213,6033,HEM
9,,SING,CHC,HHC,no,N,9,,238213,6033,HEM
10,,DOUB,CHD,C4C,yes,N,10,,238213,6033,HEM
11,,SING,CHD,C1D,yes,N,11,,238213,6033,HEM
12,,SING,CHD,HHD,no,N,12,,238213,6033,HEM
13,,DOUB,C1A,C2A,yes,N,13,,238213,6033,HEM
14,,SING,C1A,NA,yes,N,14,,238213,6033,HEM
15,,SING,C2A,C3A,yes,N,15,,238213,6033,HEM
16,,SING,C2A,CAA,no,N,16,,238213,6033,HEM
17,,DOUB,C3A,C4A,yes,N,17,,238213,6033,HEM
18,,SING,C3A,CMA,no,N,18,,238213,6033,HEM
19,,SING,C4A,NA,yes,N,19,,238213,6033,HEM
20,,SING,CMA,HMA,no,N,20,,238213,6033,HEM
21,,SING,CMA,HMAA,no,N,21,,238213,6033,HEM
22,,SING,CMA,HMAB,no,N,22,,238213,6033,HEM
23,,SING,CAA,CBA,no,N,23,,238213,6033,HEM
24,,SING,CAA,HAA,no,N,24,,238213,6033,HEM
25,,SING,CAA,HAAA,no,N,25,,238213,6033,HEM
26,,SING,CBA,CGA,no,N,26,,238213,6033,HEM
27,,SING,CBA,HBA,no,N,27,,238213,6033,HEM
28,,SING,CBA,HBAA,no,N,28,,238213,6033,HEM
29,,DOUB,CGA,O1A,no,N,29,,238213,6033,HEM
30,,SING,CGA,O2A,no,N,30,,238213,6033,HEM
31,,SING,C1B,C2B,no,N,31,,238213,6033,HEM
32,,SING,C1B,NB,yes,N,32,,238213,6033,HEM
33,,DOUB,C2B,C3B,yes,N,33,,238213,6033,HEM
34,,SING,C2B,CMB,yes,N,34,,238213,6033,HEM
35,,SING,C3B,C4B,no,N,35,,238213,6033,HEM
36,,SING,C3B,CAB,yes,N,36,,238213,6033,HEM
37,,DOUB,C4B,NB,no,N,37,,238213,6033,HEM
38,,SING,CMB,HMB,yes,N,38,,238213,6033,HEM
39,,SING,CMB,HMBA,no,N,39,,238213,6033,HEM
40,,SING,CMB,HMBB,no,N,40,,238213,6033,HEM
41,,DOUB,CAB,CBB,no,N,41,,238213,6033,HEM
42,,SING,CAB,HAB,no,N,42,,238213,6033,HEM
43,,SING,CBB,HBB,no,N,43,,238213,6033,HEM
44,,SING,CBB,HBBA,no,N,44,,238213,6033,HEM
45,,SING,C1C,C2C,no,N,45,,238213,6033,HEM
46,,SING,C1C,NC,yes,N,46,,238213,6033,HEM
47,,DOUB,C2C,C3C,yes,N,47,,238213,6033,HEM
48,,SING,C2C,CMC,yes,N,48,,238213,6033,HEM
49,,SING,C3C,C4C,no,N,49,,238213,6033,HEM
50,,SING,C3C,CAC,yes,N,50,,238213,6033,HEM
51,,SING,C4C,NC,no,N,51,,238213,6033,HEM
52,,SING,CMC,HMC,yes,N,52,,238213,6033,HEM
53,,SING,CMC,HMCA,no,N,53,,238213,6033,HEM
54,,SING,CMC,HMCB,no,N,54,,238213,6033,HEM
55,,DOUB,CAC,CBC,no,N,55,,238213,6033,HEM
56,,SING,CAC,HAC,no,N,56,,238213,6033,HEM
57,,SING,CBC,HBC,no,N,57,,238213,6033,HEM
58,,SING,CBC,HBCA,no,N,58,,238213,6033,HEM
59,,SING,C1D,C2D,no,N,59,,238213,6033,HEM
60,,DOUB,C1D,ND,yes,N,60,,238213,6033,HEM
61,,DOUB,C2D,C3D,yes,N,61,,238213,6033,HEM
62,,SING,C2D,CMD,yes,N,62,,238213,6033,HEM
63,,SING,C3D,C4D,no,N,63,,238213,6033,HEM
64,,SING,C3D,CAD,yes,N,64,,238213,6033,HEM
65,,SING,C4D,ND,no,N,65,,238213,6033,HEM
66,,SING,CMD,HMD,yes,N,66,,238213,6033,HEM
67,,SING,CMD,HMDA,no,N,67,,238213,6033,HEM
68,,SING,CMD,HMDB,no,N,68,,238213,6033,HEM
69,,SING,CAD,CBD,no,N,69,,238213,6033,HEM
70,,SING,CAD,HAD,no,N,70,,238213,6033,HEM
71,,SING,CAD,HADA,no,N,71,,238213,6033,HEM
72,,SING,CBD,CGD,no,N,72,,238213,6033,HEM
73,,SING,CBD,HBD,no,N,73,,238213,6033,HEM
74,,SING,CBD,HBDA,no,N,74,,238213,6033,HEM
75,,DOUB,CGD,O1D,no,N,75,,238213,6033,HEM
76,,SING,CGD,O2D,no,N,76,,238213,6033,HEM
77,,SING,O2A,H2A,no,N,77,,238213,6033,HEM
78,,SING,O2D,H2D,no,N,78,,238213,6033,HEM
79,,SING,FE,NA,no,N,79,,238213,6033,HEM
80,,SING,FE,NB,no,N,80,,238213,6033,HEM
81,,SING,FE,NC,no,N,81,,238213,6033,HEM
82,,SING,FE,ND,no,N,82,,238213,6033,HEM
1,,SING,N,CA,no,N,1,,238321,6039,NLE
2,,SING,N,H,no,N,2,,238321,6039,NLE
3,,SING,N,HN2,no,N,3,,238321,6039,NLE
4,,SING,CA,C,no,N,4,,238321,6039,NLE
5,,SING,CA,CB,no,N,5,,238321,6039,NLE
6,,SING,CA,HA,no,N,6,,238321,6039,NLE
7,,DOUB,C,O,no,N,7,,238321,6039,NLE
8,,SING,C,OXT,no,N,8,,238321,6039,NLE
9,,SING,OXT,HXT,no,N,9,,238321,6039,NLE
10,,SING,CB,CG,no,N,10,,238321,6039,NLE
11,,SING,CB,HB2,no,N,11,,238321,6039,NLE
12,,SING,CB,HB3,no,N,12,,238321,6039,NLE
13,,SING,CG,CD,no,N,13,,238321,6039,NLE
14,,SING,CG,HG2,no,N,14,,238321,6039,NLE
15,,SING,CG,HG3,no,N,15,,238321,6039,NLE
16,,SING,CD,CE,no,N,16,,238321,6039,NLE
17,,SING,CD,HD2,no,N,17,,238321,6039,NLE
18,,SING,CD,HD3,no,N,18,,238321,6039,NLE
19,,SING,CE,HE1,no,N,19,,238321,6039,NLE
20,,SING,CE,HE2,no,N,20,,238321,6039,NLE
21,,SING,CE,HE3,no,N,21,,238321,6039,NLE
1,,SING,N,CA,no,N,1,,238322,6039,DNE
2,,SING,N,H,no,N,2,,238322,6039,DNE
3,,SING,N,H2,no,N,3,,238322,6039,DNE
4,,SING,CA,C,no,N,4,,238322,6039,DNE
5,,SING,CA,CB,no,N,5,,238322,6039,DNE
6,,SING,CA,HA,no,N,6,,238322,6039,DNE
7,,DOUB,C,O,no,N,7,,238322,6039,DNE
8,,SING,C,OXT,no,N,8,,238322,6039,DNE
9,,SING,CB,CG,no,N,9,,238322,6039,DNE
10,,SING,CB,HB2,no,N,10,,238322,6039,DNE
11,,SING,CB,HB3,no,N,11,,238322,6039,DNE
12,,SING,CG,CD,no,N,12,,238322,6039,DNE
13,,SING,CG,HG2,no,N,13,,238322,6039,DNE
14,,SING,CG,HG3,no,N,14,,238322,6039,DNE
15,,SING,CD,CE,no,N,15,,238322,6039,DNE
16,,SING,CD,HD2,no,N,16,,238322,6039,DNE
17,,SING,CD,HD3,no,N,17,,238322,6039,DNE
18,,SING,CE,HE1,no,N,18,,238322,6039,DNE
19,,SING,CE,HE2,no,N,19,,238322,6039,DNE
20,,SING,CE,HE3,no,N,20,,238322,6039,DNE
21,,SING,OXT,HO1,no,N,21,,238322,6039,DNE
1,,SING,C1,N,no,N,1,,238323,6039,DNM
2,,SING,C1,HC1,no,N,2,,238323,6039,DNM
3,,SING,C1,HC2,no,N,3,,238323,6039,DNM
4,,SING,C1,HC3,no,N,4,,238323,6039,DNM
5,,SING,N,CA,no,N,5,,238323,6039,DNM
6,,SING,N,H,no,N,6,,238323,6039,DNM
7,,SING,CA,C,no,N,7,,238323,6039,DNM
8,,SING,CA,CB,no,N,8,,238323,6039,DNM
9,,SING,CA,HA,no,N,9,,238323,6039,DNM
10,,DOUB,C,O,no,N,10,,238323,6039,DNM
11,,SING,C,OXT,no,N,11,,238323,6039,DNM
12,,SING,CB,CG,no,N,12,,238323,6039,DNM
13,,SING,CB,HB2,no,N,13,,238323,6039,DNM
14,,SING,CB,HB3,no,N,14,,238323,6039,DNM
15,,SING,CG,CD,no,N,15,,238323,6039,DNM
16,,SING,CG,HG2,no,N,16,,238323,6039,DNM
17,,SING,CG,HG3,no,N,17,,238323,6039,DNM
18,,SING,CD,CE,no,N,18,,238323,6039,DNM
19,,SING,CD,HD2,no,N,19,,238323,6039,DNM
20,,SING,CD,HD3,no,N,20,,238323,6039,DNM
21,,SING,CE,HE1,no,N,21,,238323,6039,DNM
22,,SING,CE,HE2,no,N,22,,238323,6039,DNM
23,,SING,CE,HE3,no,N,23,,238323,6039,DNM
24,,SING,OXT,HO1,no,N,24,,238323,6039,DNM
1,,SING,N,HN1,no,N,1,,238485,6048,NH2
2,,SING,N,HN2,no,N,2,,238485,6048,NH2
1,,SING,N,CA,no,N,1,,238624,6054,SMC
2,,SING,N,H,no,N,2,,238624,6054,SMC
3,,SING,N,H2,no,N,3,,238624,6054,SMC
4,,SING,CA,CB,no,N,4,,238624,6054,SMC
5,,SING,CA,C,no,N,5,,238624,6054,SMC
6,,SING,CA,HA,no,N,6,,238624,6054,SMC
7,,SING,CB,SG,no,N,7,,238624,6054,SMC
8,,SING,CB,HB2,no,N,8,,238624,6054,SMC
9,,SING,CB,HB3,no,N,9,,238624,6054,SMC
10,,SING,SG,CS,no,N,10,,238624,6054,SMC
11,,SING,CS,HCS1,no,N,11,,238624,6054,SMC
12,,SING,CS,HCS2,no,N,12,,238624,6054,SMC
13,,SING,CS,HCS3,no,N,13,,238624,6054,SMC
14,,DOUB,C,O,no,N,14,,238624,6054,SMC
15,,SING,C,OXT,no,N,15,,238624,6054,SMC
16,,SING,OXT,HXT,no,N,16,,238624,6054,SMC
1,,SING,S1,C1,no,N,1,,238642,6055,DTT
2,,SING,S1,HS1,no,N,2,,238642,6055,DTT
3,,SING,C1,C2,no,N,3,,238642,6055,DTT
4,,SING,C1,H11,no,N,4,,238642,6055,DTT
5,,SING,C1,H12,no,N,5,,238642,6055,DTT
6,,SING,C2,O2,no,N,6,,238642,6055,DTT
7,,SING,C2,C3,no,N,7,,238642,6055,DTT
8,,SING,C2,H2,no,N,8,,238642,6055,DTT
9,,SING,O2,HO2,no,N,9,,238642,6055,DTT
10,,SING,C3,O3,no,N,10,,238642,6055,DTT
11,,SING,C3,C4,no,N,11,,238642,6055,DTT
12,,SING,C3,H3,no,N,12,,238642,6055,DTT
13,,SING,O3,HO3,no,N,13,,238642,6055,DTT
14,,SING,C4,S4,no,N,14,,238642,6055,DTT
15,,SING,C4,H41,no,N,15,,238642,6055,DTT
16,,SING,C4,H42,no,N,16,,238642,6055,DTT
17,,SING,S4,HS2,no,N,17,,238642,6055,DTT
1,,SING,N,HN1,no,N,1,,238761,606,NH2
2,,SING,N,HN2,no,N,2,,238761,606,NH2
1,,DOUB,C,O,no,N,1,,238841,6063,ACE
2,,SING,C,CH3,no,N,2,,238841,6063,ACE
3,,SING,C,H,no,N,3,,238841,6063,ACE
4,,SING,CH3,H1,no,N,4,,238841,6063,ACE
5,,SING,CH3,H2,no,N,5,,238841,6063,ACE
6,,SING,CH3,H3,no,N,6,,238841,6063,ACE
1,,SING,N,HN1,no,N,1,,238842,6063,NH2
2,,SING,N,HN2,no,N,2,,238842,6063,NH2
1,,DOUB,C,O,no,N,1,,238859,6064,ACE
2,,SING,C,CH3,no,N,2,,238859,6064,ACE
3,,SING,C,H,no,N,3,,238859,6064,ACE
4,,SING,CH3,H1,no,N,4,,238859,6064,ACE
5,,SING,CH3,H2,no,N,5,,238859,6064,ACE
6,,SING,CH3,H3,no,N,6,,238859,6064,ACE
1,,SING,N,HN1,no,N,1,,238860,6064,NH2
2,,SING,N,HN2,no,N,2,,238860,6064,NH2
1,,SING,N,HN1,no,N,1,,238877,6066,NH2
2,,SING,N,HN2,no,N,2,,238877,6066,NH2
1,,SING,N,HN1,no,N,1,,238893,6067,NH2
2,,SING,N,HN2,no,N,2,,238893,6067,NH2
1,,SING,N,HN1,no,N,1,,238909,6068,NH2
2,,SING,N,HN2,no,N,2,,238909,6068,NH2
1,,DOUB,C,O,no,N,1,,239328,6088,ACE
2,,SING,C,CH3,no,N,2,,239328,6088,ACE
3,,SING,C,H,no,N,3,,239328,6088,ACE
4,,SING,CH3,H1,no,N,4,,239328,6088,ACE
5,,SING,CH3,H2,no,N,5,,239328,6088,ACE
6,,SING,CH3,H3,no,N,6,,239328,6088,ACE
1,,SING,N,HN1,no,N,1,,239329,6088,NH2
2,,SING,N,HN2,no,N,2,,239329,6088,NH2
1,,SING,N,CA,no,N,1,,239596,6101,NLE
2,,SING,N,H,no,N,2,,239596,6101,NLE
3,,SING,N,HN2,no,N,3,,239596,6101,NLE
4,,SING,CA,C,no,N,4,,239596,6101,NLE
5,,SING,CA,CB,no,N,5,,239596,6101,NLE
6,,SING,CA,HA,no,N,6,,239596,6101,NLE
7,,DOUB,C,O,no,N,7,,239596,6101,NLE
8,,SING,C,OXT,no,N,8,,239596,6101,NLE
9,,SING,OXT,HXT,no,N,9,,239596,6101,NLE
10,,SING,CB,CG,no,N,10,,239596,6101,NLE
11,,SING,CB,HB2,no,N,11,,239596,6101,NLE
12,,SING,CB,HB3,no,N,12,,239596,6101,NLE
13,,SING,CG,CD,no,N,13,,239596,6101,NLE
14,,SING,CG,HG2,no,N,14,,239596,6101,NLE
15,,SING,CG,HG3,no,N,15,,239596,6101,NLE
16,,SING,CD,CE,no,N,16,,239596,6101,NLE
17,,SING,CD,HD2,no,N,17,,239596,6101,NLE
18,,SING,CD,HD3,no,N,18,,239596,6101,NLE
19,,SING,CE,HE1,no,N,19,,239596,6101,NLE
20,,SING,CE,HE2,no,N,20,,239596,6101,NLE
21,,SING,CE,HE3,no,N,21,,239596,6101,NLE
1,,SING,N,CA,no,N,1,,239597,6101,DNE
2,,SING,N,H,no,N,2,,239597,6101,DNE
3,,SING,N,H2,no,N,3,,239597,6101,DNE
4,,SING,CA,C,no,N,4,,239597,6101,DNE
5,,SING,CA,CB,no,N,5,,239597,6101,DNE
6,,SING,CA,HA,no,N,6,,239597,6101,DNE
7,,DOUB,C,O,no,N,7,,239597,6101,DNE
8,,SING,C,OXT,no,N,8,,239597,6101,DNE
9,,SING,CB,CG,no,N,9,,239597,6101,DNE
10,,SING,CB,HB2,no,N,10,,239597,6101,DNE
11,,SING,CB,HB3,no,N,11,,239597,6101,DNE
12,,SING,CG,CD,no,N,12,,239597,6101,DNE
13,,SING,CG,HG2,no,N,13,,239597,6101,DNE
14,,SING,CG,HG3,no,N,14,,239597,6101,DNE
15,,SING,CD,CE,no,N,15,,239597,6101,DNE
16,,SING,CD,HD2,no,N,16,,239597,6101,DNE
17,,SING,CD,HD3,no,N,17,,239597,6101,DNE
18,,SING,CE,HE1,no,N,18,,239597,6101,DNE
19,,SING,CE,HE2,no,N,19,,239597,6101,DNE
20,,SING,CE,HE3,no,N,20,,239597,6101,DNE
21,,SING,OXT,HO1,no,N,21,,239597,6101,DNE
1,,SING,C1,N,no,N,1,,239598,6101,DNM
2,,SING,C1,HC1,no,N,2,,239598,6101,DNM
3,,SING,C1,HC2,no,N,3,,239598,6101,DNM
4,,SING,C1,HC3,no,N,4,,239598,6101,DNM
5,,SING,N,CA,no,N,5,,239598,6101,DNM
6,,SING,N,H,no,N,6,,239598,6101,DNM
7,,SING,CA,C,no,N,7,,239598,6101,DNM
8,,SING,CA,CB,no,N,8,,239598,6101,DNM
9,,SING,CA,HA,no,N,9,,239598,6101,DNM
10,,DOUB,C,O,no,N,10,,239598,6101,DNM
11,,SING,C,OXT,no,N,11,,239598,6101,DNM
12,,SING,CB,CG,no,N,12,,239598,6101,DNM
13,,SING,CB,HB2,no,N,13,,239598,6101,DNM
14,,SING,CB,HB3,no,N,14,,239598,6101,DNM
15,,SING,CG,CD,no,N,15,,239598,6101,DNM
16,,SING,CG,HG2,no,N,16,,239598,6101,DNM
17,,SING,CG,HG3,no,N,17,,239598,6101,DNM
18,,SING,CD,CE,no,N,18,,239598,6101,DNM
19,,SING,CD,HD2,no,N,19,,239598,6101,DNM
20,,SING,CD,HD3,no,N,20,,239598,6101,DNM
21,,SING,CE,HE1,no,N,21,,239598,6101,DNM
22,,SING,CE,HE2,no,N,22,,239598,6101,DNM
23,,SING,CE,HE3,no,N,23,,239598,6101,DNM
24,,SING,OXT,HO1,no,N,24,,239598,6101,DNM
1,,SING,N,CA,no,N,1,,239678,6105,NLE
2,,SING,N,H,no,N,2,,239678,6105,NLE
3,,SING,N,HN2,no,N,3,,239678,6105,NLE
4,,SING,CA,C,no,N,4,,239678,6105,NLE
5,,SING,CA,CB,no,N,5,,239678,6105,NLE
6,,SING,CA,HA,no,N,6,,239678,6105,NLE
7,,DOUB,C,O,no,N,7,,239678,6105,NLE
8,,SING,C,OXT,no,N,8,,239678,6105,NLE
9,,SING,OXT,HXT,no,N,9,,239678,6105,NLE
10,,SING,CB,CG,no,N,10,,239678,6105,NLE
11,,SING,CB,HB2,no,N,11,,239678,6105,NLE
12,,SING,CB,HB3,no,N,12,,239678,6105,NLE
13,,SING,CG,CD,no,N,13,,239678,6105,NLE
14,,SING,CG,HG2,no,N,14,,239678,6105,NLE
15,,SING,CG,HG3,no,N,15,,239678,6105,NLE
16,,SING,CD,CE,no,N,16,,239678,6105,NLE
17,,SING,CD,HD2,no,N,17,,239678,6105,NLE
18,,SING,CD,HD3,no,N,18,,239678,6105,NLE
19,,SING,CE,HE1,no,N,19,,239678,6105,NLE
20,,SING,CE,HE2,no,N,20,,239678,6105,NLE
21,,SING,CE,HE3,no,N,21,,239678,6105,NLE
1,,SING,N,CA,no,N,1,,239679,6105,DNE
2,,SING,N,H,no,N,2,,239679,6105,DNE
3,,SING,N,H2,no,N,3,,239679,6105,DNE
4,,SING,CA,C,no,N,4,,239679,6105,DNE
5,,SING,CA,CB,no,N,5,,239679,6105,DNE
6,,SING,CA,HA,no,N,6,,239679,6105,DNE
7,,DOUB,C,O,no,N,7,,239679,6105,DNE
8,,SING,C,OXT,no,N,8,,239679,6105,DNE
9,,SING,CB,CG,no,N,9,,239679,6105,DNE
10,,SING,CB,HB2,no,N,10,,239679,6105,DNE
11,,SING,CB,HB3,no,N,11,,239679,6105,DNE
12,,SING,CG,CD,no,N,12,,239679,6105,DNE
13,,SING,CG,HG2,no,N,13,,239679,6105,DNE
14,,SING,CG,HG3,no,N,14,,239679,6105,DNE
15,,SING,CD,CE,no,N,15,,239679,6105,DNE
16,,SING,CD,HD2,no,N,16,,239679,6105,DNE
17,,SING,CD,HD3,no,N,17,,239679,6105,DNE
18,,SING,CE,HE1,no,N,18,,239679,6105,DNE
19,,SING,CE,HE2,no,N,19,,239679,6105,DNE
20,,SING,CE,HE3,no,N,20,,239679,6105,DNE
21,,SING,OXT,HO1,no,N,21,,239679,6105,DNE
1,,SING,C1,N,no,N,1,,239680,6105,DNM
2,,SING,C1,HC1,no,N,2,,239680,6105,DNM
3,,SING,C1,HC2,no,N,3,,239680,6105,DNM
4,,SING,C1,HC3,no,N,4,,239680,6105,DNM
5,,SING,N,CA,no,N,5,,239680,6105,DNM
6,,SING,N,H,no,N,6,,239680,6105,DNM
7,,SING,CA,C,no,N,7,,239680,6105,DNM
8,,SING,CA,CB,no,N,8,,239680,6105,DNM
9,,SING,CA,HA,no,N,9,,239680,6105,DNM
10,,DOUB,C,O,no,N,10,,239680,6105,DNM
11,,SING,C,OXT,no,N,11,,239680,6105,DNM
12,,SING,CB,CG,no,N,12,,239680,6105,DNM
13,,SING,CB,HB2,no,N,13,,239680,6105,DNM
14,,SING,CB,HB3,no,N,14,,239680,6105,DNM
15,,SING,CG,CD,no,N,15,,239680,6105,DNM
16,,SING,CG,HG2,no,N,16,,239680,6105,DNM
17,,SING,CG,HG3,no,N,17,,239680,6105,DNM
18,,SING,CD,CE,no,N,18,,239680,6105,DNM
19,,SING,CD,HD2,no,N,19,,239680,6105,DNM
20,,SING,CD,HD3,no,N,20,,239680,6105,DNM
21,,SING,CE,HE1,no,N,21,,239680,6105,DNM
22,,SING,CE,HE2,no,N,22,,239680,6105,DNM
23,,SING,CE,HE3,no,N,23,,239680,6105,DNM
24,,SING,OXT,HO1,no,N,24,,239680,6105,DNM
1,,SING,N,CA,no,N,1,,239747,6109,PCA
2,,SING,N,CD,no,N,2,,239747,6109,PCA
3,,SING,N,H,no,N,3,,239747,6109,PCA
4,,SING,CA,CB,no,N,4,,239747,6109,PCA
5,,SING,CA,C,no,N,5,,239747,6109,PCA
6,,SING,CA,HA,no,N,6,,239747,6109,PCA
7,,SING,CB,CG,no,N,7,,239747,6109,PCA
8,,SING,CB,HB2,no,N,8,,239747,6109,PCA
9,,SING,CB,HB3,no,N,9,,239747,6109,PCA
10,,SING,CG,CD,no,N,10,,239747,6109,PCA
11,,SING,CG,HG2,no,N,11,,239747,6109,PCA
12,,SING,CG,HG3,no,N,12,,239747,6109,PCA
13,,DOUB,CD,OE,no,N,13,,239747,6109,PCA
14,,DOUB,C,O,no,N,14,,239747,6109,PCA
15,,SING,C,OXT,no,N,15,,239747,6109,PCA
16,,SING,OXT,HXT,no,N,16,,239747,6109,PCA
1,,SING,C11,C21,no,N,1,,239973,6123,CTO
2,,SING,C11,O51,no,N,2,,239973,6123,CTO
3,,SING,C11,O42,no,N,3,,239973,6123,CTO
4,,SING,C11,H11,no,N,4,,239973,6123,CTO
5,,SING,C21,N21,no,N,5,,239973,6123,CTO
6,,SING,C21,C31,no,N,6,,239973,6123,CTO
7,,SING,C21,H21,no,N,7,,239973,6123,CTO
8,,SING,N21,C71,no,N,8,,239973,6123,CTO
9,,SING,N21,HNL,no,N,9,,239973,6123,CTO
10,,DOUB,C71,O71,no,N,10,,239973,6123,CTO
11,,SING,C71,C81,no,N,11,,239973,6123,CTO
12,,SING,C81,H811,no,N,12,,239973,6123,CTO
13,,SING,C81,H812,no,N,13,,239973,6123,CTO
14,,SING,C81,H813,no,N,14,,239973,6123,CTO
15,,SING,C31,O31,no,N,15,,239973,6123,CTO
16,,SING,C31,C41,no,N,16,,239973,6123,CTO
17,,SING,C31,H31,no,N,17,,239973,6123,CTO
18,,SING,O31,HOV,no,N,18,,239973,6123,CTO
19,,SING,C41,O41,no,N,19,,239973,6123,CTO
20,,SING,C41,C51,no,N,20,,239973,6123,CTO
21,,SING,C41,H41,no,N,21,,239973,6123,CTO
22,,SING,O41,HO4,no,N,22,,239973,6123,CTO
23,,SING,C51,O51,no,N,23,,239973,6123,CTO
24,,SING,C51,C61,no,N,24,,239973,6123,CTO
25,,SING,C51,H51,no,N,25,,239973,6123,CTO
26,,SING,C61,O61,no,N,26,,239973,6123,CTO
27,,SING,C61,H611,no,N,27,,239973,6123,CTO
28,,SING,C61,H612,no,N,28,,239973,6123,CTO
29,,SING,O61,HO6,no,N,29,,239973,6123,CTO
30,,SING,C12,C22,no,N,30,,239973,6123,CTO
31,,SING,C12,O52,no,N,31,,239973,6123,CTO
32,,SING,C12,O43,no,N,32,,239973,6123,CTO
33,,SING,C12,H12,no,N,33,,239973,6123,CTO
34,,SING,C22,N22,no,N,34,,239973,6123,CTO
35,,SING,C22,C32,no,N,35,,239973,6123,CTO
36,,SING,C22,H22,no,N,36,,239973,6123,CTO
37,,SING,N22,C72,no,N,37,,239973,6123,CTO
38,,SING,N22,HNM,no,N,38,,239973,6123,CTO
39,,DOUB,C72,O72,no,N,39,,239973,6123,CTO
40,,SING,C72,C82,no,N,40,,239973,6123,CTO
41,,SING,C82,H821,no,N,41,,239973,6123,CTO
42,,SING,C82,H822,no,N,42,,239973,6123,CTO
43,,SING,C82,H823,no,N,43,,239973,6123,CTO
44,,SING,C32,O32,no,N,44,,239973,6123,CTO
45,,SING,C32,C42,no,N,45,,239973,6123,CTO
46,,SING,C32,H32,no,N,46,,239973,6123,CTO
47,,SING,O32,HOW,no,N,47,,239973,6123,CTO
48,,SING,C42,O42,no,N,48,,239973,6123,CTO
49,,SING,C42,C52,no,N,49,,239973,6123,CTO
50,,SING,C42,H42,no,N,50,,239973,6123,CTO
51,,SING,C52,O52,no,N,51,,239973,6123,CTO
52,,SING,C52,C62,no,N,52,,239973,6123,CTO
53,,SING,C52,H52,no,N,53,,239973,6123,CTO
54,,SING,C62,O62,no,N,54,,239973,6123,CTO
55,,SING,C62,H621,no,N,55,,239973,6123,CTO
56,,SING,C62,H622,no,N,56,,239973,6123,CTO
57,,SING,O62,HO2,no,N,57,,239973,6123,CTO
58,,SING,C13,O13,no,N,58,,239973,6123,CTO
59,,SING,C13,C23,no,N,59,,239973,6123,CTO
60,,SING,C13,O53,no,N,60,,239973,6123,CTO
61,,SING,C13,H13,no,N,61,,239973,6123,CTO
62,,SING,O13,HOD,no,N,62,,239973,6123,CTO
63,,SING,C23,N23,no,N,63,,239973,6123,CTO
64,,SING,C23,C33,no,N,64,,239973,6123,CTO
65,,SING,C23,H23,no,N,65,,239973,6123,CTO
66,,SING,N23,C73,no,N,66,,239973,6123,CTO
67,,SING,N23,HNN,no,N,67,,239973,6123,CTO
68,,DOUB,C73,O73,no,N,68,,239973,6123,CTO
69,,SING,C73,C83,no,N,69,,239973,6123,CTO
70,,SING,C83,H831,no,N,70,,239973,6123,CTO
71,,SING,C83,H832,no,N,71,,239973,6123,CTO
72,,SING,C83,H833,no,N,72,,239973,6123,CTO
73,,SING,C33,O33,no,N,73,,239973,6123,CTO
74,,SING,C33,C43,no,N,74,,239973,6123,CTO
75,,SING,C33,H33,no,N,75,,239973,6123,CTO
76,,SING,O33,HOX,no,N,76,,239973,6123,CTO
77,,SING,C43,O43,no,N,77,,239973,6123,CTO
78,,SING,C43,C53,no,N,78,,239973,6123,CTO
79,,SING,C43,H43,no,N,79,,239973,6123,CTO
80,,SING,C53,O53,no,N,80,,239973,6123,CTO
81,,SING,C53,C63,no,N,81,,239973,6123,CTO
82,,SING,C53,H53,no,N,82,,239973,6123,CTO
83,,SING,C63,O63,no,N,83,,239973,6123,CTO
84,,SING,C63,H631,no,N,84,,239973,6123,CTO
85,,SING,C63,H632,no,N,85,,239973,6123,CTO
86,,SING,O63,HO3,no,N,86,,239973,6123,CTO
1,,SING,CHA,C1A,yes,N,1,,240120,6131,HEM
2,,DOUB,CHA,C4D,yes,N,2,,240120,6131,HEM
3,,SING,CHA,HHA,no,N,3,,240120,6131,HEM
4,,SING,CHB,C4A,yes,N,4,,240120,6131,HEM
5,,DOUB,CHB,C1B,yes,N,5,,240120,6131,HEM
6,,SING,CHB,HHB,no,N,6,,240120,6131,HEM
7,,SING,CHC,C4B,yes,N,7,,240120,6131,HEM
8,,DOUB,CHC,C1C,yes,N,8,,240120,6131,HEM
9,,SING,CHC,HHC,no,N,9,,240120,6131,HEM
10,,DOUB,CHD,C4C,yes,N,10,,240120,6131,HEM
11,,SING,CHD,C1D,yes,N,11,,240120,6131,HEM
12,,SING,CHD,HHD,no,N,12,,240120,6131,HEM
13,,DOUB,C1A,C2A,yes,N,13,,240120,6131,HEM
14,,SING,C1A,NA,yes,N,14,,240120,6131,HEM
15,,SING,C2A,C3A,yes,N,15,,240120,6131,HEM
16,,SING,C2A,CAA,no,N,16,,240120,6131,HEM
17,,DOUB,C3A,C4A,yes,N,17,,240120,6131,HEM
18,,SING,C3A,CMA,no,N,18,,240120,6131,HEM
19,,SING,C4A,NA,yes,N,19,,240120,6131,HEM
20,,SING,CMA,HMA,no,N,20,,240120,6131,HEM
21,,SING,CMA,HMAA,no,N,21,,240120,6131,HEM
22,,SING,CMA,HMAB,no,N,22,,240120,6131,HEM
23,,SING,CAA,CBA,no,N,23,,240120,6131,HEM
24,,SING,CAA,HAA,no,N,24,,240120,6131,HEM
25,,SING,CAA,HAAA,no,N,25,,240120,6131,HEM
26,,SING,CBA,CGA,no,N,26,,240120,6131,HEM
27,,SING,CBA,HBA,no,N,27,,240120,6131,HEM
28,,SING,CBA,HBAA,no,N,28,,240120,6131,HEM
29,,DOUB,CGA,O1A,no,N,29,,240120,6131,HEM
30,,SING,CGA,O2A,no,N,30,,240120,6131,HEM
31,,SING,C1B,C2B,no,N,31,,240120,6131,HEM
32,,SING,C1B,NB,yes,N,32,,240120,6131,HEM
33,,DOUB,C2B,C3B,yes,N,33,,240120,6131,HEM
34,,SING,C2B,CMB,yes,N,34,,240120,6131,HEM
35,,SING,C3B,C4B,no,N,35,,240120,6131,HEM
36,,SING,C3B,CAB,yes,N,36,,240120,6131,HEM
37,,DOUB,C4B,NB,no,N,37,,240120,6131,HEM
38,,SING,CMB,HMB,yes,N,38,,240120,6131,HEM
39,,SING,CMB,HMBA,no,N,39,,240120,6131,HEM
40,,SING,CMB,HMBB,no,N,40,,240120,6131,HEM
41,,DOUB,CAB,CBB,no,N,41,,240120,6131,HEM
42,,SING,CAB,HAB,no,N,42,,240120,6131,HEM
43,,SING,CBB,HBB,no,N,43,,240120,6131,HEM
44,,SING,CBB,HBBA,no,N,44,,240120,6131,HEM
45,,SING,C1C,C2C,no,N,45,,240120,6131,HEM
46,,SING,C1C,NC,yes,N,46,,240120,6131,HEM
47,,DOUB,C2C,C3C,yes,N,47,,240120,6131,HEM
48,,SING,C2C,CMC,yes,N,48,,240120,6131,HEM
49,,SING,C3C,C4C,no,N,49,,240120,6131,HEM
50,,SING,C3C,CAC,yes,N,50,,240120,6131,HEM
51,,SING,C4C,NC,no,N,51,,240120,6131,HEM
52,,SING,CMC,HMC,yes,N,52,,240120,6131,HEM
53,,SING,CMC,HMCA,no,N,53,,240120,6131,HEM
54,,SING,CMC,HMCB,no,N,54,,240120,6131,HEM
55,,DOUB,CAC,CBC,no,N,55,,240120,6131,HEM
56,,SING,CAC,HAC,no,N,56,,240120,6131,HEM
57,,SING,CBC,HBC,no,N,57,,240120,6131,HEM
58,,SING,CBC,HBCA,no,N,58,,240120,6131,HEM
59,,SING,C1D,C2D,no,N,59,,240120,6131,HEM
60,,DOUB,C1D,ND,yes,N,60,,240120,6131,HEM
61,,DOUB,C2D,C3D,yes,N,61,,240120,6131,HEM
62,,SING,C2D,CMD,yes,N,62,,240120,6131,HEM
63,,SING,C3D,C4D,no,N,63,,240120,6131,HEM
64,,SING,C3D,CAD,yes,N,64,,240120,6131,HEM
65,,SING,C4D,ND,no,N,65,,240120,6131,HEM
66,,SING,CMD,HMD,yes,N,66,,240120,6131,HEM
67,,SING,CMD,HMDA,no,N,67,,240120,6131,HEM
68,,SING,CMD,HMDB,no,N,68,,240120,6131,HEM
69,,SING,CAD,CBD,no,N,69,,240120,6131,HEM
70,,SING,CAD,HAD,no,N,70,,240120,6131,HEM
71,,SING,CAD,HADA,no,N,71,,240120,6131,HEM
72,,SING,CBD,CGD,no,N,72,,240120,6131,HEM
73,,SING,CBD,HBD,no,N,73,,240120,6131,HEM
74,,SING,CBD,HBDA,no,N,74,,240120,6131,HEM
75,,DOUB,CGD,O1D,no,N,75,,240120,6131,HEM
76,,SING,CGD,O2D,no,N,76,,240120,6131,HEM
77,,SING,O2A,H2A,no,N,77,,240120,6131,HEM
78,,SING,O2D,H2D,no,N,78,,240120,6131,HEM
79,,SING,FE,NA,no,N,79,,240120,6131,HEM
80,,SING,FE,NB,no,N,80,,240120,6131,HEM
81,,SING,FE,NC,no,N,81,,240120,6131,HEM
82,,SING,FE,ND,no,N,82,,240120,6131,HEM
1,,SING,C1,C2,no,N,1,,240208,6136,GAL
2,,SING,C1,O1,no,N,2,,240208,6136,GAL
3,,SING,C1,O5,no,N,3,,240208,6136,GAL
4,,SING,C1,H1,no,N,4,,240208,6136,GAL
5,,SING,C2,C3,no,N,5,,240208,6136,GAL
6,,SING,C2,O2,no,N,6,,240208,6136,GAL
7,,SING,C2,H2,no,N,7,,240208,6136,GAL
8,,SING,C3,C4,no,N,8,,240208,6136,GAL
9,,SING,C3,O3,no,N,9,,240208,6136,GAL
10,,SING,C3,H3,no,N,10,,240208,6136,GAL
11,,SING,C4,C5,no,N,11,,240208,6136,GAL
12,,SING,C4,O4,no,N,12,,240208,6136,GAL
13,,SING,C4,H4,no,N,13,,240208,6136,GAL
14,,SING,C5,C6,no,N,14,,240208,6136,GAL
15,,SING,C5,O5,no,N,15,,240208,6136,GAL
16,,SING,C5,H5,no,N,16,,240208,6136,GAL
17,,SING,C6,O6,no,N,17,,240208,6136,GAL
18,,SING,C6,H61,no,N,18,,240208,6136,GAL
19,,SING,C6,H62,no,N,19,,240208,6136,GAL
20,,SING,O1,HO1,no,N,20,,240208,6136,GAL
21,,SING,O2,HO2,no,N,21,,240208,6136,GAL
22,,SING,O3,HO3,no,N,22,,240208,6136,GAL
23,,SING,O4,HO4,no,N,23,,240208,6136,GAL
24,,SING,O6,HO6,no,N,24,,240208,6136,GAL
1,,SING,N,CA,no,N,1,,240342,6144,DHA
2,,SING,N,H,no,N,2,,240342,6144,DHA
3,,SING,N,H2,no,N,3,,240342,6144,DHA
4,,DOUB,CA,CB,no,N,4,,240342,6144,DHA
5,,SING,CA,C,no,N,5,,240342,6144,DHA
6,,SING,CB,HB1,no,N,6,,240342,6144,DHA
7,,SING,CB,HB2,no,N,7,,240342,6144,DHA
8,,DOUB,C,O,no,N,8,,240342,6144,DHA
9,,SING,C,OXT,no,N,9,,240342,6144,DHA
10,,SING,OXT,HXT,no,N,10,,240342,6144,DHA
1,,SING,N,CA,no,N,1,,240343,6144,DBU
2,,SING,N,H,no,N,2,,240343,6144,DBU
3,,SING,N,H2,no,N,3,,240343,6144,DBU
4,,DOUB,CA,CB,no,Z,4,,240343,6144,DBU
5,,SING,CA,C,no,N,5,,240343,6144,DBU
6,,SING,CB,CG,no,N,6,,240343,6144,DBU
7,,SING,CB,HB,no,N,7,,240343,6144,DBU
8,,SING,CG,HG1,no,N,8,,240343,6144,DBU
9,,SING,CG,HG2,no,N,9,,240343,6144,DBU
10,,SING,CG,HG3,no,N,10,,240343,6144,DBU
11,,DOUB,C,O,no,N,11,,240343,6144,DBU
12,,SING,C,OXT,no,N,12,,240343,6144,DBU
13,,SING,OXT,HXT,no,N,13,,240343,6144,DBU
1,,SING,N,CA,no,N,1,,240344,6144,DAL
2,,SING,N,H,no,N,2,,240344,6144,DAL
3,,SING,N,H2,no,N,3,,240344,6144,DAL
4,,SING,CA,CB,no,N,4,,240344,6144,DAL
5,,SING,CA,C,no,N,5,,240344,6144,DAL
6,,SING,CA,HA,no,N,6,,240344,6144,DAL
7,,SING,CB,HB1,no,N,7,,240344,6144,DAL
8,,SING,CB,HB2,no,N,8,,240344,6144,DAL
9,,SING,CB,HB3,no,N,9,,240344,6144,DAL
10,,DOUB,C,O,no,N,10,,240344,6144,DAL
11,,SING,C,OXT,no,N,11,,240344,6144,DAL
12,,SING,OXT,HXT,no,N,12,,240344,6144,DAL
1,,SING,N,CA,no,N,1,,240345,6144,ABA
2,,SING,N,H,no,N,2,,240345,6144,ABA
3,,SING,N,HN2,no,N,3,,240345,6144,ABA
4,,SING,CA,C,no,N,4,,240345,6144,ABA
5,,SING,CA,CB,no,N,5,,240345,6144,ABA
6,,SING,CA,HA,no,N,6,,240345,6144,ABA
7,,DOUB,C,O,no,N,7,,240345,6144,ABA
8,,SING,C,OXT,no,N,8,,240345,6144,ABA
9,,SING,CB,CG,no,N,9,,240345,6144,ABA
10,,SING,CB,HB3,no,N,10,,240345,6144,ABA
11,,SING,CB,HB2,no,N,11,,240345,6144,ABA
12,,SING,CG,HG1,no,N,12,,240345,6144,ABA
13,,SING,CG,HG3,no,N,13,,240345,6144,ABA
14,,SING,CG,HG2,no,N,14,,240345,6144,ABA
15,,SING,OXT,HXT,no,N,15,,240345,6144,ABA
1,,SING,N,CA,no,N,1,,240366,6145,DGL
2,,SING,N,H,no,N,2,,240366,6145,DGL
3,,SING,N,H2,no,N,3,,240366,6145,DGL
4,,SING,CA,C,no,N,4,,240366,6145,DGL
5,,SING,CA,CB,no,N,5,,240366,6145,DGL
6,,SING,CA,HA,no,N,6,,240366,6145,DGL
7,,DOUB,C,O,no,N,7,,240366,6145,DGL
8,,SING,C,OXT,no,N,8,,240366,6145,DGL
9,,SING,CB,CG,no,N,9,,240366,6145,DGL
10,,SING,CB,HB2,no,N,10,,240366,6145,DGL
11,,SING,CB,HB3,no,N,11,,240366,6145,DGL
12,,SING,CG,CD,no,N,12,,240366,6145,DGL
13,,SING,CG,HG2,no,N,13,,240366,6145,DGL
14,,SING,CG,HG3,no,N,14,,240366,6145,DGL
15,,DOUB,CD,OE1,no,N,15,,240366,6145,DGL
16,,SING,CD,OE2,no,N,16,,240366,6145,DGL
17,,SING,OE2,HE2,no,N,17,,240366,6145,DGL
18,,SING,OXT,HXT,no,N,18,,240366,6145,DGL
1,,SING,N,CA,no,N,1,,240367,6145,DAL
2,,SING,N,H,no,N,2,,240367,6145,DAL
3,,SING,N,H2,no,N,3,,240367,6145,DAL
4,,SING,CA,CB,no,N,4,,240367,6145,DAL
5,,SING,CA,C,no,N,5,,240367,6145,DAL
6,,SING,CA,HA,no,N,6,,240367,6145,DAL
7,,SING,CB,HB1,no,N,7,,240367,6145,DAL
8,,SING,CB,HB2,no,N,8,,240367,6145,DAL
9,,SING,CB,HB3,no,N,9,,240367,6145,DAL
10,,DOUB,C,O,no,N,10,,240367,6145,DAL
11,,SING,C,OXT,no,N,11,,240367,6145,DAL
12,,SING,OXT,HXT,no,N,12,,240367,6145,DAL
1,,SING,C1,C2,no,N,1,,240368,6145,NAG
2,,SING,C1,O1,no,N,2,,240368,6145,NAG
3,,SING,C1,O5,no,N,3,,240368,6145,NAG
4,,SING,C1,H1,no,N,4,,240368,6145,NAG
5,,SING,C2,C3,no,N,5,,240368,6145,NAG
6,,SING,C2,N2,no,N,6,,240368,6145,NAG
7,,SING,C2,H2,no,N,7,,240368,6145,NAG
8,,SING,C3,C4,no,N,8,,240368,6145,NAG
9,,SING,C3,O3,no,N,9,,240368,6145,NAG
10,,SING,C3,H3,no,N,10,,240368,6145,NAG
11,,SING,C4,C5,no,N,11,,240368,6145,NAG
12,,SING,C4,O4,no,N,12,,240368,6145,NAG
13,,SING,C4,H4,no,N,13,,240368,6145,NAG
14,,SING,C5,C6,no,N,14,,240368,6145,NAG
15,,SING,C5,O5,no,N,15,,240368,6145,NAG
16,,SING,C5,H5,no,N,16,,240368,6145,NAG
17,,SING,C6,O6,no,N,17,,240368,6145,NAG
18,,SING,C6,H61,no,N,18,,240368,6145,NAG
19,,SING,C6,H62,no,N,19,,240368,6145,NAG
20,,SING,C7,C8,no,N,20,,240368,6145,NAG
21,,SING,C7,N2,no,N,21,,240368,6145,NAG
22,,DOUB,C7,O7,no,N,22,,240368,6145,NAG
23,,SING,C8,H81,no,N,23,,240368,6145,NAG
24,,SING,C8,H82,no,N,24,,240368,6145,NAG
25,,SING,C8,H83,no,N,25,,240368,6145,NAG
26,,SING,N2,HN2,no,N,26,,240368,6145,NAG
27,,SING,O1,HO1,no,N,27,,240368,6145,NAG
28,,SING,O3,HO3,no,N,28,,240368,6145,NAG
29,,SING,O4,HO4,no,N,29,,240368,6145,NAG
30,,SING,O6,HO6,no,N,30,,240368,6145,NAG
1,,SING,C1,C2,no,N,1,,240369,6145,MUB
2,,SING,C2,C3,no,N,2,,240369,6145,MUB
3,,SING,C3,C4,no,N,3,,240369,6145,MUB
4,,SING,C4,C5,no,N,4,,240369,6145,MUB
5,,SING,C5,C6,no,N,5,,240369,6145,MUB
6,,SING,C7,C8,no,N,6,,240369,6145,MUB
7,,SING,C9,C10,no,N,7,,240369,6145,MUB
8,,SING,C9,C11,no,N,8,,240369,6145,MUB
9,,SING,C1,O1,no,N,9,,240369,6145,MUB
10,,SING,C3,O3,no,N,10,,240369,6145,MUB
11,,SING,C9,O3,no,N,11,,240369,6145,MUB
12,,SING,C4,O4,no,N,12,,240369,6145,MUB
13,,SING,C1,O5,no,N,13,,240369,6145,MUB
14,,SING,C5,O5,no,N,14,,240369,6145,MUB
15,,SING,C6,O6,no,N,15,,240369,6145,MUB
16,,DOUB,C7,O7,no,N,16,,240369,6145,MUB
17,,SING,C10,O11,no,N,17,,240369,6145,MUB
18,,DOUB,C10,O10,no,N,18,,240369,6145,MUB
19,,SING,C2,N2,no,N,19,,240369,6145,MUB
20,,SING,C7,N2,no,N,20,,240369,6145,MUB
21,,SING,C1,H1,no,N,21,,240369,6145,MUB
22,,SING,C2,H2,no,N,22,,240369,6145,MUB
23,,SING,N2,HN2,no,N,23,,240369,6145,MUB
24,,SING,C8,H81,no,N,24,,240369,6145,MUB
25,,SING,C8,H82,no,N,25,,240369,6145,MUB
26,,SING,C8,H83,no,N,26,,240369,6145,MUB
27,,SING,C3,H3,no,N,27,,240369,6145,MUB
28,,SING,C9,H9,no,N,28,,240369,6145,MUB
29,,SING,C11,H111,no,N,29,,240369,6145,MUB
30,,SING,C11,H112,no,N,30,,240369,6145,MUB
31,,SING,C11,H113,no,N,31,,240369,6145,MUB
32,,SING,C4,H4A,no,N,32,,240369,6145,MUB
33,,SING,C5,H5,no,N,33,,240369,6145,MUB
34,,SING,C6,H61,no,N,34,,240369,6145,MUB
35,,SING,C6,H62,no,N,35,,240369,6145,MUB
36,,SING,O6,HO6,no,N,36,,240369,6145,MUB
37,,SING,O4,H4,no,N,37,,240369,6145,MUB
38,,SING,O11,H1',no,N,38,,240369,6145,MUB
39,,SING,O1,HO1,no,N,39,,240369,6145,MUB
1,,DOUB,P1,O1,no,N,1,,240370,6145,POP
2,,SING,P1,O2,no,N,2,,240370,6145,POP
3,,SING,P1,O3,no,N,3,,240370,6145,POP
4,,SING,P1,O,no,N,4,,240370,6145,POP
5,,SING,O2,HO2,no,N,5,,240370,6145,POP
6,,SING,O,P2,no,N,6,,240370,6145,POP
7,,DOUB,P2,O4,no,N,7,,240370,6145,POP
8,,SING,P2,O5,no,N,8,,240370,6145,POP
9,,SING,P2,O6,no,N,9,,240370,6145,POP
10,,SING,O5,HO5,no,N,10,,240370,6145,POP
1,,SING,C1,C2,,,,,240371,6145,TPLi
2,,DOUB,C2,C3,,,,,240371,6145,TPLi
10,,SING,CG,HG3,,,,,240396,6146,MLN_2
11,,DOUB,C,O,,,,,240396,6146,MLN_2
1,,SING,N,CA,no,N,1,,240397,6146,DGL
2,,SING,N,H,no,N,2,,240397,6146,DGL
3,,SING,N,H2,no,N,3,,240397,6146,DGL
4,,SING,CA,C,no,N,4,,240397,6146,DGL
5,,SING,CA,CB,no,N,5,,240397,6146,DGL
6,,SING,CA,HA,no,N,6,,240397,6146,DGL
7,,DOUB,C,O,no,N,7,,240397,6146,DGL
8,,SING,C,OXT,no,N,8,,240397,6146,DGL
9,,SING,CB,CG,no,N,9,,240397,6146,DGL
10,,SING,CB,HB2,no,N,10,,240397,6146,DGL
11,,SING,CB,HB3,no,N,11,,240397,6146,DGL
12,,SING,CG,CD,no,N,12,,240397,6146,DGL
13,,SING,CG,HG2,no,N,13,,240397,6146,DGL
14,,SING,CG,HG3,no,N,14,,240397,6146,DGL
15,,DOUB,CD,OE1,no,N,15,,240397,6146,DGL
16,,SING,CD,OE2,no,N,16,,240397,6146,DGL
17,,SING,OE2,HE2,no,N,17,,240397,6146,DGL
18,,SING,OXT,HXT,no,N,18,,240397,6146,DGL
1,,SING,N,CA,no,N,1,,240398,6146,DAL
2,,SING,N,H,no,N,2,,240398,6146,DAL
3,,SING,N,H2,no,N,3,,240398,6146,DAL
4,,SING,CA,CB,no,N,4,,240398,6146,DAL
5,,SING,CA,C,no,N,5,,240398,6146,DAL
6,,SING,CA,HA,no,N,6,,240398,6146,DAL
7,,SING,CB,HB1,no,N,7,,240398,6146,DAL
8,,SING,CB,HB2,no,N,8,,240398,6146,DAL
9,,SING,CB,HB3,no,N,9,,240398,6146,DAL
10,,DOUB,C,O,no,N,10,,240398,6146,DAL
11,,SING,C,OXT,no,N,11,,240398,6146,DAL
12,,SING,OXT,HXT,no,N,12,,240398,6146,DAL
1,,SING,C1,C2,no,N,1,,240399,6146,NAG
2,,SING,C1,O1,no,N,2,,240399,6146,NAG
3,,SING,C1,O5,no,N,3,,240399,6146,NAG
4,,SING,C1,H1,no,N,4,,240399,6146,NAG
5,,SING,C2,C3,no,N,5,,240399,6146,NAG
6,,SING,C2,N2,no,N,6,,240399,6146,NAG
7,,SING,C2,H2,no,N,7,,240399,6146,NAG
8,,SING,C3,C4,no,N,8,,240399,6146,NAG
9,,SING,C3,O3,no,N,9,,240399,6146,NAG
10,,SING,C3,H3,no,N,10,,240399,6146,NAG
11,,SING,C4,C5,no,N,11,,240399,6146,NAG
12,,SING,C4,O4,no,N,12,,240399,6146,NAG
13,,SING,C4,H4,no,N,13,,240399,6146,NAG
14,,SING,C5,C6,no,N,14,,240399,6146,NAG
15,,SING,C5,O5,no,N,15,,240399,6146,NAG
16,,SING,C5,H5,no,N,16,,240399,6146,NAG
17,,SING,C6,O6,no,N,17,,240399,6146,NAG
18,,SING,C6,H61,no,N,18,,240399,6146,NAG
19,,SING,C6,H62,no,N,19,,240399,6146,NAG
20,,SING,C7,C8,no,N,20,,240399,6146,NAG
21,,SING,C7,N2,no,N,21,,240399,6146,NAG
22,,DOUB,C7,O7,no,N,22,,240399,6146,NAG
23,,SING,C8,H81,no,N,23,,240399,6146,NAG
24,,SING,C8,H82,no,N,24,,240399,6146,NAG
25,,SING,C8,H83,no,N,25,,240399,6146,NAG
26,,SING,N2,HN2,no,N,26,,240399,6146,NAG
27,,SING,O1,HO1,no,N,27,,240399,6146,NAG
28,,SING,O3,HO3,no,N,28,,240399,6146,NAG
29,,SING,O4,HO4,no,N,29,,240399,6146,NAG
30,,SING,O6,HO6,no,N,30,,240399,6146,NAG
1,,SING,C1,C2,,,,,240400,6146,NAM_2
2,,SING,C1,O5,,,,,240400,6146,NAM_2
3,,SING,C1,O1,,,,,240400,6146,NAM_2
4,,SING,C1,H1,,,,,240400,6146,NAM_2
5,,SING,C2,C3,,,,,240400,6146,NAM_2
6,,SING,C2,N2,,,,,240400,6146,NAM_2
7,,SING,N2,HN2,,,,,240400,6146,NAM_2
8,,SING,N2,C7,,,,,240400,6146,NAM_2
9,,DOUB,C7,O7,,,,,240400,6146,NAM_2
10,,SING,C7,C8,,,,,240400,6146,NAM_2
11,,SING,C8,H81,,,,,240400,6146,NAM_2
12,,SING,C8,H82,,,,,240400,6146,NAM_2
13,,SING,C8,H83,,,,,240400,6146,NAM_2
14,,SING,C3,C4,,,,,240400,6146,NAM_2
15,,SING,C3,O3,,,,,240400,6146,NAM_2
16,,SING,C3,H3,,,,,240400,6146,NAM_2
17,,SING,O3,C9,,,,,240400,6146,NAM_2
18,,SING,C9,H9,,,,,240400,6146,NAM_2
19,,SING,C9,C10,,,,,240400,6146,NAM_2
20,,DOUB,C10,O10,,,,,240400,6146,NAM_2
21,,SING,C9,C11,,,,,240400,6146,NAM_2
22,,SING,C11,H111,,,,,240400,6146,NAM_2
23,,SING,C11,H112,,,,,240400,6146,NAM_2
24,,SING,C11,H113,,,,,240400,6146,NAM_2
25,,SING,C4,C5,,,,,240400,6146,NAM_2
26,,SING,C4,H4,,,,,240400,6146,NAM_2
27,,SING,C4,O4,,,,,240400,6146,NAM_2
28,,SING,C5,C6,,,,,240400,6146,NAM_2
29,,SING,C5,O5,,,,,240400,6146,NAM_2
30,,SING,C5,H5,,,,,240400,6146,NAM_2
31,,SING,C6,O6,,,,,240400,6146,NAM_2
32,,SING,C6,H61,,,,,240400,6146,NAM_2
33,,SING,C6,H62,,,,,240400,6146,NAM_2
34,,SING,O6,HO6,,,,,240400,6146,NAM_2
1,,DOUB,P1,O1,no,N,1,,240401,6146,POP
2,,SING,P1,O2,no,N,2,,240401,6146,POP
3,,SING,P1,O3,no,N,3,,240401,6146,POP
4,,SING,P1,O,no,N,4,,240401,6146,POP
5,,SING,O2,HO2,no,N,5,,240401,6146,POP
6,,SING,O,P2,no,N,6,,240401,6146,POP
7,,DOUB,P2,O4,no,N,7,,240401,6146,POP
8,,SING,P2,O5,no,N,8,,240401,6146,POP
9,,SING,P2,O6,no,N,9,,240401,6146,POP
10,,SING,O5,HO5,no,N,10,,240401,6146,POP
1,,SING,C1,C2,,,,,240402,6146,TPL_2
2,,DOUB,C2,C3,,,,,240402,6146,TPL_2
3,,SING,C3,C4,,,,,240402,6146,TPL_2
4,,SING,C3,C5,,,,,240402,6146,TPL_2
10,,SING,C4,H41,,,,,240402,6146,TPL_2
11,,SING,C4,H42,,,,,240402,6146,TPL_2
12,,SING,C5,H51,,,,,240402,6146,TPL_2
13,,SING,C5,H52,,,,,240402,6146,TPL_2
14,,SING,C5,H53,,,,,240402,6146,TPL_2
1,,SING,N,CA,,,,,240485,6151,LEU_NH2
2,,SING,N,H,,,,,240485,6151,LEU_NH2
3,,SING,CA,CB,,,,,240485,6151,LEU_NH2
4,,SING,CA,C,,,,,240485,6151,LEU_NH2
5,,SING,CA,HA,,,,,240485,6151,LEU_NH2
6,,SING,CB,CG,,,,,240485,6151,LEU_NH2
7,,SING,CB,HB2,,,,,240485,6151,LEU_NH2
8,,SING,CB,HB3,,,,,240485,6151,LEU_NH2
9,,SING,CG,CD1,,,,,240485,6151,LEU_NH2
10,,SING,CG,CD2,,,,,240485,6151,LEU_NH2
11,,SING,CG,HG,,,,,240485,6151,LEU_NH2
12,,SING,CD1,HD11,,,,,240485,6151,LEU_NH2
13,,SING,CD1,HD12,,,,,240485,6151,LEU_NH2
14,,SING,CD1,HD13,,,,,240485,6151,LEU_NH2
15,,SING,CD2,HD21,,,,,240485,6151,LEU_NH2
16,,SING,CD2,HD22,,,,,240485,6151,LEU_NH2
17,,SING,CD2,HD23,,,,,240485,6151,LEU_NH2
18,,DOUB,C,O,,,,,240485,6151,LEU_NH2
19,,SING,C,NT,,,,,240485,6151,LEU_NH2
20,,SING,NT,HT1,,,,,240485,6151,LEU_NH2
21,,SING,NT,HT2,,,,,240485,6151,LEU_NH2
1,,DOUB,C6,C5,yes,N,1,,240744,6168,NAL
2,,SING,C6,C7,yes,N,2,,240744,6168,NAL
3,,SING,C5,C4A,yes,N,3,,240744,6168,NAL
4,,DOUB,C7,C8,yes,N,4,,240744,6168,NAL
5,,DOUB,C4A,C4,yes,N,5,,240744,6168,NAL
6,,SING,C4A,C8A,yes,N,6,,240744,6168,NAL
7,,SING,C8,C8A,yes,N,7,,240744,6168,NAL
8,,SING,C4,C3,yes,N,8,,240744,6168,NAL
9,,DOUB,C8A,C1,yes,N,9,,240744,6168,NAL
10,,DOUB,C3,C2,yes,N,10,,240744,6168,NAL
11,,SING,C1,C2,yes,N,11,,240744,6168,NAL
12,,SING,C2,C9,no,N,12,,240744,6168,NAL
13,,SING,C9,CA,no,N,13,,240744,6168,NAL
14,,SING,CA,N,no,N,14,,240744,6168,NAL
15,,SING,CA,C,no,N,15,,240744,6168,NAL
16,,DOUB,C,O,no,N,16,,240744,6168,NAL
17,,SING,C,OXT,no,N,17,,240744,6168,NAL
18,,SING,C1,H1,no,N,18,,240744,6168,NAL
19,,SING,C3,H3,no,N,19,,240744,6168,NAL
20,,SING,C4,H4,no,N,20,,240744,6168,NAL
21,,SING,C5,H5,no,N,21,,240744,6168,NAL
22,,SING,C6,H6,no,N,22,,240744,6168,NAL
23,,SING,C7,H7,no,N,23,,240744,6168,NAL
24,,SING,C8,H8,no,N,24,,240744,6168,NAL
25,,SING,C9,H91,no,N,25,,240744,6168,NAL
26,,SING,C9,H92,no,N,26,,240744,6168,NAL
27,,SING,CA,HA,no,N,27,,240744,6168,NAL
28,,SING,N,H,no,N,28,,240744,6168,NAL
29,,SING,N,H2,no,N,29,,240744,6168,NAL
30,,SING,OXT,HXT,no,N,30,,240744,6168,NAL
1,,SING,C1,O1,no,N,1,,241030,6182,FLU
2,,DOUB,C1,C2,yes,N,2,,241030,6182,FLU
3,,SING,C1,C13,yes,N,3,,241030,6182,FLU
4,,SING,O1,HO1,no,N,4,,241030,6182,FLU
5,,SING,C2,C3,yes,N,5,,241030,6182,FLU
6,,SING,C2,H2,no,N,6,,241030,6182,FLU
7,,SING,C3,O2,yes,N,7,,241030,6182,FLU
8,,DOUB,C3,C11,yes,N,8,,241030,6182,FLU
9,,SING,O2,C4,yes,N,9,,241030,6182,FLU
10,,DOUB,C4,C5,yes,N,10,,241030,6182,FLU
11,,SING,C4,C9,yes,N,11,,241030,6182,FLU
12,,SING,C5,C6,yes,N,12,,241030,6182,FLU
13,,SING,C5,H5,no,N,13,,241030,6182,FLU
14,,DOUB,C6,O3,no,N,14,,241030,6182,FLU
15,,SING,C6,C7,yes,N,15,,241030,6182,FLU
16,,DOUB,C7,C8,yes,N,16,,241030,6182,FLU
17,,SING,C7,H7,no,N,17,,241030,6182,FLU
18,,SING,C8,C9,yes,N,18,,241030,6182,FLU
19,,SING,C8,H8,no,N,19,,241030,6182,FLU
20,,DOUB,C9,C10,yes,N,20,,241030,6182,FLU
21,,SING,C10,C11,yes,N,21,,241030,6182,FLU
22,,SING,C10,C14,yes,N,22,,241030,6182,FLU
23,,SING,C11,C12,yes,N,23,,241030,6182,FLU
24,,DOUB,C12,C13,yes,N,24,,241030,6182,FLU
25,,SING,C12,H12,no,N,25,,241030,6182,FLU
26,,SING,C13,H13,no,N,26,,241030,6182,FLU
27,,DOUB,C14,C15,yes,N,27,,241030,6182,FLU
28,,SING,C14,C19,yes,N,28,,241030,6182,FLU
29,,SING,C15,C16,yes,N,29,,241030,6182,FLU
30,,SING,C15,H15,no,N,30,,241030,6182,FLU
31,,DOUB,C16,C17,yes,N,31,,241030,6182,FLU
32,,SING,C16,H16,no,N,32,,241030,6182,FLU
33,,SING,C17,C18,yes,N,33,,241030,6182,FLU
34,,SING,C17,H17,no,N,34,,241030,6182,FLU
35,,DOUB,C18,C19,yes,N,35,,241030,6182,FLU
36,,SING,C18,H18,no,N,36,,241030,6182,FLU
37,,SING,C19,C20,no,N,37,,241030,6182,FLU
38,,DOUB,C20,O4,no,N,38,,241030,6182,FLU
39,,SING,C20,O5,no,N,39,,241030,6182,FLU
40,,SING,O5,HO5,no,N,40,,241030,6182,FLU
1,,SING,N,CA,no,N,1,,241484,6205,ABA
2,,SING,N,H,no,N,2,,241484,6205,ABA
3,,SING,N,HN2,no,N,3,,241484,6205,ABA
4,,SING,CA,C,no,N,4,,241484,6205,ABA
5,,SING,CA,CB,no,N,5,,241484,6205,ABA
6,,SING,CA,HA,no,N,6,,241484,6205,ABA
7,,DOUB,C,O,no,N,7,,241484,6205,ABA
8,,SING,C,OXT,no,N,8,,241484,6205,ABA
9,,SING,CB,CG,no,N,9,,241484,6205,ABA
10,,SING,CB,HB3,no,N,10,,241484,6205,ABA
11,,SING,CB,HB2,no,N,11,,241484,6205,ABA
12,,SING,CG,HG1,no,N,12,,241484,6205,ABA
13,,SING,CG,HG3,no,N,13,,241484,6205,ABA
14,,SING,CG,HG2,no,N,14,,241484,6205,ABA
15,,SING,OXT,HXT,no,N,15,,241484,6205,ABA
1,,SING,N,CA,no,N,1,,241673,6217,NFA
2,,SING,N,H,no,N,2,,241673,6217,NFA
3,,SING,N,H2,no,N,3,,241673,6217,NFA
4,,SING,CA,C,no,N,4,,241673,6217,NFA
5,,SING,CA,CB,no,N,5,,241673,6217,NFA
6,,SING,CA,HA,no,N,6,,241673,6217,NFA
7,,DOUB,C,O,no,N,7,,241673,6217,NFA
8,,SING,C,NXT,no,N,8,,241673,6217,NFA
9,,SING,CB,CG,no,N,9,,241673,6217,NFA
10,,SING,CB,HB2,no,N,10,,241673,6217,NFA
11,,SING,CB,HB3,no,N,11,,241673,6217,NFA
12,,DOUB,CG,CD1,yes,N,12,,241673,6217,NFA
13,,SING,CG,CD2,yes,N,13,,241673,6217,NFA
14,,SING,CD1,CE1,yes,N,14,,241673,6217,NFA
15,,SING,CD1,HD1,no,N,15,,241673,6217,NFA
16,,DOUB,CD2,CE2,yes,N,16,,241673,6217,NFA
17,,SING,CD2,HD2,no,N,17,,241673,6217,NFA
18,,DOUB,CE1,CZ,yes,N,18,,241673,6217,NFA
19,,SING,CE1,HE1,no,N,19,,241673,6217,NFA
20,,SING,CE2,CZ,yes,N,20,,241673,6217,NFA
21,,SING,CE2,HE2,no,N,21,,241673,6217,NFA
22,,SING,CZ,HZ,no,N,22,,241673,6217,NFA
23,,SING,NXT,HXT1,no,N,23,,241673,6217,NFA
24,,SING,NXT,HXT2,no,N,24,,241673,6217,NFA
1,,SING,N,HN1,no,N,1,,241692,6218,NH2
2,,SING,N,HN2,no,N,2,,241692,6218,NH2
1,,SING,N,CA,no,N,1,,241711,6219,NFA
2,,SING,N,H,no,N,2,,241711,6219,NFA
3,,SING,N,H2,no,N,3,,241711,6219,NFA
4,,SING,CA,C,no,N,4,,241711,6219,NFA
5,,SING,CA,CB,no,N,5,,241711,6219,NFA
6,,SING,CA,HA,no,N,6,,241711,6219,NFA
7,,DOUB,C,O,no,N,7,,241711,6219,NFA
8,,SING,C,NXT,no,N,8,,241711,6219,NFA
9,,SING,CB,CG,no,N,9,,241711,6219,NFA
10,,SING,CB,HB2,no,N,10,,241711,6219,NFA
11,,SING,CB,HB3,no,N,11,,241711,6219,NFA
12,,DOUB,CG,CD1,yes,N,12,,241711,6219,NFA
13,,SING,CG,CD2,yes,N,13,,241711,6219,NFA
14,,SING,CD1,CE1,yes,N,14,,241711,6219,NFA
15,,SING,CD1,HD1,no,N,15,,241711,6219,NFA
16,,DOUB,CD2,CE2,yes,N,16,,241711,6219,NFA
17,,SING,CD2,HD2,no,N,17,,241711,6219,NFA
18,,DOUB,CE1,CZ,yes,N,18,,241711,6219,NFA
19,,SING,CE1,HE1,no,N,19,,241711,6219,NFA
20,,SING,CE2,CZ,yes,N,20,,241711,6219,NFA
21,,SING,CE2,HE2,no,N,21,,241711,6219,NFA
22,,SING,CZ,HZ,no,N,22,,241711,6219,NFA
23,,SING,NXT,HXT1,no,N,23,,241711,6219,NFA
24,,SING,NXT,HXT2,no,N,24,,241711,6219,NFA
1,,SING,N,CA,no,N,1,,241733,6220,NFA
2,,SING,N,H,no,N,2,,241733,6220,NFA
3,,SING,N,H2,no,N,3,,241733,6220,NFA
4,,SING,CA,C,no,N,4,,241733,6220,NFA
5,,SING,CA,CB,no,N,5,,241733,6220,NFA
6,,SING,CA,HA,no,N,6,,241733,6220,NFA
7,,DOUB,C,O,no,N,7,,241733,6220,NFA
8,,SING,C,NXT,no,N,8,,241733,6220,NFA
9,,SING,CB,CG,no,N,9,,241733,6220,NFA
10,,SING,CB,HB2,no,N,10,,241733,6220,NFA
11,,SING,CB,HB3,no,N,11,,241733,6220,NFA
12,,DOUB,CG,CD1,yes,N,12,,241733,6220,NFA
13,,SING,CG,CD2,yes,N,13,,241733,6220,NFA
14,,SING,CD1,CE1,yes,N,14,,241733,6220,NFA
15,,SING,CD1,HD1,no,N,15,,241733,6220,NFA
16,,DOUB,CD2,CE2,yes,N,16,,241733,6220,NFA
17,,SING,CD2,HD2,no,N,17,,241733,6220,NFA
18,,DOUB,CE1,CZ,yes,N,18,,241733,6220,NFA
19,,SING,CE1,HE1,no,N,19,,241733,6220,NFA
20,,SING,CE2,CZ,yes,N,20,,241733,6220,NFA
21,,SING,CE2,HE2,no,N,21,,241733,6220,NFA
22,,SING,CZ,HZ,no,N,22,,241733,6220,NFA
23,,SING,NXT,HXT1,no,N,23,,241733,6220,NFA
24,,SING,NXT,HXT2,no,N,24,,241733,6220,NFA
1,covalent,SING,F1,C6,,,,,241788,6223,1
2,covalent,DOUB,O2,C7,,,,,241788,6223,1
3,covalent,SING,N3,C5,,,,,241788,6223,1
4,covalent,SING,N3,C7,,,,,241788,6223,1
5,covalent,SING,N3,H10,,,,,241788,6223,1
6,covalent,SING,N4,C7,,,,,241788,6223,1
7,covalent,DOUB,N4,C8,,,,,241788,6223,1
8,covalent,DOUB,C5,C6,,,,,241788,6223,1
9,covalent,SING,C5,H9,,,,,241788,6223,1
10,covalent,SING,C6,C8,,,,,241788,6223,1
11,covalent,SING,C8,H11,,,,,241788,6223,1
1,,DOUB,PB,O1B,no,N,1,,241916,6229,ADP
2,,SING,PB,O2B,no,N,2,,241916,6229,ADP
3,,SING,PB,O3B,no,N,3,,241916,6229,ADP
4,,SING,PB,O3A,no,N,4,,241916,6229,ADP
5,,SING,O2B,HOB2,no,N,5,,241916,6229,ADP
6,,SING,O3B,HOB3,no,N,6,,241916,6229,ADP
7,,DOUB,PA,O1A,no,N,7,,241916,6229,ADP
8,,SING,PA,O2A,no,N,8,,241916,6229,ADP
9,,SING,PA,O3A,no,N,9,,241916,6229,ADP
10,,SING,PA,O5',no,N,10,,241916,6229,ADP
11,,SING,O2A,HOA2,no,N,11,,241916,6229,ADP
12,,SING,O5',C5',no,N,12,,241916,6229,ADP
13,,SING,C5',C4',no,N,13,,241916,6229,ADP
14,,SING,C5',H5'1,no,N,14,,241916,6229,ADP
15,,SING,C5',H5'2,no,N,15,,241916,6229,ADP
16,,SING,C4',O4',no,N,16,,241916,6229,ADP
17,,SING,C4',C3',no,N,17,,241916,6229,ADP
18,,SING,C4',H4',no,N,18,,241916,6229,ADP
19,,SING,O4',C1',no,N,19,,241916,6229,ADP
20,,SING,C3',O3',no,N,20,,241916,6229,ADP
21,,SING,C3',C2',no,N,21,,241916,6229,ADP
22,,SING,C3',H3',no,N,22,,241916,6229,ADP
23,,SING,O3',HO3',no,N,23,,241916,6229,ADP
24,,SING,C2',O2',no,N,24,,241916,6229,ADP
25,,SING,C2',C1',no,N,25,,241916,6229,ADP
26,,SING,C2',H2',no,N,26,,241916,6229,ADP
27,,SING,O2',HO2',no,N,27,,241916,6229,ADP
28,,SING,C1',N9,no,N,28,,241916,6229,ADP
29,,SING,C1',H1',no,N,29,,241916,6229,ADP
30,,SING,N9,C8,yes,N,30,,241916,6229,ADP
31,,SING,N9,C4,yes,N,31,,241916,6229,ADP
32,,DOUB,C8,N7,yes,N,32,,241916,6229,ADP
33,,SING,C8,H8,no,N,33,,241916,6229,ADP
34,,SING,N7,C5,yes,N,34,,241916,6229,ADP
35,,SING,C5,C6,yes,N,35,,241916,6229,ADP
36,,DOUB,C5,C4,yes,N,36,,241916,6229,ADP
37,,SING,C6,N6,no,N,37,,241916,6229,ADP
38,,DOUB,C6,N1,yes,N,38,,241916,6229,ADP
39,,SING,N6,HN61,no,N,39,,241916,6229,ADP
40,,SING,N6,HN62,no,N,40,,241916,6229,ADP
41,,SING,N1,C2,yes,N,41,,241916,6229,ADP
42,,DOUB,C2,N3,yes,N,42,,241916,6229,ADP
43,,SING,C2,H2,no,N,43,,241916,6229,ADP
44,,SING,N3,C4,yes,N,44,,241916,6229,ADP
1,,SING,FE,NA,,,,,241955,6230,HEM_ox
2,,SING,FE,NB,,,,,241955,6230,HEM_ox
3,,SING,FE,NC,,,,,241955,6230,HEM_ox
4,,SING,FE,ND,,,,,241955,6230,HEM_ox
5,,DOUB,CHA,C1A,,,,,241955,6230,HEM_ox
6,,SING,CHA,C4D,,,,,241955,6230,HEM_ox
7,,SING,CHA,HHA,,,,,241955,6230,HEM_ox
8,,DOUB,CHB,C4A,,,,,241955,6230,HEM_ox
9,,SING,CHB,C1B,,,,,241955,6230,HEM_ox
10,,SING,CHB,HHB,,,,,241955,6230,HEM_ox
11,,DOUB,CHC,C4B,,,,,241955,6230,HEM_ox
12,,SING,CHC,C1C,,,,,241955,6230,HEM_ox
13,,SING,CHC,HHC,,,,,241955,6230,HEM_ox
14,,SING,CHD,C4C,,,,,241955,6230,HEM_ox
15,,DOUB,CHD,C1D,,,,,241955,6230,HEM_ox
16,,SING,CHD,HHD,,,,,241955,6230,HEM_ox
17,,SING,NA,C1A,,,,,241955,6230,HEM_ox
18,,SING,NA,C4A,,,,,241955,6230,HEM_ox
19,,SING,C1A,C2A,,,,,241955,6230,HEM_ox
20,,DOUB,C2A,C3A,,,,,241955,6230,HEM_ox
21,,SING,C2A,CAA,,,,,241955,6230,HEM_ox
22,,SING,C3A,C4A,,,,,241955,6230,HEM_ox
23,,SING,C3A,CMA,,,,,241955,6230,HEM_ox
24,,SING,CMA,1HMA,,,,,241955,6230,HEM_ox
25,,SING,CMA,2HMA,,,,,241955,6230,HEM_ox
26,,SING,CMA,3HMA,,,,,241955,6230,HEM_ox
27,,SING,CAA,CBA,,,,,241955,6230,HEM_ox
28,,SING,CAA,1HAA,,,,,241955,6230,HEM_ox
29,,SING,CAA,2HAA,,,,,241955,6230,HEM_ox
30,,SING,CBA,CGA,,,,,241955,6230,HEM_ox
31,,SING,CBA,1HBA,,,,,241955,6230,HEM_ox
32,,SING,CBA,2HBA,,,,,241955,6230,HEM_ox
33,,DOUB,CGA,O1A,,,,,241955,6230,HEM_ox
34,,SING,CGA,O2A,,,,,241955,6230,HEM_ox
35,,SING,O2A,H2A,,,,,241955,6230,HEM_ox
36,,DOUB,NB,C1B,,,,,241955,6230,HEM_ox
37,,SING,NB,C4B,,,,,241955,6230,HEM_ox
38,,SING,C1B,C2B,,,,,241955,6230,HEM_ox
39,,DOUB,C2B,C3B,,,,,241955,6230,HEM_ox
40,,SING,C2B,CMB,,,,,241955,6230,HEM_ox
41,,SING,C3B,C4B,,,,,241955,6230,HEM_ox
42,,SING,C3B,CAB,,,,,241955,6230,HEM_ox
43,,SING,CMB,1HMB,,,,,241955,6230,HEM_ox
44,,SING,CMB,2HMB,,,,,241955,6230,HEM_ox
45,,SING,CMB,3HMB,,,,,241955,6230,HEM_ox
46,,DOUB,CAB,CBB,,,,,241955,6230,HEM_ox
47,,SING,CAB,HAB,,,,,241955,6230,HEM_ox
48,,SING,CBB,1HBB,,,,,241955,6230,HEM_ox
49,,SING,CBB,2HBB,,,,,241955,6230,HEM_ox
50,,SING,NC,C1C,,,,,241955,6230,HEM_ox
51,,SING,NC,C4C,,,,,241955,6230,HEM_ox
52,,DOUB,C1C,C2C,,,,,241955,6230,HEM_ox
53,,SING,C2C,C3C,,,,,241955,6230,HEM_ox
54,,SING,C2C,CMC,,,,,241955,6230,HEM_ox
55,,DOUB,C3C,C4C,,,,,241955,6230,HEM_ox
56,,SING,C3C,CAC,,,,,241955,6230,HEM_ox
57,,SING,CMC,1HMC,,,,,241955,6230,HEM_ox
58,,SING,CMC,2HMC,,,,,241955,6230,HEM_ox
59,,SING,CMC,3HMC,,,,,241955,6230,HEM_ox
60,,DOUB,CAC,CBC,,,,,241955,6230,HEM_ox
61,,SING,CAC,HAC,,,,,241955,6230,HEM_ox
62,,SING,CBC,1HBC,,,,,241955,6230,HEM_ox
63,,SING,CBC,2HBC,,,,,241955,6230,HEM_ox
64,,SING,ND,C1D,,,,,241955,6230,HEM_ox
65,,DOUB,ND,C4D,,,,,241955,6230,HEM_ox
66,,SING,C1D,C2D,,,,,241955,6230,HEM_ox
67,,DOUB,C2D,C3D,,,,,241955,6230,HEM_ox
68,,SING,C2D,CMD,,,,,241955,6230,HEM_ox
69,,SING,C3D,C4D,,,,,241955,6230,HEM_ox
70,,SING,C3D,CAD,,,,,241955,6230,HEM_ox
71,,SING,CMD,1HMD,,,,,241955,6230,HEM_ox
72,,SING,CMD,2HMD,,,,,241955,6230,HEM_ox
73,,SING,CMD,3HMD,,,,,241955,6230,HEM_ox
74,,SING,CAD,CBD,,,,,241955,6230,HEM_ox
75,,SING,CAD,1HAD,,,,,241955,6230,HEM_ox
76,,SING,CAD,2HAD,,,,,241955,6230,HEM_ox
77,,SING,CBD,CGD,,,,,241955,6230,HEM_ox
78,,SING,CBD,1HBD,,,,,241955,6230,HEM_ox
79,,SING,CBD,2HBD,,,,,241955,6230,HEM_ox
80,,DOUB,CGD,O1D,,,,,241955,6230,HEM_ox
81,,SING,CGD,O2D,,,,,241955,6230,HEM_ox
82,,SING,O2D,H2D,,,,,241955,6230,HEM_ox
1,,TRIP,C,N,no,N,1,,241956,6230,CYN
1,,SING,N,CA,no,N,1,,241995,6232,SEP
2,,SING,N,H,no,N,2,,241995,6232,SEP
3,,SING,N,H2,no,N,3,,241995,6232,SEP
4,,SING,CA,CB,no,N,4,,241995,6232,SEP
5,,SING,CA,C,no,N,5,,241995,6232,SEP
6,,SING,CA,HA,no,N,6,,241995,6232,SEP
7,,SING,CB,OG,no,N,7,,241995,6232,SEP
8,,SING,CB,HB2,no,N,8,,241995,6232,SEP
9,,SING,CB,HB3,no,N,9,,241995,6232,SEP
10,,SING,OG,P,no,N,10,,241995,6232,SEP
11,,DOUB,C,O,no,N,11,,241995,6232,SEP
12,,SING,C,OXT,no,N,12,,241995,6232,SEP
13,,SING,OXT,HXT,no,N,13,,241995,6232,SEP
14,,DOUB,P,O1P,no,N,14,,241995,6232,SEP
15,,SING,P,O2P,no,N,15,,241995,6232,SEP
16,,SING,P,O3P,no,N,16,,241995,6232,SEP
17,,SING,O2P,HOP2,no,N,17,,241995,6232,SEP
18,,SING,O3P,HOP3,no,N,18,,241995,6232,SEP
1,,SING,N,HN1,no,N,1,,242092,6237,NH2
2,,SING,N,HN2,no,N,2,,242092,6237,NH2
1,,SING,N,HN1,no,N,1,,242313,6245,NH2
2,,SING,N,HN2,no,N,2,,242313,6245,NH2
1,,SING,N,CA,no,N,1,,242338,6246,DAS
2,,SING,N,H,no,N,2,,242338,6246,DAS
3,,SING,N,H2,no,N,3,,242338,6246,DAS
4,,SING,CA,C,no,N,4,,242338,6246,DAS
5,,SING,CA,CB,no,N,5,,242338,6246,DAS
6,,SING,CA,HA,no,N,6,,242338,6246,DAS
7,,DOUB,C,O,no,N,7,,242338,6246,DAS
8,,SING,C,OXT,no,N,8,,242338,6246,DAS
9,,SING,CB,CG,no,N,9,,242338,6246,DAS
10,,SING,CB,HB2,no,N,10,,242338,6246,DAS
11,,SING,CB,HB3,no,N,11,,242338,6246,DAS
12,,DOUB,CG,OD1,no,N,12,,242338,6246,DAS
13,,SING,CG,OD2,no,N,13,,242338,6246,DAS
14,,SING,OD2,HD2,no,N,14,,242338,6246,DAS
15,,SING,OXT,HXT,no,N,15,,242338,6246,DAS
1,,SING,N,CA,no,N,1,,242339,6246,ORN
2,,SING,N,H,no,N,2,,242339,6246,ORN
3,,SING,N,H2,no,N,3,,242339,6246,ORN
4,,SING,CA,CB,no,N,4,,242339,6246,ORN
5,,SING,CA,C,no,N,5,,242339,6246,ORN
6,,SING,CA,HA,no,N,6,,242339,6246,ORN
7,,SING,CB,CG,no,N,7,,242339,6246,ORN
8,,SING,CB,HB2,no,N,8,,242339,6246,ORN
9,,SING,CB,HB3,no,N,9,,242339,6246,ORN
10,,SING,CG,CD,no,N,10,,242339,6246,ORN
11,,SING,CG,HG2,no,N,11,,242339,6246,ORN
12,,SING,CG,HG3,no,N,12,,242339,6246,ORN
13,,SING,CD,NE,no,N,13,,242339,6246,ORN
14,,SING,CD,HD2,no,N,14,,242339,6246,ORN
15,,SING,CD,HD3,no,N,15,,242339,6246,ORN
16,,SING,NE,HE1,no,N,16,,242339,6246,ORN
17,,SING,NE,HE2,no,N,17,,242339,6246,ORN
18,,DOUB,C,O,no,N,18,,242339,6246,ORN
19,,SING,C,OXT,no,N,19,,242339,6246,ORN
20,,SING,OXT,HXT,no,N,20,,242339,6246,ORN
1,,SING,N,CA,no,N,1,,242340,6246,DAL
2,,SING,N,H,no,N,2,,242340,6246,DAL
3,,SING,N,H2,no,N,3,,242340,6246,DAL
4,,SING,CA,CB,no,N,4,,242340,6246,DAL
5,,SING,CA,C,no,N,5,,242340,6246,DAL
6,,SING,CA,HA,no,N,6,,242340,6246,DAL
7,,SING,CB,HB1,no,N,7,,242340,6246,DAL
8,,SING,CB,HB2,no,N,8,,242340,6246,DAL
9,,SING,CB,HB3,no,N,9,,242340,6246,DAL
10,,DOUB,C,O,no,N,10,,242340,6246,DAL
11,,SING,C,OXT,no,N,11,,242340,6246,DAL
12,,SING,OXT,HXT,no,N,12,,242340,6246,DAL
1,,SING,N,CA,no,N,1,,242341,6246,DSN
2,,SING,N,H,no,N,2,,242341,6246,DSN
3,,SING,N,H2,no,N,3,,242341,6246,DSN
4,,SING,CA,C,no,N,4,,242341,6246,DSN
5,,SING,CA,CB,no,N,5,,242341,6246,DSN
6,,SING,CA,HA,no,N,6,,242341,6246,DSN
7,,DOUB,C,O,no,N,7,,242341,6246,DSN
8,,SING,C,OXT,no,N,8,,242341,6246,DSN
9,,SING,OXT,HXT,no,N,9,,242341,6246,DSN
10,,SING,CB,OG,no,N,10,,242341,6246,DSN
11,,SING,CB,HB2,no,N,11,,242341,6246,DSN
12,,SING,CB,HB3,no,N,12,,242341,6246,DSN
13,,SING,OG,HG,no,N,13,,242341,6246,DSN
1,,SING,N,CA,no,N,1,,242342,6246,MEG
2,,SING,N,H,no,N,2,,242342,6246,MEG
3,,SING,N,H2,no,N,3,,242342,6246,MEG
4,,SING,CA,CB,no,N,4,,242342,6246,MEG
5,,SING,CA,C,no,N,5,,242342,6246,MEG
6,,SING,CA,HA,no,N,6,,242342,6246,MEG
7,,SING,CB,CG,no,N,7,,242342,6246,MEG
8,,SING,CB,C1,no,N,8,,242342,6246,MEG
9,,SING,CB,HB,no,N,9,,242342,6246,MEG
10,,SING,CG,CD,no,N,10,,242342,6246,MEG
11,,SING,CG,HG2,no,N,11,,242342,6246,MEG
12,,SING,CG,HG3,no,N,12,,242342,6246,MEG
13,,DOUB,CD,OE1,no,N,13,,242342,6246,MEG
14,,SING,CD,OE2,no,N,14,,242342,6246,MEG
15,,DOUB,C,O,no,N,15,,242342,6246,MEG
16,,SING,C1,H11,no,N,16,,242342,6246,MEG
17,,SING,C1,H12,no,N,17,,242342,6246,MEG
18,,SING,C1,H13,no,N,18,,242342,6246,MEG
19,,SING,HE2,OE2,no,N,19,,242342,6246,MEG
20,,SING,C,OXT,no,N,20,,242342,6246,MEG
21,,SING,OXT,HXT,no,N,21,,242342,6246,MEG
1,,SING,CA,C,no,N,1,,242343,6246,KYN
2,,DOUB,O,C,no,N,2,,242343,6246,KYN
3,,SING,C,OXT,no,N,3,,242343,6246,KYN
4,,SING,N,CA,no,N,4,,242343,6246,KYN
5,,SING,N,H,no,N,5,,242343,6246,KYN
6,,SING,N,H2,no,N,6,,242343,6246,KYN
7,,SING,OXT,HXT,no,N,7,,242343,6246,KYN
8,,SING,CD2,C1,no,N,8,,242343,6246,KYN
9,,DOUB,O2,C1,no,N,9,,242343,6246,KYN
10,,SING,C1,CB,no,N,10,,242343,6246,KYN
11,,SING,CG,N1,no,N,11,,242343,6246,KYN
12,,SING,N1,HN1,no,N,12,,242343,6246,KYN
13,,SING,N1,HN1A,no,N,13,,242343,6246,KYN
14,,SING,CB,CA,no,N,14,,242343,6246,KYN
15,,SING,CA,HA,no,N,15,,242343,6246,KYN
16,,SING,CB,HB,no,N,16,,242343,6246,KYN
17,,SING,CB,HBA,no,N,17,,242343,6246,KYN
18,,DOUB,CD1,CG,yes,N,18,,242343,6246,KYN
19,,SING,CD2,CG,yes,N,19,,242343,6246,KYN
20,,DOUB,CZ,CE1,yes,N,20,,242343,6246,KYN
21,,SING,CZ,CE2,yes,N,21,,242343,6246,KYN
22,,SING,CZ,HZ,no,N,22,,242343,6246,KYN
23,,SING,CE1,CD1,yes,N,23,,242343,6246,KYN
24,,SING,CD1,HD1,no,N,24,,242343,6246,KYN
25,,DOUB,CE2,CD2,yes,N,25,,242343,6246,KYN
26,,SING,CE1,HE1,no,N,26,,242343,6246,KYN
27,,SING,CE2,HE2,no,N,27,,242343,6246,KYN
1,,DOUB,C1,O1,no,N,1,,242344,6246,DKA
2,,SING,C1,C2,no,N,2,,242344,6246,DKA
3,,SING,C1,O2,no,N,3,,242344,6246,DKA
4,,SING,C2,C3,no,N,4,,242344,6246,DKA
5,,SING,C2,H21,no,N,5,,242344,6246,DKA
6,,SING,C2,H22,no,N,6,,242344,6246,DKA
7,,SING,C3,C4,no,N,7,,242344,6246,DKA
8,,SING,C3,H31,no,N,8,,242344,6246,DKA
9,,SING,C3,H32,no,N,9,,242344,6246,DKA
10,,SING,C4,C5,no,N,10,,242344,6246,DKA
11,,SING,C4,H41,no,N,11,,242344,6246,DKA
12,,SING,C4,H42,no,N,12,,242344,6246,DKA
13,,SING,C5,C6,no,N,13,,242344,6246,DKA
14,,SING,C5,H51,no,N,14,,242344,6246,DKA
15,,SING,C5,H52,no,N,15,,242344,6246,DKA
16,,SING,C6,C7,no,N,16,,242344,6246,DKA
17,,SING,C6,H61,no,N,17,,242344,6246,DKA
18,,SING,C6,H62,no,N,18,,242344,6246,DKA
19,,SING,C7,C8,no,N,19,,242344,6246,DKA
20,,SING,C7,H71,no,N,20,,242344,6246,DKA
21,,SING,C7,H72,no,N,21,,242344,6246,DKA
22,,SING,C8,C9,no,N,22,,242344,6246,DKA
23,,SING,C8,H81,no,N,23,,242344,6246,DKA
24,,SING,C8,H82,no,N,24,,242344,6246,DKA
25,,SING,C9,C10,no,N,25,,242344,6246,DKA
26,,SING,C9,H91,no,N,26,,242344,6246,DKA
27,,SING,C9,H92,no,N,27,,242344,6246,DKA
28,,SING,C10,H101,no,N,28,,242344,6246,DKA
29,,SING,C10,H102,no,N,29,,242344,6246,DKA
30,,SING,C10,H103,no,N,30,,242344,6246,DKA
31,,SING,O2,HO2,no,N,31,,242344,6246,DKA
1,,SING,C1,N2,no,N,1,,242386,6248,IMY
2,,DOUB,C1,N5,no,N,2,,242386,6248,IMY
3,,SING,C1,C34,no,N,3,,242386,6248,IMY
4,,SING,N2,C3,no,N,4,,242386,6248,IMY
5,,SING,N2,C2,no,N,5,,242386,6248,IMY
6,,SING,C3,C4,no,N,6,,242386,6248,IMY
7,,SING,C3,C13,no,N,7,,242386,6248,IMY
8,,SING,C3,H3,no,N,8,,242386,6248,IMY
9,,SING,C4,N5,no,N,9,,242386,6248,IMY
10,,SING,C4,C19,no,N,10,,242386,6248,IMY
11,,SING,C4,H4,no,N,11,,242386,6248,IMY
12,,SING,C13,C14,yes,N,12,,242386,6248,IMY
13,,DOUB,C13,C18,yes,N,13,,242386,6248,IMY
14,,DOUB,C14,C15,yes,N,14,,242386,6248,IMY
15,,SING,C14,H14,no,N,15,,242386,6248,IMY
16,,SING,C15,C16,yes,N,16,,242386,6248,IMY
17,,SING,C15,H15,no,N,17,,242386,6248,IMY
18,,DOUB,C16,C17,yes,N,18,,242386,6248,IMY
19,,SING,C16,CL16,no,N,19,,242386,6248,IMY
20,,SING,C17,C18,yes,N,20,,242386,6248,IMY
21,,SING,C17,H17,no,N,21,,242386,6248,IMY
22,,SING,C18,H18,no,N,22,,242386,6248,IMY
23,,SING,C20,C21,yes,N,23,,242386,6248,IMY
24,,DOUB,C20,C19,yes,N,24,,242386,6248,IMY
25,,SING,C20,H20,no,N,25,,242386,6248,IMY
26,,DOUB,C21,C22,yes,N,26,,242386,6248,IMY
27,,SING,C21,H21,no,N,27,,242386,6248,IMY
28,,SING,C22,C23,yes,N,28,,242386,6248,IMY
29,,SING,C22,CL22,no,N,29,,242386,6248,IMY
30,,DOUB,C23,C24,yes,N,30,,242386,6248,IMY
31,,SING,C23,H23,no,N,31,,242386,6248,IMY
32,,SING,C24,C19,yes,N,32,,242386,6248,IMY
33,,SING,C24,H24,no,N,33,,242386,6248,IMY
34,,DOUB,C28,C29,yes,N,34,,242386,6248,IMY
35,,SING,C28,C27,yes,N,35,,242386,6248,IMY
36,,SING,C28,H28,no,N,36,,242386,6248,IMY
37,,SING,C29,C34,yes,N,37,,242386,6248,IMY
38,,SING,C29,O3,no,N,38,,242386,6248,IMY
39,,DOUB,C34,C25,yes,N,39,,242386,6248,IMY
40,,SING,C25,C26,yes,N,40,,242386,6248,IMY
41,,SING,C25,H25,no,N,41,,242386,6248,IMY
42,,DOUB,C26,C27,yes,N,42,,242386,6248,IMY
43,,SING,C26,H26,no,N,43,,242386,6248,IMY
44,,SING,C27,O2,no,N,44,,242386,6248,IMY
45,,SING,O3,C31,no,N,45,,242386,6248,IMY
46,,SING,C31,C32,no,N,46,,242386,6248,IMY
47,,SING,C31,C33,no,N,47,,242386,6248,IMY
48,,SING,C31,H31,no,N,48,,242386,6248,IMY
49,,SING,C32,H321,no,N,49,,242386,6248,IMY
50,,SING,C32,H322,no,N,50,,242386,6248,IMY
51,,SING,C32,H323,no,N,51,,242386,6248,IMY
52,,SING,C33,H331,no,N,52,,242386,6248,IMY
53,,SING,C33,H332,no,N,53,,242386,6248,IMY
54,,SING,C33,H333,no,N,54,,242386,6248,IMY
55,,SING,O2,C30,no,N,55,,242386,6248,IMY
56,,SING,C30,H30,no,N,56,,242386,6248,IMY
57,,SING,C30,H301,no,N,57,,242386,6248,IMY
58,,SING,C30,H302,no,N,58,,242386,6248,IMY
59,,DOUB,C2,O1,no,N,59,,242386,6248,IMY
60,,SING,C2,N1,no,N,60,,242386,6248,IMY
61,,SING,N1,C5,no,N,61,,242386,6248,IMY
62,,SING,N1,C8,no,N,62,,242386,6248,IMY
63,,SING,C5,C6,no,N,63,,242386,6248,IMY
64,,SING,C5,H51,no,N,64,,242386,6248,IMY
65,,SING,C5,H52,no,N,65,,242386,6248,IMY
66,,SING,C6,N3,no,N,66,,242386,6248,IMY
67,,SING,C6,H61,no,N,67,,242386,6248,IMY
68,,SING,C6,H62,no,N,68,,242386,6248,IMY
69,,SING,N3,C7,no,N,69,,242386,6248,IMY
70,,SING,N3,HN3,no,N,70,,242386,6248,IMY
71,,SING,C7,C8,no,N,71,,242386,6248,IMY
72,,SING,C7,H71,no,N,72,,242386,6248,IMY
73,,SING,C7,H72,no,N,73,,242386,6248,IMY
74,,SING,C8,H81,no,N,74,,242386,6248,IMY
75,,SING,C8,H82,no,N,75,,242386,6248,IMY
1,,SING,C21,C20,no,N,1,,242895,6271,OHN
2,,SING,C20,C19,no,N,2,,242895,6271,OHN
3,,SING,C19,C18,no,N,3,,242895,6271,OHN
4,,SING,C18,C17,no,N,4,,242895,6271,OHN
5,,SING,C17,C16,no,N,5,,242895,6271,OHN
6,,SING,C16,C15,no,N,6,,242895,6271,OHN
7,,SING,C15,C14,no,N,7,,242895,6271,OHN
8,,SING,C14,C13,no,N,8,,242895,6271,OHN
9,,SING,C13,C11,no,N,9,,242895,6271,OHN
10,,DOUB,C11,O12,no,N,10,,242895,6271,OHN
11,,SING,C11,C10,no,N,11,,242895,6271,OHN
12,,SING,C10,C8,no,N,12,,242895,6271,OHN
13,,DOUB,C8,O9,no,N,13,,242895,6271,OHN
14,,SING,C8,N7,no,N,14,,242895,6271,OHN
15,,SING,N7,C1,no,N,15,,242895,6271,OHN
16,,SING,C1,C5,no,N,16,,242895,6271,OHN
17,,SING,C5,C4,no,N,17,,242895,6271,OHN
18,,SING,C1,C2,no,N,18,,242895,6271,OHN
19,,DOUB,C2,O6,no,N,19,,242895,6271,OHN
20,,SING,C4,OAP,no,N,20,,242895,6271,OHN
21,,SING,C2,OAP,no,N,21,,242895,6271,OHN
22,,SING,C21,H211,no,N,22,,242895,6271,OHN
23,,SING,C21,H212,no,N,23,,242895,6271,OHN
24,,SING,C21,H213,no,N,24,,242895,6271,OHN
25,,SING,C20,H201,no,N,25,,242895,6271,OHN
26,,SING,C20,H202,no,N,26,,242895,6271,OHN
27,,SING,C19,H191,no,N,27,,242895,6271,OHN
28,,SING,C19,H192,no,N,28,,242895,6271,OHN
29,,SING,C18,H181,no,N,29,,242895,6271,OHN
30,,SING,C18,H182,no,N,30,,242895,6271,OHN
31,,SING,C17,H171,no,N,31,,242895,6271,OHN
32,,SING,C17,H172,no,N,32,,242895,6271,OHN
33,,SING,C16,H161,no,N,33,,242895,6271,OHN
34,,SING,C16,H162,no,N,34,,242895,6271,OHN
35,,SING,C15,H151,no,N,35,,242895,6271,OHN
36,,SING,C15,H152,no,N,36,,242895,6271,OHN
37,,SING,C14,H141,no,N,37,,242895,6271,OHN
38,,SING,C14,H142,no,N,38,,242895,6271,OHN
39,,SING,C13,H131,no,N,39,,242895,6271,OHN
40,,SING,C13,H132,no,N,40,,242895,6271,OHN
41,,SING,C10,H101,no,N,41,,242895,6271,OHN
42,,SING,C10,H102,no,N,42,,242895,6271,OHN
43,,SING,N7,H7,no,N,43,,242895,6271,OHN
44,,SING,C1,H1,no,N,44,,242895,6271,OHN
45,,SING,C5,H5C1,no,N,45,,242895,6271,OHN
46,,SING,C5,H5C2,no,N,46,,242895,6271,OHN
47,,SING,C4,H4C1,no,N,47,,242895,6271,OHN
48,,SING,C4,H4C2,no,N,48,,242895,6271,OHN
1,,DOUB,PA,O1A,no,N,1,,243424,6295,FDA
2,,SING,PA,O2A,no,N,2,,243424,6295,FDA
3,,SING,PA,O5B,no,N,3,,243424,6295,FDA
4,,SING,PA,O3P,no,N,4,,243424,6295,FDA
5,,SING,O2A,HOA2,no,N,5,,243424,6295,FDA
6,,SING,O5B,C5B,no,N,6,,243424,6295,FDA
7,,SING,C5B,C4B,no,N,7,,243424,6295,FDA
8,,SING,C5B,H51A,no,N,8,,243424,6295,FDA
9,,SING,C5B,H52A,no,N,9,,243424,6295,FDA
10,,SING,C4B,O4B,no,N,10,,243424,6295,FDA
11,,SING,C4B,C3B,no,N,11,,243424,6295,FDA
12,,SING,C4B,H4B,no,N,12,,243424,6295,FDA
13,,SING,O4B,C1B,no,N,13,,243424,6295,FDA
14,,SING,C3B,O3B,no,N,14,,243424,6295,FDA
15,,SING,C3B,C2B,no,N,15,,243424,6295,FDA
16,,SING,C3B,H3B,no,N,16,,243424,6295,FDA
17,,SING,O3B,HO3A,no,N,17,,243424,6295,FDA
18,,SING,C2B,O2B,no,N,18,,243424,6295,FDA
19,,SING,C2B,C1B,no,N,19,,243424,6295,FDA
20,,SING,C2B,H2B,no,N,20,,243424,6295,FDA
21,,SING,O2B,HO2A,no,N,21,,243424,6295,FDA
22,,SING,C1B,N9A,no,N,22,,243424,6295,FDA
23,,SING,C1B,H1B,no,N,23,,243424,6295,FDA
24,,SING,N9A,C8A,yes,N,24,,243424,6295,FDA
25,,SING,N9A,C4A,yes,N,25,,243424,6295,FDA
26,,DOUB,C8A,N7A,yes,N,26,,243424,6295,FDA
27,,SING,C8A,H8A,no,N,27,,243424,6295,FDA
28,,SING,N7A,C5A,yes,N,28,,243424,6295,FDA
29,,SING,C5A,C6A,yes,N,29,,243424,6295,FDA
30,,DOUB,C5A,C4A,yes,N,30,,243424,6295,FDA
31,,SING,C6A,N6A,no,N,31,,243424,6295,FDA
32,,DOUB,C6A,N1A,yes,N,32,,243424,6295,FDA
33,,SING,N6A,H61A,no,N,33,,243424,6295,FDA
34,,SING,N6A,H62A,no,N,34,,243424,6295,FDA
35,,SING,N1A,C2A,yes,N,35,,243424,6295,FDA
36,,DOUB,C2A,N3A,yes,N,36,,243424,6295,FDA
37,,SING,C2A,H2A,no,N,37,,243424,6295,FDA
38,,SING,N3A,C4A,yes,N,38,,243424,6295,FDA
39,,SING,N1,C2,no,N,39,,243424,6295,FDA
40,,SING,N1,C10,no,N,40,,243424,6295,FDA
41,,SING,N1,HN1,no,N,41,,243424,6295,FDA
42,,DOUB,C2,O2,no,N,42,,243424,6295,FDA
43,,SING,C2,N3,no,N,43,,243424,6295,FDA
44,,SING,N3,C4,no,N,44,,243424,6295,FDA
45,,SING,N3,HN3,no,N,45,,243424,6295,FDA
46,,DOUB,C4,O4,no,N,46,,243424,6295,FDA
47,,SING,C4,C4X,no,N,47,,243424,6295,FDA
48,,SING,C4X,N5,no,N,48,,243424,6295,FDA
49,,DOUB,C4X,C10,no,N,49,,243424,6295,FDA
50,,SING,N5,C5X,no,N,50,,243424,6295,FDA
51,,SING,N5,HN5,no,N,51,,243424,6295,FDA
52,,DOUB,C5X,C6,yes,N,52,,243424,6295,FDA
53,,SING,C5X,C9A,yes,N,53,,243424,6295,FDA
54,,SING,C6,C7,yes,N,54,,243424,6295,FDA
55,,SING,C6,H6,no,N,55,,243424,6295,FDA
56,,SING,C7,C7M,no,N,56,,243424,6295,FDA
57,,DOUB,C7,C8,yes,N,57,,243424,6295,FDA
58,,SING,C7M,HM71,no,N,58,,243424,6295,FDA
59,,SING,C7M,HM72,no,N,59,,243424,6295,FDA
60,,SING,C7M,HM73,no,N,60,,243424,6295,FDA
61,,SING,C8,C8M,no,N,61,,243424,6295,FDA
62,,SING,C8,C9,yes,N,62,,243424,6295,FDA
63,,SING,C8M,HM81,no,N,63,,243424,6295,FDA
64,,SING,C8M,HM82,no,N,64,,243424,6295,FDA
65,,SING,C8M,HM83,no,N,65,,243424,6295,FDA
66,,DOUB,C9,C9A,yes,N,66,,243424,6295,FDA
67,,SING,C9,H9,no,N,67,,243424,6295,FDA
68,,SING,C9A,N10,no,N,68,,243424,6295,FDA
69,,SING,N10,C10,no,N,69,,243424,6295,FDA
70,,SING,N10,C1',no,N,70,,243424,6295,FDA
71,,SING,C1',C2',no,N,71,,243424,6295,FDA
72,,SING,C1',H1'1,no,N,72,,243424,6295,FDA
73,,SING,C1',H1'2,no,N,73,,243424,6295,FDA
74,,SING,C2',O2',no,N,74,,243424,6295,FDA
75,,SING,C2',C3',no,N,75,,243424,6295,FDA
76,,SING,C2',H2',no,N,76,,243424,6295,FDA
77,,SING,O2',HO2',no,N,77,,243424,6295,FDA
78,,SING,C3',O3',no,N,78,,243424,6295,FDA
79,,SING,C3',C4',no,N,79,,243424,6295,FDA
80,,SING,C3',H3',no,N,80,,243424,6295,FDA
81,,SING,O3',HO3',no,N,81,,243424,6295,FDA
82,,SING,C4',O4',no,N,82,,243424,6295,FDA
83,,SING,C4',C5',no,N,83,,243424,6295,FDA
84,,SING,C4',H4',no,N,84,,243424,6295,FDA
85,,SING,O4',HO4',no,N,85,,243424,6295,FDA
86,,SING,C5',O5',no,N,86,,243424,6295,FDA
87,,SING,C5',H5'1,no,N,87,,243424,6295,FDA
88,,SING,C5',H5'2,no,N,88,,243424,6295,FDA
89,,SING,O5',P,no,N,89,,243424,6295,FDA
90,,DOUB,P,O1P,no,N,90,,243424,6295,FDA
91,,SING,P,O2P,no,N,91,,243424,6295,FDA
92,,SING,P,O3P,no,N,92,,243424,6295,FDA
93,,SING,O2P,HOP2,no,N,93,,243424,6295,FDA
1,,SING,C1,C2,no,N,1,,243560,630,AAC
2,,SING,C1,O1,no,N,2,,243560,630,AAC
3,,DOUB,C1,O2,no,N,3,,243560,630,AAC
4,,SING,C2,N1,no,N,4,,243560,630,AAC
5,,SING,C2,HC21,no,N,5,,243560,630,AAC
6,,SING,C2,HC22,no,N,6,,243560,630,AAC
7,,SING,C3,C4,no,N,7,,243560,630,AAC
8,,SING,C3,N1,no,N,8,,243560,630,AAC
9,,DOUB,C3,O3,no,N,9,,243560,630,AAC
10,,SING,C4,HC41,no,N,10,,243560,630,AAC
11,,SING,C4,HC42,no,N,11,,243560,630,AAC
12,,SING,C4,HC43,no,N,12,,243560,630,AAC
13,,SING,N1,HN1,no,N,13,,243560,630,AAC
14,,SING,O1,HO1,no,N,14,,243560,630,AAC
1,,SING,FE,NA,no,N,1,,243561,630,HEC
2,,SING,FE,NB,no,N,2,,243561,630,HEC
3,,SING,FE,NC,no,N,3,,243561,630,HEC
4,,SING,FE,ND,no,N,4,,243561,630,HEC
5,,DOUB,CHA,C1A,no,N,5,,243561,630,HEC
6,,SING,CHA,C4D,no,N,6,,243561,630,HEC
7,,SING,CHA,HHA,no,N,7,,243561,630,HEC
8,,DOUB,CHB,C4A,no,N,8,,243561,630,HEC
9,,SING,CHB,C1B,no,N,9,,243561,630,HEC
10,,SING,CHB,HHB,no,N,10,,243561,630,HEC
11,,DOUB,CHC,C4B,no,N,11,,243561,630,HEC
12,,SING,CHC,C1C,no,N,12,,243561,630,HEC
13,,SING,CHC,HHC,no,N,13,,243561,630,HEC
14,,DOUB,CHD,C4C,no,N,14,,243561,630,HEC
15,,SING,CHD,C1D,no,N,15,,243561,630,HEC
16,,SING,CHD,HHD,no,N,16,,243561,630,HEC
17,,SING,NA,C1A,yes,N,17,,243561,630,HEC
18,,SING,NA,C4A,yes,N,18,,243561,630,HEC
19,,SING,C1A,C2A,yes,N,19,,243561,630,HEC
20,,DOUB,C2A,C3A,yes,N,20,,243561,630,HEC
21,,SING,C2A,CAA,no,N,21,,243561,630,HEC
22,,SING,C3A,C4A,yes,N,22,,243561,630,HEC
23,,SING,C3A,CMA,no,N,23,,243561,630,HEC
24,,SING,CMA,HMA1,no,N,24,,243561,630,HEC
25,,SING,CMA,HMA2,no,N,25,,243561,630,HEC
26,,SING,CMA,HMA3,no,N,26,,243561,630,HEC
27,,SING,CAA,CBA,no,N,27,,243561,630,HEC
28,,SING,CAA,HAA1,no,N,28,,243561,630,HEC
29,,SING,CAA,HAA2,no,N,29,,243561,630,HEC
30,,SING,CBA,CGA,no,N,30,,243561,630,HEC
31,,SING,CBA,HBA1,no,N,31,,243561,630,HEC
32,,SING,CBA,HBA2,no,N,32,,243561,630,HEC
33,,DOUB,CGA,O1A,no,N,33,,243561,630,HEC
34,,SING,CGA,O2A,no,N,34,,243561,630,HEC
35,,SING,O2A,H2A,no,N,35,,243561,630,HEC
36,,SING,NB,C1B,yes,N,36,,243561,630,HEC
37,,SING,NB,C4B,yes,N,37,,243561,630,HEC
38,,DOUB,C1B,C2B,yes,N,38,,243561,630,HEC
39,,SING,C2B,C3B,yes,N,39,,243561,630,HEC
40,,SING,C2B,CMB,no,N,40,,243561,630,HEC
41,,SING,C3B,C4B,yes,N,41,,243561,630,HEC
42,,DOUB,C3B,CAB,no,E,42,,243561,630,HEC
43,,SING,CMB,HMB1,no,N,43,,243561,630,HEC
44,,SING,CMB,HMB2,no,N,44,,243561,630,HEC
45,,SING,CMB,HMB3,no,N,45,,243561,630,HEC
46,,SING,CAB,CBB,no,N,46,,243561,630,HEC
47,,SING,CAB,HAB,no,N,47,,243561,630,HEC
48,,SING,CBB,HBB1,no,N,48,,243561,630,HEC
49,,SING,CBB,HBB2,no,N,49,,243561,630,HEC
50,,SING,CBB,HBB3,no,N,50,,243561,630,HEC
51,,SING,NC,C1C,yes,N,51,,243561,630,HEC
52,,SING,NC,C4C,yes,N,52,,243561,630,HEC
53,,DOUB,C1C,C2C,yes,N,53,,243561,630,HEC
54,,SING,C2C,C3C,yes,N,54,,243561,630,HEC
55,,SING,C2C,CMC,no,N,55,,243561,630,HEC
56,,SING,C3C,C4C,yes,N,56,,243561,630,HEC
57,,DOUB,C3C,CAC,no,E,57,,243561,630,HEC
58,,SING,CMC,HMC1,no,N,58,,243561,630,HEC
59,,SING,CMC,HMC2,no,N,59,,243561,630,HEC
60,,SING,CMC,HMC3,no,N,60,,243561,630,HEC
61,,SING,CAC,CBC,no,N,61,,243561,630,HEC
62,,SING,CAC,HAC,no,N,62,,243561,630,HEC
63,,SING,CBC,HBC1,no,N,63,,243561,630,HEC
64,,SING,CBC,HBC2,no,N,64,,243561,630,HEC
65,,SING,CBC,HBC3,no,N,65,,243561,630,HEC
66,,SING,ND,C1D,yes,N,66,,243561,630,HEC
67,,SING,ND,C4D,yes,N,67,,243561,630,HEC
68,,DOUB,C1D,C2D,yes,N,68,,243561,630,HEC
69,,SING,C2D,C3D,yes,N,69,,243561,630,HEC
70,,SING,C2D,CMD,no,N,70,,243561,630,HEC
71,,DOUB,C3D,C4D,yes,N,71,,243561,630,HEC
72,,SING,C3D,CAD,no,N,72,,243561,630,HEC
73,,SING,CMD,HMD1,no,N,73,,243561,630,HEC
74,,SING,CMD,HMD2,no,N,74,,243561,630,HEC
75,,SING,CMD,HMD3,no,N,75,,243561,630,HEC
76,,SING,CAD,CBD,no,N,76,,243561,630,HEC
77,,SING,CAD,HAD1,no,N,77,,243561,630,HEC
78,,SING,CAD,HAD2,no,N,78,,243561,630,HEC
79,,SING,CBD,CGD,no,N,79,,243561,630,HEC
80,,SING,CBD,HBD1,no,N,80,,243561,630,HEC
81,,SING,CBD,HBD2,no,N,81,,243561,630,HEC
82,,DOUB,CGD,O1D,no,N,82,,243561,630,HEC
83,,SING,CGD,O2D,no,N,83,,243561,630,HEC
84,,SING,O2D,H2D,no,N,84,,243561,630,HEC
1,,DOUB,C,O,no,N,1,,243596,6301,ACE
2,,SING,C,CH3,no,N,2,,243596,6301,ACE
3,,SING,C,H,no,N,3,,243596,6301,ACE
4,,SING,CH3,H1,no,N,4,,243596,6301,ACE
5,,SING,CH3,H2,no,N,5,,243596,6301,ACE
6,,SING,CH3,H3,no,N,6,,243596,6301,ACE
1,,SING,N,HN1,no,N,1,,243597,6301,NH2
2,,SING,N,HN2,no,N,2,,243597,6301,NH2
1,,DOUB,C1,O1,no,N,1,,244230,6333,OLA
2,,SING,C1,O2,no,N,2,,244230,6333,OLA
3,,SING,C1,C2,no,N,3,,244230,6333,OLA
4,,SING,O2,HO2,no,N,4,,244230,6333,OLA
5,,SING,C2,C3,no,N,5,,244230,6333,OLA
6,,SING,C2,H21,no,N,6,,244230,6333,OLA
7,,SING,C2,H22,no,N,7,,244230,6333,OLA
8,,SING,C3,C4,no,N,8,,244230,6333,OLA
9,,SING,C3,H31,no,N,9,,244230,6333,OLA
10,,SING,C3,H32,no,N,10,,244230,6333,OLA
11,,SING,C4,C5,no,N,11,,244230,6333,OLA
12,,SING,C4,H41,no,N,12,,244230,6333,OLA
13,,SING,C4,H42,no,N,13,,244230,6333,OLA
14,,SING,C5,C6,no,N,14,,244230,6333,OLA
15,,SING,C5,H51,no,N,15,,244230,6333,OLA
16,,SING,C5,H52,no,N,16,,244230,6333,OLA
17,,SING,C6,C7,no,N,17,,244230,6333,OLA
18,,SING,C6,H61,no,N,18,,244230,6333,OLA
19,,SING,C6,H62,no,N,19,,244230,6333,OLA
20,,SING,C7,C8,no,N,20,,244230,6333,OLA
21,,SING,C7,H71,no,N,21,,244230,6333,OLA
22,,SING,C7,H72,no,N,22,,244230,6333,OLA
23,,SING,C8,C9,no,N,23,,244230,6333,OLA
24,,SING,C8,H81,no,N,24,,244230,6333,OLA
25,,SING,C8,H82,no,N,25,,244230,6333,OLA
26,,DOUB,C9,C10,no,Z,26,,244230,6333,OLA
27,,SING,C9,H9,no,N,27,,244230,6333,OLA
28,,SING,C10,C11,no,N,28,,244230,6333,OLA
29,,SING,C10,H10,no,N,29,,244230,6333,OLA
30,,SING,C11,C12,no,N,30,,244230,6333,OLA
31,,SING,C11,H111,no,N,31,,244230,6333,OLA
32,,SING,C11,H112,no,N,32,,244230,6333,OLA
33,,SING,C12,C13,no,N,33,,244230,6333,OLA
34,,SING,C12,H121,no,N,34,,244230,6333,OLA
35,,SING,C12,H122,no,N,35,,244230,6333,OLA
36,,SING,C13,C14,no,N,36,,244230,6333,OLA
37,,SING,C13,H131,no,N,37,,244230,6333,OLA
38,,SING,C13,H132,no,N,38,,244230,6333,OLA
39,,SING,C14,C15,no,N,39,,244230,6333,OLA
40,,SING,C14,H141,no,N,40,,244230,6333,OLA
41,,SING,C14,H142,no,N,41,,244230,6333,OLA
42,,SING,C15,C16,no,N,42,,244230,6333,OLA
43,,SING,C15,H151,no,N,43,,244230,6333,OLA
44,,SING,C15,H152,no,N,44,,244230,6333,OLA
45,,SING,C16,C17,no,N,45,,244230,6333,OLA
46,,SING,C16,H161,no,N,46,,244230,6333,OLA
47,,SING,C16,H162,no,N,47,,244230,6333,OLA
48,,SING,C17,C18,no,N,48,,244230,6333,OLA
49,,SING,C17,H171,no,N,49,,244230,6333,OLA
50,,SING,C17,H172,no,N,50,,244230,6333,OLA
51,,SING,C18,H181,no,N,51,,244230,6333,OLA
52,,SING,C18,H182,no,N,52,,244230,6333,OLA
53,,SING,C18,H183,no,N,53,,244230,6333,OLA
1,,DOUB,PG,O1G,no,N,1,,244293,6336,ATP
2,,SING,PG,O2G,no,N,2,,244293,6336,ATP
3,,SING,PG,O3G,no,N,3,,244293,6336,ATP
4,,SING,PG,O3B,no,N,4,,244293,6336,ATP
5,,SING,O2G,HOG2,no,N,5,,244293,6336,ATP
6,,SING,O3G,HOG3,no,N,6,,244293,6336,ATP
7,,DOUB,PB,O1B,no,N,7,,244293,6336,ATP
8,,SING,PB,O2B,no,N,8,,244293,6336,ATP
9,,SING,PB,O3B,no,N,9,,244293,6336,ATP
10,,SING,PB,O3A,no,N,10,,244293,6336,ATP
11,,SING,O2B,HOB2,no,N,11,,244293,6336,ATP
12,,DOUB,PA,O1A,no,N,12,,244293,6336,ATP
13,,SING,PA,O2A,no,N,13,,244293,6336,ATP
14,,SING,PA,O3A,no,N,14,,244293,6336,ATP
15,,SING,PA,O5',no,N,15,,244293,6336,ATP
16,,SING,O2A,HOA2,no,N,16,,244293,6336,ATP
17,,SING,O5',C5',no,N,17,,244293,6336,ATP
18,,SING,C5',C4',no,N,18,,244293,6336,ATP
19,,SING,C5',H5'1,no,N,19,,244293,6336,ATP
20,,SING,C5',H5'2,no,N,20,,244293,6336,ATP
21,,SING,C4',O4',no,N,21,,244293,6336,ATP
22,,SING,C4',C3',no,N,22,,244293,6336,ATP
23,,SING,C4',H4',no,N,23,,244293,6336,ATP
24,,SING,O4',C1',no,N,24,,244293,6336,ATP
25,,SING,C3',O3',no,N,25,,244293,6336,ATP
26,,SING,C3',C2',no,N,26,,244293,6336,ATP
27,,SING,C3',H3',no,N,27,,244293,6336,ATP
28,,SING,O3',HO3',no,N,28,,244293,6336,ATP
29,,SING,C2',O2',no,N,29,,244293,6336,ATP
30,,SING,C2',C1',no,N,30,,244293,6336,ATP
31,,SING,C2',H2',no,N,31,,244293,6336,ATP
32,,SING,O2',HO2',no,N,32,,244293,6336,ATP
33,,SING,C1',N9,no,N,33,,244293,6336,ATP
34,,SING,C1',H1',no,N,34,,244293,6336,ATP
35,,SING,N9,C8,yes,N,35,,244293,6336,ATP
36,,SING,N9,C4,yes,N,36,,244293,6336,ATP
37,,DOUB,C8,N7,yes,N,37,,244293,6336,ATP
38,,SING,C8,H8,no,N,38,,244293,6336,ATP
39,,SING,N7,C5,yes,N,39,,244293,6336,ATP
40,,SING,C5,C6,yes,N,40,,244293,6336,ATP
41,,DOUB,C5,C4,yes,N,41,,244293,6336,ATP
42,,SING,C6,N6,no,N,42,,244293,6336,ATP
43,,DOUB,C6,N1,yes,N,43,,244293,6336,ATP
44,,SING,N6,HN61,no,N,44,,244293,6336,ATP
45,,SING,N6,HN62,no,N,45,,244293,6336,ATP
46,,SING,N1,C2,yes,N,46,,244293,6336,ATP
47,,DOUB,C2,N3,yes,N,47,,244293,6336,ATP
48,,SING,C2,H2,no,N,48,,244293,6336,ATP
49,,SING,N3,C4,yes,N,49,,244293,6336,ATP
1,,SING,C1',C2',no,N,1,,244551,6348,RG1
2,,SING,C1',O1',no,N,2,,244551,6348,RG1
3,,SING,C1',O5',no,N,3,,244551,6348,RG1
4,,SING,C1',H1',no,N,4,,244551,6348,RG1
5,,SING,C2',C3',no,N,5,,244551,6348,RG1
6,,SING,C2',O2',no,N,6,,244551,6348,RG1
7,,SING,C2',H2',no,N,7,,244551,6348,RG1
8,,SING,C3',C4',no,N,8,,244551,6348,RG1
9,,SING,C3',O3',no,N,9,,244551,6348,RG1
10,,SING,C3',H3',no,N,10,,244551,6348,RG1
11,,SING,C4',C5',no,N,11,,244551,6348,RG1
12,,SING,C4',O4',no,N,12,,244551,6348,RG1
13,,SING,C4',H4',no,N,13,,244551,6348,RG1
14,,SING,C5',C6',no,N,14,,244551,6348,RG1
15,,SING,C5',O5',no,N,15,,244551,6348,RG1
16,,SING,C5',H5',no,N,16,,244551,6348,RG1
17,,SING,C6',O6',no,N,17,,244551,6348,RG1
18,,SING,C6',H6'1,no,N,18,,244551,6348,RG1
19,,SING,C6',H6'2,no,N,19,,244551,6348,RG1
20,,SING,O1',C1,no,N,20,,244551,6348,RG1
21,,SING,O2',HO2',no,N,21,,244551,6348,RG1
22,,SING,O3',HO3',no,N,22,,244551,6348,RG1
23,,SING,O4',HO4',no,N,23,,244551,6348,RG1
24,,SING,O6',HO6',no,N,24,,244551,6348,RG1
25,,SING,C1,CM1,no,N,25,,244551,6348,RG1
26,,SING,C1,CM2,no,N,26,,244551,6348,RG1
27,,SING,C1,C2,no,N,27,,244551,6348,RG1
28,,SING,CM1,HM11,no,N,28,,244551,6348,RG1
29,,SING,CM1,HM12,no,N,29,,244551,6348,RG1
30,,SING,CM1,HM13,no,N,30,,244551,6348,RG1
31,,SING,CM2,HM21,no,N,31,,244551,6348,RG1
32,,SING,CM2,HM22,no,N,32,,244551,6348,RG1
33,,SING,CM2,HM23,no,N,33,,244551,6348,RG1
34,,SING,C2,C3,no,N,34,,244551,6348,RG1
35,,SING,C2,H21A,no,N,35,,244551,6348,RG1
36,,SING,C2,H22,no,N,36,,244551,6348,RG1
37,,SING,C3,C4,no,N,37,,244551,6348,RG1
38,,SING,C3,H31,no,N,38,,244551,6348,RG1
39,,SING,C3,H32,no,N,39,,244551,6348,RG1
40,,SING,C4,C5,no,N,40,,244551,6348,RG1
41,,SING,C4,H41,no,N,41,,244551,6348,RG1
42,,SING,C4,H42,no,N,42,,244551,6348,RG1
43,,SING,C5,CM3,no,N,43,,244551,6348,RG1
44,,DOUB,C5,C6,no,E,44,,244551,6348,RG1
45,,SING,CM3,HM31,no,N,45,,244551,6348,RG1
46,,SING,CM3,HM32,no,N,46,,244551,6348,RG1
47,,SING,CM3,HM33,no,N,47,,244551,6348,RG1
48,,SING,C6,C7,no,N,48,,244551,6348,RG1
49,,SING,C6,H6,no,N,49,,244551,6348,RG1
50,,DOUB,C7,C8,no,E,50,,244551,6348,RG1
51,,SING,C7,H7,no,N,51,,244551,6348,RG1
52,,SING,C8,C9,no,N,52,,244551,6348,RG1
53,,SING,C8,H8,no,N,53,,244551,6348,RG1
54,,SING,C9,CM4,no,N,54,,244551,6348,RG1
55,,DOUB,C9,C10,no,E,55,,244551,6348,RG1
56,,SING,CM4,HM41,no,N,56,,244551,6348,RG1
57,,SING,CM4,HM42,no,N,57,,244551,6348,RG1
58,,SING,CM4,HM43,no,N,58,,244551,6348,RG1
59,,SING,C10,C11,no,N,59,,244551,6348,RG1
60,,SING,C10,H10,no,N,60,,244551,6348,RG1
61,,DOUB,C11,C12,no,E,61,,244551,6348,RG1
62,,SING,C11,H11,no,N,62,,244551,6348,RG1
63,,SING,C12,C13,no,N,63,,244551,6348,RG1
64,,SING,C12,H12,no,N,64,,244551,6348,RG1
65,,SING,C13,CM5,no,N,65,,244551,6348,RG1
66,,DOUB,C13,C14,no,E,66,,244551,6348,RG1
67,,SING,CM5,HM51,no,N,67,,244551,6348,RG1
68,,SING,CM5,HM52,no,N,68,,244551,6348,RG1
69,,SING,CM5,HM53,no,N,69,,244551,6348,RG1
70,,SING,C14,C15,no,N,70,,244551,6348,RG1
71,,SING,C14,H14,no,N,71,,244551,6348,RG1
72,,DOUB,C15,C16,no,E,72,,244551,6348,RG1
73,,SING,C15,H15,no,N,73,,244551,6348,RG1
74,,SING,C16,C17,no,N,74,,244551,6348,RG1
75,,SING,C16,H16,no,N,75,,244551,6348,RG1
76,,DOUB,C17,C18,no,E,76,,244551,6348,RG1
77,,SING,C17,H17,no,N,77,,244551,6348,RG1
78,,SING,C18,CM6,no,N,78,,244551,6348,RG1
79,,SING,C18,C19,no,N,79,,244551,6348,RG1
80,,SING,CM6,HM61,no,N,80,,244551,6348,RG1
81,,SING,CM6,HM62,no,N,81,,244551,6348,RG1
82,,SING,CM6,HM63,no,N,82,,244551,6348,RG1
83,,DOUB,C19,C20,no,E,83,,244551,6348,RG1
84,,SING,C19,H19,no,N,84,,244551,6348,RG1
85,,SING,C20,C21,no,N,85,,244551,6348,RG1
86,,SING,C20,H20,no,N,86,,244551,6348,RG1
87,,DOUB,C21,C22,no,E,87,,244551,6348,RG1
88,,SING,C21,H21,no,N,88,,244551,6348,RG1
89,,SING,C22,CM7,no,N,89,,244551,6348,RG1
90,,SING,C22,C23,no,N,90,,244551,6348,RG1
91,,SING,CM7,HM71,no,N,91,,244551,6348,RG1
92,,SING,CM7,HM72,no,N,92,,244551,6348,RG1
93,,SING,CM7,HM73,no,N,93,,244551,6348,RG1
94,,DOUB,C23,C24,no,E,94,,244551,6348,RG1
95,,SING,C23,H23,no,N,95,,244551,6348,RG1
96,,SING,C24,C25,no,N,96,,244551,6348,RG1
97,,SING,C24,H24,no,N,97,,244551,6348,RG1
98,,DOUB,C25,C26,no,E,98,,244551,6348,RG1
99,,SING,C25,H25,no,N,99,,244551,6348,RG1
100,,SING,C26,CM8,no,N,100,,244551,6348,RG1
101,,SING,C26,C27,no,N,101,,244551,6348,RG1
102,,SING,CM8,HM81,no,N,102,,244551,6348,RG1
103,,SING,CM8,HM82,no,N,103,,244551,6348,RG1
104,,SING,CM8,HM83,no,N,104,,244551,6348,RG1
105,,DOUB,C27,C28,no,E,105,,244551,6348,RG1
106,,SING,C27,H27,no,N,106,,244551,6348,RG1
107,,SING,C28,C29,no,N,107,,244551,6348,RG1
108,,SING,C28,H28,no,N,108,,244551,6348,RG1
109,,DOUB,C29,C30,no,N,109,,244551,6348,RG1
110,,SING,C29,H29,no,N,110,,244551,6348,RG1
111,,SING,C30,CM9,no,N,111,,244551,6348,RG1
112,,SING,C30,CM0,no,N,112,,244551,6348,RG1
113,,SING,CM9,HM91,no,N,113,,244551,6348,RG1
114,,SING,CM9,HM92,no,N,114,,244551,6348,RG1
115,,SING,CM9,HM93,no,N,115,,244551,6348,RG1
116,,SING,CM0,HM01,no,N,116,,244551,6348,RG1
117,,SING,CM0,HM02,no,N,117,,244551,6348,RG1
118,,SING,CM0,HM03,no,N,118,,244551,6348,RG1
1,,SING,MG,NA,no,N,1,,244552,6348,BCL
2,,SING,MG,NB,no,N,2,,244552,6348,BCL
3,,SING,MG,NC,no,N,3,,244552,6348,BCL
4,,SING,MG,ND,no,N,4,,244552,6348,BCL
5,,SING,CHA,C1A,no,N,5,,244552,6348,BCL
6,,DOUB,CHA,C4D,no,N,6,,244552,6348,BCL
7,,SING,CHA,CBD,no,N,7,,244552,6348,BCL
8,,DOUB,CHB,C4A,no,N,8,,244552,6348,BCL
9,,SING,CHB,C1B,no,N,9,,244552,6348,BCL
10,,SING,CHB,HHB,no,N,10,,244552,6348,BCL
11,,SING,CHC,C4B,no,N,11,,244552,6348,BCL
12,,DOUB,CHC,C1C,no,N,12,,244552,6348,BCL
13,,SING,CHC,HHC,no,N,13,,244552,6348,BCL
14,,SING,CHD,C4C,no,N,14,,244552,6348,BCL
15,,DOUB,CHD,C1D,no,N,15,,244552,6348,BCL
16,,SING,CHD,HHD,no,N,16,,244552,6348,BCL
17,,DOUB,NA,C1A,no,N,17,,244552,6348,BCL
18,,SING,NA,C4A,no,N,18,,244552,6348,BCL
19,,SING,C1A,C2A,no,N,19,,244552,6348,BCL
20,,SING,C2A,C3A,no,N,20,,244552,6348,BCL
21,,SING,C2A,CAA,no,N,21,,244552,6348,BCL
22,,SING,C2A,H2A,no,N,22,,244552,6348,BCL
23,,SING,C3A,C4A,no,N,23,,244552,6348,BCL
24,,SING,C3A,CMA,no,N,24,,244552,6348,BCL
25,,SING,C3A,H3A,no,N,25,,244552,6348,BCL
26,,SING,CMA,HMA1,no,N,26,,244552,6348,BCL
27,,SING,CMA,HMA2,no,N,27,,244552,6348,BCL
28,,SING,CMA,HMA3,no,N,28,,244552,6348,BCL
29,,SING,CAA,CBA,no,N,29,,244552,6348,BCL
30,,SING,CAA,HAA1,no,N,30,,244552,6348,BCL
31,,SING,CAA,HAA2,no,N,31,,244552,6348,BCL
32,,SING,CBA,CGA,no,N,32,,244552,6348,BCL
33,,SING,CBA,HBA1,no,N,33,,244552,6348,BCL
34,,SING,CBA,HBA2,no,N,34,,244552,6348,BCL
35,,DOUB,CGA,O1A,no,N,35,,244552,6348,BCL
36,,SING,CGA,O2A,no,N,36,,244552,6348,BCL
37,,SING,O2A,C1,no,N,37,,244552,6348,BCL
38,,SING,NB,C1B,yes,N,38,,244552,6348,BCL
39,,SING,NB,C4B,yes,N,39,,244552,6348,BCL
40,,DOUB,C1B,C2B,yes,N,40,,244552,6348,BCL
41,,SING,C2B,C3B,yes,N,41,,244552,6348,BCL
42,,SING,C2B,CMB,no,N,42,,244552,6348,BCL
43,,DOUB,C3B,C4B,yes,N,43,,244552,6348,BCL
44,,SING,C3B,CAB,no,N,44,,244552,6348,BCL
45,,SING,CMB,HMB1,no,N,45,,244552,6348,BCL
46,,SING,CMB,HMB2,no,N,46,,244552,6348,BCL
47,,SING,CMB,HMB3,no,N,47,,244552,6348,BCL
48,,DOUB,CAB,OBB,no,N,48,,244552,6348,BCL
49,,SING,CAB,CBB,no,N,49,,244552,6348,BCL
50,,SING,CBB,HBB1,no,N,50,,244552,6348,BCL
51,,SING,CBB,HBB2,no,N,51,,244552,6348,BCL
52,,SING,CBB,HBB3,no,N,52,,244552,6348,BCL
53,,SING,NC,C1C,no,N,53,,244552,6348,BCL
54,,DOUB,NC,C4C,no,N,54,,244552,6348,BCL
55,,SING,C1C,C2C,no,N,55,,244552,6348,BCL
56,,SING,C2C,C3C,no,N,56,,244552,6348,BCL
57,,SING,C2C,CMC,no,N,57,,244552,6348,BCL
58,,SING,C2C,H2C,no,N,58,,244552,6348,BCL
59,,SING,C3C,C4C,no,N,59,,244552,6348,BCL
60,,SING,C3C,CAC,no,N,60,,244552,6348,BCL
61,,SING,C3C,H3C,no,N,61,,244552,6348,BCL
62,,SING,CMC,HMC1,no,N,62,,244552,6348,BCL
63,,SING,CMC,HMC2,no,N,63,,244552,6348,BCL
64,,SING,CMC,HMC3,no,N,64,,244552,6348,BCL
65,,SING,CAC,CBC,no,N,65,,244552,6348,BCL
66,,SING,CAC,HAC1,no,N,66,,244552,6348,BCL
67,,SING,CAC,HAC2,no,N,67,,244552,6348,BCL
68,,SING,CBC,HBC1,no,N,68,,244552,6348,BCL
69,,SING,CBC,HBC2,no,N,69,,244552,6348,BCL
70,,SING,CBC,HBC3,no,N,70,,244552,6348,BCL
71,,SING,ND,C1D,yes,N,71,,244552,6348,BCL
72,,SING,ND,C4D,yes,N,72,,244552,6348,BCL
73,,SING,C1D,C2D,yes,N,73,,244552,6348,BCL
74,,DOUB,C2D,C3D,yes,N,74,,244552,6348,BCL
75,,SING,C2D,CMD,no,N,75,,244552,6348,BCL
76,,SING,C3D,C4D,yes,N,76,,244552,6348,BCL
77,,SING,C3D,CAD,no,N,77,,244552,6348,BCL
78,,SING,CMD,HMD1,no,N,78,,244552,6348,BCL
79,,SING,CMD,HMD2,no,N,79,,244552,6348,BCL
80,,SING,CMD,HMD3,no,N,80,,244552,6348,BCL
81,,DOUB,CAD,OBD,no,N,81,,244552,6348,BCL
82,,SING,CAD,CBD,no,N,82,,244552,6348,BCL
83,,SING,CBD,CGD,no,N,83,,244552,6348,BCL
84,,SING,CBD,HBD,no,N,84,,244552,6348,BCL
85,,DOUB,CGD,O1D,no,N,85,,244552,6348,BCL
86,,SING,CGD,O2D,no,N,86,,244552,6348,BCL
87,,SING,O2D,CED,no,N,87,,244552,6348,BCL
88,,SING,CED,HED1,no,N,88,,244552,6348,BCL
89,,SING,CED,HED2,no,N,89,,244552,6348,BCL
90,,SING,CED,HED3,no,N,90,,244552,6348,BCL
91,,SING,C1,C2,no,N,91,,244552,6348,BCL
92,,SING,C1,H11,no,N,92,,244552,6348,BCL
93,,SING,C1,H12,no,N,93,,244552,6348,BCL
94,,DOUB,C2,C3,no,E,94,,244552,6348,BCL
95,,SING,C2,H2,no,N,95,,244552,6348,BCL
96,,SING,C3,C4,no,N,96,,244552,6348,BCL
97,,SING,C3,C5,no,N,97,,244552,6348,BCL
98,,SING,C4,H41,no,N,98,,244552,6348,BCL
99,,SING,C4,H42,no,N,99,,244552,6348,BCL
100,,SING,C4,H43,no,N,100,,244552,6348,BCL
101,,SING,C5,C6,no,N,101,,244552,6348,BCL
102,,SING,C5,H51,no,N,102,,244552,6348,BCL
103,,SING,C5,H52,no,N,103,,244552,6348,BCL
104,,SING,C6,C7,no,N,104,,244552,6348,BCL
105,,SING,C6,H61,no,N,105,,244552,6348,BCL
106,,SING,C6,H62,no,N,106,,244552,6348,BCL
107,,SING,C7,C8,no,N,107,,244552,6348,BCL
108,,SING,C7,H71,no,N,108,,244552,6348,BCL
109,,SING,C7,H72,no,N,109,,244552,6348,BCL
110,,SING,C8,C9,no,N,110,,244552,6348,BCL
111,,SING,C8,C10,no,N,111,,244552,6348,BCL
112,,SING,C8,H8,no,N,112,,244552,6348,BCL
113,,SING,C9,H91,no,N,113,,244552,6348,BCL
114,,SING,C9,H92,no,N,114,,244552,6348,BCL
115,,SING,C9,H93,no,N,115,,244552,6348,BCL
116,,SING,C10,C11,no,N,116,,244552,6348,BCL
117,,SING,C10,H101,no,N,117,,244552,6348,BCL
118,,SING,C10,H102,no,N,118,,244552,6348,BCL
119,,SING,C11,C12,no,N,119,,244552,6348,BCL
120,,SING,C11,H111,no,N,120,,244552,6348,BCL
121,,SING,C11,H112,no,N,121,,244552,6348,BCL
122,,SING,C12,C13,no,N,122,,244552,6348,BCL
123,,SING,C12,H121,no,N,123,,244552,6348,BCL
124,,SING,C12,H122,no,N,124,,244552,6348,BCL
125,,SING,C13,C14,no,N,125,,244552,6348,BCL
126,,SING,C13,C15,no,N,126,,244552,6348,BCL
127,,SING,C13,H13,no,N,127,,244552,6348,BCL
128,,SING,C14,H141,no,N,128,,244552,6348,BCL
129,,SING,C14,H142,no,N,129,,244552,6348,BCL
130,,SING,C14,H143,no,N,130,,244552,6348,BCL
131,,SING,C15,C16,no,N,131,,244552,6348,BCL
132,,SING,C15,H151,no,N,132,,244552,6348,BCL
133,,SING,C15,H152,no,N,133,,244552,6348,BCL
134,,SING,C16,C17,no,N,134,,244552,6348,BCL
135,,SING,C16,H161,no,N,135,,244552,6348,BCL
136,,SING,C16,H162,no,N,136,,244552,6348,BCL
137,,SING,C17,C18,no,N,137,,244552,6348,BCL
138,,SING,C17,H171,no,N,138,,244552,6348,BCL
139,,SING,C17,H172,no,N,139,,244552,6348,BCL
140,,SING,C18,C19,no,N,140,,244552,6348,BCL
141,,SING,C18,C20,no,N,141,,244552,6348,BCL
142,,SING,C18,H18,no,N,142,,244552,6348,BCL
143,,SING,C19,H191,no,N,143,,244552,6348,BCL
144,,SING,C19,H192,no,N,144,,244552,6348,BCL
145,,SING,C19,H193,no,N,145,,244552,6348,BCL
146,,SING,C20,H201,no,N,146,,244552,6348,BCL
147,,SING,C20,H202,no,N,147,,244552,6348,BCL
148,,SING,C20,H203,no,N,148,,244552,6348,BCL
1,,SING,N,CA,no,N,1,,244628,6352,DHA
2,,SING,N,H,no,N,2,,244628,6352,DHA
3,,SING,N,H2,no,N,3,,244628,6352,DHA
4,,DOUB,CA,CB,no,N,4,,244628,6352,DHA
5,,SING,CA,C,no,N,5,,244628,6352,DHA
6,,SING,CB,HB1,no,N,6,,244628,6352,DHA
7,,SING,CB,HB2,no,N,7,,244628,6352,DHA
8,,DOUB,C,O,no,N,8,,244628,6352,DHA
9,,SING,C,OXT,no,N,9,,244628,6352,DHA
10,,SING,OXT,HXT,no,N,10,,244628,6352,DHA
1,,SING,N,CA,no,N,1,,244629,6352,DAL
2,,SING,N,H,no,N,2,,244629,6352,DAL
3,,SING,N,H2,no,N,3,,244629,6352,DAL
4,,SING,CA,CB,no,N,4,,244629,6352,DAL
5,,SING,CA,C,no,N,5,,244629,6352,DAL
6,,SING,CA,HA,no,N,6,,244629,6352,DAL
7,,SING,CB,HB1,no,N,7,,244629,6352,DAL
8,,SING,CB,HB2,no,N,8,,244629,6352,DAL
9,,SING,CB,HB3,no,N,9,,244629,6352,DAL
10,,DOUB,C,O,no,N,10,,244629,6352,DAL
11,,SING,C,OXT,no,N,11,,244629,6352,DAL
12,,SING,OXT,HXT,no,N,12,,244629,6352,DAL
1,,SING,C1,C2,yes,N,1,,244630,6352,HOP
2,,DOUB,C1,C6,yes,N,2,,244630,6352,HOP
3,,SING,C1,H1,no,N,3,,244630,6352,HOP
4,,DOUB,C2,C3,yes,N,4,,244630,6352,HOP
5,,SING,C2,H2,no,N,5,,244630,6352,HOP
6,,SING,C6,C5,yes,N,6,,244630,6352,HOP
7,,SING,C6,H6,no,N,7,,244630,6352,HOP
8,,DOUB,C5,C4,yes,N,8,,244630,6352,HOP
9,,SING,C5,H5,no,N,9,,244630,6352,HOP
10,,SING,C4,C3,yes,N,10,,244630,6352,HOP
11,,SING,C4,C7,no,N,11,,244630,6352,HOP
12,,SING,C3,H3,no,N,12,,244630,6352,HOP
13,,SING,C7,C12,no,N,13,,244630,6352,HOP
14,,SING,C7,C8,no,N,14,,244630,6352,HOP
15,,SING,C7,H7,no,N,15,,244630,6352,HOP
16,,SING,C12,C11,no,N,16,,244630,6352,HOP
17,,SING,C12,H121,no,N,17,,244630,6352,HOP
18,,SING,C12,H122,no,N,18,,244630,6352,HOP
19,,SING,C11,C10,no,N,19,,244630,6352,HOP
20,,SING,C11,O19,no,N,20,,244630,6352,HOP
21,,SING,C11,H11,no,N,21,,244630,6352,HOP
22,,SING,C10,C9,no,N,22,,244630,6352,HOP
23,,SING,C10,C13,no,N,23,,244630,6352,HOP
24,,SING,C10,H10,no,N,24,,244630,6352,HOP
25,,SING,C9,C8,no,N,25,,244630,6352,HOP
26,,SING,C9,H91,no,N,26,,244630,6352,HOP
27,,SING,C9,H92,no,N,27,,244630,6352,HOP
28,,SING,C8,H81,no,N,28,,244630,6352,HOP
29,,SING,C8,H82,no,N,29,,244630,6352,HOP
30,,DOUB,C13,C14,yes,N,30,,244630,6352,HOP
31,,SING,C13,C18,yes,N,31,,244630,6352,HOP
32,,SING,C14,C15,yes,N,32,,244630,6352,HOP
33,,SING,C14,H14,no,N,33,,244630,6352,HOP
34,,DOUB,C15,C16,yes,N,34,,244630,6352,HOP
35,,SING,C15,H15,no,N,35,,244630,6352,HOP
36,,SING,C16,C17,yes,N,36,,244630,6352,HOP
37,,SING,C16,C20,no,N,37,,244630,6352,HOP
38,,DOUB,C17,C18,yes,N,38,,244630,6352,HOP
39,,SING,C17,H17,no,N,39,,244630,6352,HOP
40,,SING,C18,H18,no,N,40,,244630,6352,HOP
41,,SING,O19,HO9,no,N,41,,244630,6352,HOP
42,,DOUB,C20,O21,no,N,42,,244630,6352,HOP
43,,SING,C20,N22,no,N,43,,244630,6352,HOP
44,,SING,N22,C23,no,N,44,,244630,6352,HOP
45,,SING,N22,HN2,no,N,45,,244630,6352,HOP
46,,SING,C23,C24,no,N,46,,244630,6352,HOP
47,,SING,C23,H231,no,N,47,,244630,6352,HOP
48,,SING,C23,H232,no,N,48,,244630,6352,HOP
49,,SING,C24,C25,no,N,49,,244630,6352,HOP
50,,SING,C24,H241,no,N,50,,244630,6352,HOP
51,,SING,C24,H242,no,N,51,,244630,6352,HOP
52,,SING,C25,C26,no,N,52,,244630,6352,HOP
53,,SING,C25,H251,no,N,53,,244630,6352,HOP
54,,SING,C25,H252,no,N,54,,244630,6352,HOP
55,,DOUB,C26,O27,no,N,55,,244630,6352,HOP
56,,SING,C26,O28,no,N,56,,244630,6352,HOP
57,,SING,O28,HO8,no,N,57,,244630,6352,HOP
1,,SING,N,CA,no,N,1,,244631,6352,AA4
2,,SING,N,H,no,N,2,,244631,6352,AA4
3,,SING,N,H2,no,N,3,,244631,6352,AA4
4,,SING,CA,C,no,N,4,,244631,6352,AA4
5,,SING,CA,CB,no,N,5,,244631,6352,AA4
6,,SING,CA,HA,no,N,6,,244631,6352,AA4
7,,DOUB,C,O,no,N,7,,244631,6352,AA4
8,,SING,C,OXT,no,N,8,,244631,6352,AA4
9,,SING,CB,CG,no,N,9,,244631,6352,AA4
10,,SING,CB,HB2,no,N,10,,244631,6352,AA4
11,,SING,CB,HB3,no,N,11,,244631,6352,AA4
12,,SING,CG,CD,no,N,12,,244631,6352,AA4
13,,SING,CG,HG2,no,N,13,,244631,6352,AA4
14,,SING,CG,HG3,no,N,14,,244631,6352,AA4
15,,SING,CD,OE,no,N,15,,244631,6352,AA4
16,,SING,CD,HD2,no,N,16,,244631,6352,AA4
17,,SING,CD,HD3,no,N,17,,244631,6352,AA4
18,,SING,OE,HE,no,N,18,,244631,6352,AA4
19,,SING,OXT,HXT,no,N,19,,244631,6352,AA4
1,,SING,N,CA,no,N,1,,244632,6352,ABA
2,,SING,N,H,no,N,2,,244632,6352,ABA
3,,SING,N,HN2,no,N,3,,244632,6352,ABA
4,,SING,CA,C,no,N,4,,244632,6352,ABA
5,,SING,CA,CB,no,N,5,,244632,6352,ABA
6,,SING,CA,HA,no,N,6,,244632,6352,ABA
7,,DOUB,C,O,no,N,7,,244632,6352,ABA
8,,SING,C,OXT,no,N,8,,244632,6352,ABA
9,,SING,CB,CG,no,N,9,,244632,6352,ABA
10,,SING,CB,HB3,no,N,10,,244632,6352,ABA
11,,SING,CB,HB2,no,N,11,,244632,6352,ABA
12,,SING,CG,HG1,no,N,12,,244632,6352,ABA
13,,SING,CG,HG3,no,N,13,,244632,6352,ABA
14,,SING,CG,HG2,no,N,14,,244632,6352,ABA
15,,SING,OXT,HXT,no,N,15,,244632,6352,ABA
1,,SING,N,HN1,no,N,1,,244817,6360,NH2
2,,SING,N,HN2,no,N,2,,244817,6360,NH2
1,,SING,C8,C7,no,N,1,,245223,6379,HTF
2,,SING,C8,H81,no,N,2,,245223,6379,HTF
3,,SING,C8,H82,no,N,3,,245223,6379,HTF
4,,SING,C8,H83,no,N,4,,245223,6379,HTF
5,,SING,C7,C6,no,N,5,,245223,6379,HTF
6,,SING,C7,H72,no,N,6,,245223,6379,HTF
7,,SING,C7,H73,no,N,7,,245223,6379,HTF
8,,SING,C6,C5,no,N,8,,245223,6379,HTF
9,,SING,C6,H62,no,N,9,,245223,6379,HTF
10,,SING,C6,H63,no,N,10,,245223,6379,HTF
11,,SING,C5,C4,no,N,11,,245223,6379,HTF
12,,SING,C5,H52,no,N,12,,245223,6379,HTF
13,,SING,C5,H53,no,N,13,,245223,6379,HTF
14,,SING,C4,C3,no,N,14,,245223,6379,HTF
15,,SING,C4,H42,no,N,15,,245223,6379,HTF
16,,SING,C4,H43,no,N,16,,245223,6379,HTF
17,,SING,C3,C2,no,N,17,,245223,6379,HTF
18,,SING,C3,H32,no,N,18,,245223,6379,HTF
19,,SING,C3,H33,no,N,19,,245223,6379,HTF
20,,SING,C2,C1,no,N,20,,245223,6379,HTF
21,,SING,C2,H22,no,N,21,,245223,6379,HTF
22,,SING,C2,H23,no,N,22,,245223,6379,HTF
23,,DOUB,C1,O1,no,N,23,,245223,6379,HTF
24,,SING,C1,N,no,N,24,,245223,6379,HTF
25,,SING,N,CA,no,N,25,,245223,6379,HTF
26,,SING,N,HN,no,N,26,,245223,6379,HTF
27,,SING,CA,C,no,N,27,,245223,6379,HTF
28,,SING,CA,CB,no,N,28,,245223,6379,HTF
29,,SING,CA,HA,no,N,29,,245223,6379,HTF
30,,DOUB,C,O,no,N,30,,245223,6379,HTF
31,,SING,C,OD,no,N,31,,245223,6379,HTF
32,,SING,OD,CG,no,N,32,,245223,6379,HTF
33,,SING,CG,CB,no,N,33,,245223,6379,HTF
34,,SING,CG,HG2,no,N,34,,245223,6379,HTF
35,,SING,CG,HG3,no,N,35,,245223,6379,HTF
36,,SING,CB,HB2,no,N,36,,245223,6379,HTF
37,,SING,CB,HB3,no,N,37,,245223,6379,HTF
1,,SING,CD1,CG,no,N,1,,245380,6388,NLW
2,,SING,CG,CD2,no,N,2,,245380,6388,NLW
3,,SING,CG,CB,no,N,3,,245380,6388,NLW
4,,SING,CB,CA,no,N,4,,245380,6388,NLW
5,,SING,N,CA,no,N,5,,245380,6388,NLW
6,,SING,CA,C,no,N,6,,245380,6388,NLW
7,,SING,C,NH2,no,N,7,,245380,6388,NLW
8,,DOUB,C,O,no,N,8,,245380,6388,NLW
9,,SING,CD2,H1,no,N,9,,245380,6388,NLW
10,,SING,CD2,H2,no,N,10,,245380,6388,NLW
11,,SING,CD2,H3,no,N,11,,245380,6388,NLW
12,,SING,CG,H4,no,N,12,,245380,6388,NLW
13,,SING,CD1,H5,no,N,13,,245380,6388,NLW
14,,SING,CD1,H6,no,N,14,,245380,6388,NLW
15,,SING,CD1,H7,no,N,15,,245380,6388,NLW
16,,SING,CB,H8,no,N,16,,245380,6388,NLW
17,,SING,CB,H9,no,N,17,,245380,6388,NLW
18,,SING,CA,H10,no,N,18,,245380,6388,NLW
19,,SING,N,H11,no,N,19,,245380,6388,NLW
20,,SING,N,H12,no,N,20,,245380,6388,NLW
21,,SING,NH2,H14,no,N,21,,245380,6388,NLW
22,,SING,NH2,H15,no,N,22,,245380,6388,NLW
1,,DOUB,C2,C1,yes,N,1,,245432,6391,DSV
2,,SING,C1,C6,yes,N,2,,245432,6391,DSV
3,,SING,C1,S21,no,N,3,,245432,6391,DSV
4,,SING,C3,C2,yes,N,4,,245432,6391,DSV
5,,SING,C2,H2,no,N,5,,245432,6391,DSV
6,,SING,S10,C3,yes,N,6,,245432,6391,DSV
7,,DOUB,C4,C3,yes,N,7,,245432,6391,DSV
8,,SING,C12,C4,yes,N,8,,245432,6391,DSV
9,,SING,C4,C5,yes,N,9,,245432,6391,DSV
10,,SING,H5,C5,no,N,10,,245432,6391,DSV
11,,DOUB,C5,C6,yes,N,11,,245432,6391,DSV
12,,SING,C6,H6,no,N,12,,245432,6391,DSV
13,,SING,C11,S10,yes,N,13,,245432,6391,DSV
14,,DOUB,CY1,C11,yes,N,14,,245432,6391,DSV
15,,SING,C11,C12,yes,N,15,,245432,6391,DSV
16,,DOUB,CY2,C12,yes,N,16,,245432,6391,DSV
17,,SING,CZ1,CY1,yes,N,17,,245432,6391,DSV
18,,SING,HY1,CY1,no,N,18,,245432,6391,DSV
19,,SING,HZ1,CZ1,no,N,19,,245432,6391,DSV
20,,DOUB,CZ1,CZ2,yes,N,20,,245432,6391,DSV
21,,SING,HZ2,CZ2,no,N,21,,245432,6391,DSV
22,,SING,CZ2,CY2,yes,N,22,,245432,6391,DSV
23,,SING,CY2,HY2,no,N,23,,245432,6391,DSV
24,,SING,N24,S21,no,N,24,,245432,6391,DSV
25,,DOUB,O22,S21,no,N,25,,245432,6391,DSV
26,,DOUB,S21,O23,no,N,26,,245432,6391,DSV
27,,SING,HN24,N24,no,N,27,,245432,6391,DSV
28,,SING,N24,C10,no,N,28,,245432,6391,DSV
29,,SING,C37,C10,no,N,29,,245432,6391,DSV
30,,SING,C10,CBC,no,N,30,,245432,6391,DSV
31,,SING,C10,H10,no,N,31,,245432,6391,DSV
32,,SING,CC2,CBC,no,N,32,,245432,6391,DSV
33,,SING,CBC,HBC,no,N,33,,245432,6391,DSV
34,,SING,CBC,CC1,no,N,34,,245432,6391,DSV
35,,SING,HC1,CC1,no,N,35,,245432,6391,DSV
36,,SING,CC1,HC1A,no,N,36,,245432,6391,DSV
37,,SING,CC1,HC1B,no,N,37,,245432,6391,DSV
38,,SING,HC2,CC2,no,N,38,,245432,6391,DSV
39,,SING,HC2B,CC2,no,N,39,,245432,6391,DSV
40,,SING,HC2A,CC2,no,N,40,,245432,6391,DSV
41,,DOUB,O39,C37,no,N,41,,245432,6391,DSV
42,,SING,O40,C37,no,N,42,,245432,6391,DSV
43,,SING,O40,HO40,no,N,43,,245432,6391,DSV
1,,SING,N,HN1,no,N,1,,245874,6411,NH2
2,,SING,N,HN2,no,N,2,,245874,6411,NH2
1,,SING,N,HN1,no,N,1,,245932,6414,NH2
2,,SING,N,HN2,no,N,2,,245932,6414,NH2
1,,SING,N1,C2,no,N,1,,246029,6418,CZH
2,,DOUB,N1,C9,no,N,2,,246029,6418,CZH
3,,SING,C2,C3,no,N,3,,246029,6418,CZH
4,,SING,C2,C10,no,N,4,,246029,6418,CZH
5,,SING,C2,O33,no,N,5,,246029,6418,CZH
6,,SING,C3,N4,no,N,6,,246029,6418,CZH
7,,DOUB,C3,O18,no,N,7,,246029,6418,CZH
8,,SING,N4,C5,no,N,8,,246029,6418,CZH
9,,SING,N4,C9,no,N,9,,246029,6418,CZH
10,,DOUB,C5,C6,no,N,10,,246029,6418,CZH
11,,SING,C5,H5,no,N,11,,246029,6418,CZH
12,,SING,C6,N7,no,N,12,,246029,6418,CZH
13,,SING,C6,C19,no,N,13,,246029,6418,CZH
14,,DOUB,N7,C8,no,N,14,,246029,6418,CZH
15,,SING,C8,C9,no,N,15,,246029,6418,CZH
16,,SING,C8,C26,no,N,16,,246029,6418,CZH
17,,SING,C10,C11,no,N,17,,246029,6418,CZH
18,,SING,C10,H101,no,N,18,,246029,6418,CZH
19,,SING,C10,H102,no,N,19,,246029,6418,CZH
20,,DOUB,C11,C12,yes,N,20,,246029,6418,CZH
21,,SING,C11,C16,yes,N,21,,246029,6418,CZH
22,,SING,C12,C13,yes,N,22,,246029,6418,CZH
23,,SING,C12,H12,no,N,23,,246029,6418,CZH
24,,DOUB,C13,C14,yes,N,24,,246029,6418,CZH
25,,SING,C13,H13,no,N,25,,246029,6418,CZH
26,,SING,C14,C15,yes,N,26,,246029,6418,CZH
27,,SING,C14,O17,no,N,27,,246029,6418,CZH
28,,DOUB,C15,C16,yes,N,28,,246029,6418,CZH
29,,SING,C15,H15,no,N,29,,246029,6418,CZH
30,,SING,C16,H16,no,N,30,,246029,6418,CZH
31,,SING,O17,H17,no,N,31,,246029,6418,CZH
32,,DOUB,C19,C20,yes,N,32,,246029,6418,CZH
33,,SING,C19,C24,yes,N,33,,246029,6418,CZH
34,,SING,C20,C21,yes,N,34,,246029,6418,CZH
35,,SING,C20,H20,no,N,35,,246029,6418,CZH
36,,DOUB,C21,C22,yes,N,36,,246029,6418,CZH
37,,SING,C21,H21,no,N,37,,246029,6418,CZH
38,,SING,C22,C23,yes,N,38,,246029,6418,CZH
39,,SING,C22,O25,no,N,39,,246029,6418,CZH
40,,DOUB,C23,C24,yes,N,40,,246029,6418,CZH
41,,SING,C23,H23,no,N,41,,246029,6418,CZH
42,,SING,C24,H24,no,N,42,,246029,6418,CZH
43,,SING,O25,H25,no,N,43,,246029,6418,CZH
44,,SING,C26,C27,no,N,44,,246029,6418,CZH
45,,SING,C26,H261,no,N,45,,246029,6418,CZH
46,,SING,C26,H262,no,N,46,,246029,6418,CZH
47,,DOUB,C27,C28,yes,N,47,,246029,6418,CZH
48,,SING,C27,C32,yes,N,48,,246029,6418,CZH
49,,SING,C28,C29,yes,N,49,,246029,6418,CZH
50,,SING,C28,H28,no,N,50,,246029,6418,CZH
51,,DOUB,C29,C30,yes,N,51,,246029,6418,CZH
52,,SING,C29,H29,no,N,52,,246029,6418,CZH
53,,SING,C30,C31,yes,N,53,,246029,6418,CZH
54,,SING,C30,H30,no,N,54,,246029,6418,CZH
55,,DOUB,C31,C32,yes,N,55,,246029,6418,CZH
56,,SING,C31,H31,no,N,56,,246029,6418,CZH
57,,SING,C32,H32,no,N,57,,246029,6418,CZH
58,,SING,O33,O34,no,N,58,,246029,6418,CZH
59,,SING,O34,H34,no,N,59,,246029,6418,CZH
1,,DOUB,C1,O1,no,N,1,,246076,6420,DKA
2,,SING,C1,C2,no,N,2,,246076,6420,DKA
3,,SING,C1,O2,no,N,3,,246076,6420,DKA
4,,SING,C2,C3,no,N,4,,246076,6420,DKA
5,,SING,C2,H21,no,N,5,,246076,6420,DKA
6,,SING,C2,H22,no,N,6,,246076,6420,DKA
7,,SING,C3,C4,no,N,7,,246076,6420,DKA
8,,SING,C3,H31,no,N,8,,246076,6420,DKA
9,,SING,C3,H32,no,N,9,,246076,6420,DKA
10,,SING,C4,C5,no,N,10,,246076,6420,DKA
11,,SING,C4,H41,no,N,11,,246076,6420,DKA
12,,SING,C4,H42,no,N,12,,246076,6420,DKA
13,,SING,C5,C6,no,N,13,,246076,6420,DKA
14,,SING,C5,H51,no,N,14,,246076,6420,DKA
15,,SING,C5,H52,no,N,15,,246076,6420,DKA
16,,SING,C6,C7,no,N,16,,246076,6420,DKA
17,,SING,C6,H61,no,N,17,,246076,6420,DKA
18,,SING,C6,H62,no,N,18,,246076,6420,DKA
19,,SING,C7,C8,no,N,19,,246076,6420,DKA
20,,SING,C7,H71,no,N,20,,246076,6420,DKA
21,,SING,C7,H72,no,N,21,,246076,6420,DKA
22,,SING,C8,C9,no,N,22,,246076,6420,DKA
23,,SING,C8,H81,no,N,23,,246076,6420,DKA
24,,SING,C8,H82,no,N,24,,246076,6420,DKA
25,,SING,C9,C10,no,N,25,,246076,6420,DKA
26,,SING,C9,H91,no,N,26,,246076,6420,DKA
27,,SING,C9,H92,no,N,27,,246076,6420,DKA
28,,SING,C10,H101,no,N,28,,246076,6420,DKA
29,,SING,C10,H102,no,N,29,,246076,6420,DKA
30,,SING,C10,H103,no,N,30,,246076,6420,DKA
31,,SING,O2,HO2,no,N,31,,246076,6420,DKA
1,,SING,N,CA,no,N,1,,246077,6420,ORN
2,,SING,N,H,no,N,2,,246077,6420,ORN
3,,SING,N,H2,no,N,3,,246077,6420,ORN
4,,SING,CA,CB,no,N,4,,246077,6420,ORN
5,,SING,CA,C,no,N,5,,246077,6420,ORN
6,,SING,CA,HA,no,N,6,,246077,6420,ORN
7,,SING,CB,CG,no,N,7,,246077,6420,ORN
8,,SING,CB,HB2,no,N,8,,246077,6420,ORN
9,,SING,CB,HB3,no,N,9,,246077,6420,ORN
10,,SING,CG,CD,no,N,10,,246077,6420,ORN
11,,SING,CG,HG2,no,N,11,,246077,6420,ORN
12,,SING,CG,HG3,no,N,12,,246077,6420,ORN
13,,SING,CD,NE,no,N,13,,246077,6420,ORN
14,,SING,CD,HD2,no,N,14,,246077,6420,ORN
15,,SING,CD,HD3,no,N,15,,246077,6420,ORN
16,,SING,NE,HE1,no,N,16,,246077,6420,ORN
17,,SING,NE,HE2,no,N,17,,246077,6420,ORN
18,,DOUB,C,O,no,N,18,,246077,6420,ORN
19,,SING,C,OXT,no,N,19,,246077,6420,ORN
20,,SING,OXT,HXT,no,N,20,,246077,6420,ORN
1,,SING,N,CA,no,N,1,,246078,6420,DAL
2,,SING,N,H,no,N,2,,246078,6420,DAL
3,,SING,N,H2,no,N,3,,246078,6420,DAL
4,,SING,CA,CB,no,N,4,,246078,6420,DAL
5,,SING,CA,C,no,N,5,,246078,6420,DAL
6,,SING,CA,HA,no,N,6,,246078,6420,DAL
7,,SING,CB,HB1,no,N,7,,246078,6420,DAL
8,,SING,CB,HB2,no,N,8,,246078,6420,DAL
9,,SING,CB,HB3,no,N,9,,246078,6420,DAL
10,,DOUB,C,O,no,N,10,,246078,6420,DAL
11,,SING,C,OXT,no,N,11,,246078,6420,DAL
12,,SING,OXT,HXT,no,N,12,,246078,6420,DAL
1,,SING,N,CA,no,N,1,,246079,6420,DSN
2,,SING,N,H,no,N,2,,246079,6420,DSN
3,,SING,N,H2,no,N,3,,246079,6420,DSN
4,,SING,CA,C,no,N,4,,246079,6420,DSN
5,,SING,CA,CB,no,N,5,,246079,6420,DSN
6,,SING,CA,HA,no,N,6,,246079,6420,DSN
7,,DOUB,C,O,no,N,7,,246079,6420,DSN
8,,SING,C,OXT,no,N,8,,246079,6420,DSN
9,,SING,OXT,HXT,no,N,9,,246079,6420,DSN
10,,SING,CB,OG,no,N,10,,246079,6420,DSN
11,,SING,CB,HB2,no,N,11,,246079,6420,DSN
12,,SING,CB,HB3,no,N,12,,246079,6420,DSN
13,,SING,OG,HG,no,N,13,,246079,6420,DSN
1,,SING,N,CA,no,N,1,,246080,6420,LME
2,,SING,N,H2,no,N,2,,246080,6420,LME
3,,SING,N,H,no,N,3,,246080,6420,LME
4,,SING,CA,CB,no,N,4,,246080,6420,LME
5,,SING,CA,C,no,N,5,,246080,6420,LME
6,,SING,CA,HA,no,N,6,,246080,6420,LME
7,,SING,CB,C1,no,N,7,,246080,6420,LME
8,,SING,CB,CG,no,N,8,,246080,6420,LME
9,,SING,CB,HB,no,N,9,,246080,6420,LME
10,,SING,C1,H11,no,N,10,,246080,6420,LME
11,,SING,C1,H12,no,N,11,,246080,6420,LME
12,,SING,C1,H13,no,N,12,,246080,6420,LME
13,,SING,CG,CD,no,N,13,,246080,6420,LME
14,,SING,CG,HG2,no,N,14,,246080,6420,LME
15,,SING,CG,HG3,no,N,15,,246080,6420,LME
16,,DOUB,CD,OE1,no,N,16,,246080,6420,LME
17,,SING,CD,OE2,no,N,17,,246080,6420,LME
18,,SING,OE2,HE2,no,N,18,,246080,6420,LME
19,,DOUB,C,O,no,N,19,,246080,6420,LME
20,,SING,C,OXT,no,N,20,,246080,6420,LME
21,,SING,OXT,HXT,no,N,21,,246080,6420,LME
1,,SING,CA,C,no,N,1,,246081,6420,KYN
2,,DOUB,O,C,no,N,2,,246081,6420,KYN
3,,SING,C,OXT,no,N,3,,246081,6420,KYN
4,,SING,N,CA,no,N,4,,246081,6420,KYN
5,,SING,N,H,no,N,5,,246081,6420,KYN
6,,SING,N,H2,no,N,6,,246081,6420,KYN
7,,SING,OXT,HXT,no,N,7,,246081,6420,KYN
8,,SING,CD2,C1,no,N,8,,246081,6420,KYN
9,,DOUB,O2,C1,no,N,9,,246081,6420,KYN
10,,SING,C1,CB,no,N,10,,246081,6420,KYN
11,,SING,CG,N1,no,N,11,,246081,6420,KYN
12,,SING,N1,HN1,no,N,12,,246081,6420,KYN
13,,SING,N1,HN1A,no,N,13,,246081,6420,KYN
14,,SING,CB,CA,no,N,14,,246081,6420,KYN
15,,SING,CA,HA,no,N,15,,246081,6420,KYN
16,,SING,CB,HB,no,N,16,,246081,6420,KYN
17,,SING,CB,HBA,no,N,17,,246081,6420,KYN
18,,DOUB,CD1,CG,yes,N,18,,246081,6420,KYN
19,,SING,CD2,CG,yes,N,19,,246081,6420,KYN
20,,DOUB,CZ,CE1,yes,N,20,,246081,6420,KYN
21,,SING,CZ,CE2,yes,N,21,,246081,6420,KYN
22,,SING,CZ,HZ,no,N,22,,246081,6420,KYN
23,,SING,CE1,CD1,yes,N,23,,246081,6420,KYN
24,,SING,CD1,HD1,no,N,24,,246081,6420,KYN
25,,DOUB,CE2,CD2,yes,N,25,,246081,6420,KYN
26,,SING,CE1,HE1,no,N,26,,246081,6420,KYN
27,,SING,CE2,HE2,no,N,27,,246081,6420,KYN
1,,SING,N,CA,no,N,1,,246099,6421,DTR
2,,SING,N,H,no,N,2,,246099,6421,DTR
3,,SING,N,HN2,no,N,3,,246099,6421,DTR
4,,SING,CA,CB,no,N,4,,246099,6421,DTR
5,,SING,CA,C,no,N,5,,246099,6421,DTR
6,,SING,CA,HA,no,N,6,,246099,6421,DTR
7,,SING,CB,CG,no,N,7,,246099,6421,DTR
8,,SING,CB,HB2,no,N,8,,246099,6421,DTR
9,,SING,CB,HB3,no,N,9,,246099,6421,DTR
10,,DOUB,CG,CD1,yes,N,10,,246099,6421,DTR
11,,SING,CG,CD2,yes,N,11,,246099,6421,DTR
12,,SING,CD1,NE1,yes,N,12,,246099,6421,DTR
13,,SING,CD1,HD1,no,N,13,,246099,6421,DTR
14,,SING,NE1,CE2,yes,N,14,,246099,6421,DTR
15,,SING,NE1,HE1,no,N,15,,246099,6421,DTR
16,,DOUB,CE2,CZ2,yes,N,16,,246099,6421,DTR
17,,SING,CE2,CD2,yes,N,17,,246099,6421,DTR
18,,SING,CZ2,CH2,yes,N,18,,246099,6421,DTR
19,,SING,CZ2,HZ2,no,N,19,,246099,6421,DTR
20,,DOUB,CH2,CZ3,yes,N,20,,246099,6421,DTR
21,,SING,CH2,HH2,no,N,21,,246099,6421,DTR
22,,SING,CZ3,CE3,yes,N,22,,246099,6421,DTR
23,,SING,CZ3,HZ3,no,N,23,,246099,6421,DTR
24,,DOUB,CE3,CD2,yes,N,24,,246099,6421,DTR
25,,SING,CE3,HE3,no,N,25,,246099,6421,DTR
26,,DOUB,C,O,no,N,26,,246099,6421,DTR
27,,SING,C,OXT,no,N,27,,246099,6421,DTR
28,,SING,OXT,HXT,no,N,28,,246099,6421,DTR
1,,SING,N,CA,no,N,1,,246100,6421,IAM
2,,SING,N,HN2,no,N,2,,246100,6421,IAM
3,,SING,N,H,no,N,3,,246100,6421,IAM
4,,SING,CA,CB,no,N,4,,246100,6421,IAM
5,,SING,CA,C,no,N,5,,246100,6421,IAM
6,,SING,CA,HA,no,N,6,,246100,6421,IAM
7,,SING,CB,CG,no,N,7,,246100,6421,IAM
8,,SING,CB,HB,no,N,8,,246100,6421,IAM
9,,SING,CB,HB1,no,N,9,,246100,6421,IAM
10,,DOUB,CG,CD1,yes,N,10,,246100,6421,IAM
11,,SING,CG,CD2,yes,N,11,,246100,6421,IAM
12,,SING,CD1,CE1,yes,N,12,,246100,6421,IAM
13,,SING,CD1,HD1,no,N,13,,246100,6421,IAM
14,,DOUB,CE1,CZ,yes,N,14,,246100,6421,IAM
15,,SING,CE1,HE1,no,N,15,,246100,6421,IAM
16,,SING,CZ,CE2,yes,N,16,,246100,6421,IAM
17,,SING,CZ,CT,no,N,17,,246100,6421,IAM
18,,DOUB,CE2,CD2,yes,N,18,,246100,6421,IAM
19,,SING,CE2,HE2,no,N,19,,246100,6421,IAM
20,,SING,CD2,HD2,no,N,20,,246100,6421,IAM
21,,SING,CT,NH,no,N,21,,246100,6421,IAM
22,,SING,CT,HT1,no,N,22,,246100,6421,IAM
23,,SING,CT,HT2,no,N,23,,246100,6421,IAM
24,,SING,NH,CI,no,N,24,,246100,6421,IAM
25,,SING,NH,HH,no,N,25,,246100,6421,IAM
26,,SING,CI,CK1,no,N,26,,246100,6421,IAM
27,,SING,CI,CK2,no,N,27,,246100,6421,IAM
28,,SING,CI,HI,no,N,28,,246100,6421,IAM
29,,SING,CK1,HK11,no,N,29,,246100,6421,IAM
30,,SING,CK1,HK12,no,N,30,,246100,6421,IAM
31,,SING,CK1,HK13,no,N,31,,246100,6421,IAM
32,,SING,CK2,HK21,no,N,32,,246100,6421,IAM
33,,SING,CK2,HK22,no,N,33,,246100,6421,IAM
34,,SING,CK2,HK23,no,N,34,,246100,6421,IAM
35,,DOUB,C,O,no,N,35,,246100,6421,IAM
36,,SING,C,OXT,no,N,36,,246100,6421,IAM
37,,SING,OXT,HXT,no,N,37,,246100,6421,IAM
1,,SING,N,CA,no,N,1,,246101,6421,IYR
2,,SING,N,H,no,N,2,,246101,6421,IYR
3,,SING,N,H2,no,N,3,,246101,6421,IYR
4,,SING,CA,CB,no,N,4,,246101,6421,IYR
5,,SING,CA,C,no,N,5,,246101,6421,IYR
6,,SING,CA,HA,no,N,6,,246101,6421,IYR
7,,SING,CB,CC,no,N,7,,246101,6421,IYR
8,,SING,CB,HB2,no,N,8,,246101,6421,IYR
9,,SING,CB,HB3,no,N,9,,246101,6421,IYR
10,,DOUB,CC,CD,yes,N,10,,246101,6421,IYR
11,,SING,CC,CH,yes,N,11,,246101,6421,IYR
12,,SING,CD,CE,yes,N,12,,246101,6421,IYR
13,,SING,CD,HD,no,N,13,,246101,6421,IYR
14,,SING,CE,IE,no,N,14,,246101,6421,IYR
15,,DOUB,CE,CF,yes,N,15,,246101,6421,IYR
16,,SING,CF,OF,no,N,16,,246101,6421,IYR
17,,SING,CF,CG,yes,N,17,,246101,6421,IYR
18,,SING,OF,HF,no,N,18,,246101,6421,IYR
19,,DOUB,CG,CH,yes,N,19,,246101,6421,IYR
20,,SING,CG,HG,no,N,20,,246101,6421,IYR
21,,SING,CH,HH,no,N,21,,246101,6421,IYR
22,,DOUB,C,O,no,N,22,,246101,6421,IYR
23,,SING,C,OXT,no,N,23,,246101,6421,IYR
24,,SING,OXT,HXT,no,N,24,,246101,6421,IYR
1,,SING,N,CA,no,N,1,,246116,6422,AA4
2,,SING,N,H,no,N,2,,246116,6422,AA4
3,,SING,N,H2,no,N,3,,246116,6422,AA4
4,,SING,CA,C,no,N,4,,246116,6422,AA4
5,,SING,CA,CB,no,N,5,,246116,6422,AA4
6,,SING,CA,HA,no,N,6,,246116,6422,AA4
7,,DOUB,C,O,no,N,7,,246116,6422,AA4
8,,SING,C,OXT,no,N,8,,246116,6422,AA4
9,,SING,CB,CG,no,N,9,,246116,6422,AA4
10,,SING,CB,HB2,no,N,10,,246116,6422,AA4
11,,SING,CB,HB3,no,N,11,,246116,6422,AA4
12,,SING,CG,CD,no,N,12,,246116,6422,AA4
13,,SING,CG,HG2,no,N,13,,246116,6422,AA4
14,,SING,CG,HG3,no,N,14,,246116,6422,AA4
15,,SING,CD,OE,no,N,15,,246116,6422,AA4
16,,SING,CD,HD2,no,N,16,,246116,6422,AA4
17,,SING,CD,HD3,no,N,17,,246116,6422,AA4
18,,SING,OE,HE,no,N,18,,246116,6422,AA4
19,,SING,OXT,HXT,no,N,19,,246116,6422,AA4
1,,SING,N,CA,no,N,1,,246117,6422,DTR
2,,SING,N,H,no,N,2,,246117,6422,DTR
3,,SING,N,HN2,no,N,3,,246117,6422,DTR
4,,SING,CA,CB,no,N,4,,246117,6422,DTR
5,,SING,CA,C,no,N,5,,246117,6422,DTR
6,,SING,CA,HA,no,N,6,,246117,6422,DTR
7,,SING,CB,CG,no,N,7,,246117,6422,DTR
8,,SING,CB,HB2,no,N,8,,246117,6422,DTR
9,,SING,CB,HB3,no,N,9,,246117,6422,DTR
10,,DOUB,CG,CD1,yes,N,10,,246117,6422,DTR
11,,SING,CG,CD2,yes,N,11,,246117,6422,DTR
12,,SING,CD1,NE1,yes,N,12,,246117,6422,DTR
13,,SING,CD1,HD1,no,N,13,,246117,6422,DTR
14,,SING,NE1,CE2,yes,N,14,,246117,6422,DTR
15,,SING,NE1,HE1,no,N,15,,246117,6422,DTR
16,,DOUB,CE2,CZ2,yes,N,16,,246117,6422,DTR
17,,SING,CE2,CD2,yes,N,17,,246117,6422,DTR
18,,SING,CZ2,CH2,yes,N,18,,246117,6422,DTR
19,,SING,CZ2,HZ2,no,N,19,,246117,6422,DTR
20,,DOUB,CH2,CZ3,yes,N,20,,246117,6422,DTR
21,,SING,CH2,HH2,no,N,21,,246117,6422,DTR
22,,SING,CZ3,CE3,yes,N,22,,246117,6422,DTR
23,,SING,CZ3,HZ3,no,N,23,,246117,6422,DTR
24,,DOUB,CE3,CD2,yes,N,24,,246117,6422,DTR
25,,SING,CE3,HE3,no,N,25,,246117,6422,DTR
26,,DOUB,C,O,no,N,26,,246117,6422,DTR
27,,SING,C,OXT,no,N,27,,246117,6422,DTR
28,,SING,OXT,HXT,no,N,28,,246117,6422,DTR
1,,SING,N,CA,no,N,1,,246118,6422,IAM
2,,SING,N,HN2,no,N,2,,246118,6422,IAM
3,,SING,N,H,no,N,3,,246118,6422,IAM
4,,SING,CA,CB,no,N,4,,246118,6422,IAM
5,,SING,CA,C,no,N,5,,246118,6422,IAM
6,,SING,CA,HA,no,N,6,,246118,6422,IAM
7,,SING,CB,CG,no,N,7,,246118,6422,IAM
8,,SING,CB,HB,no,N,8,,246118,6422,IAM
9,,SING,CB,HB1,no,N,9,,246118,6422,IAM
10,,DOUB,CG,CD1,yes,N,10,,246118,6422,IAM
11,,SING,CG,CD2,yes,N,11,,246118,6422,IAM
12,,SING,CD1,CE1,yes,N,12,,246118,6422,IAM
13,,SING,CD1,HD1,no,N,13,,246118,6422,IAM
14,,DOUB,CE1,CZ,yes,N,14,,246118,6422,IAM
15,,SING,CE1,HE1,no,N,15,,246118,6422,IAM
16,,SING,CZ,CE2,yes,N,16,,246118,6422,IAM
17,,SING,CZ,CT,no,N,17,,246118,6422,IAM
18,,DOUB,CE2,CD2,yes,N,18,,246118,6422,IAM
19,,SING,CE2,HE2,no,N,19,,246118,6422,IAM
20,,SING,CD2,HD2,no,N,20,,246118,6422,IAM
21,,SING,CT,NH,no,N,21,,246118,6422,IAM
22,,SING,CT,HT1,no,N,22,,246118,6422,IAM
23,,SING,CT,HT2,no,N,23,,246118,6422,IAM
24,,SING,NH,CI,no,N,24,,246118,6422,IAM
25,,SING,NH,HH,no,N,25,,246118,6422,IAM
26,,SING,CI,CK1,no,N,26,,246118,6422,IAM
27,,SING,CI,CK2,no,N,27,,246118,6422,IAM
28,,SING,CI,HI,no,N,28,,246118,6422,IAM
29,,SING,CK1,HK11,no,N,29,,246118,6422,IAM
30,,SING,CK1,HK12,no,N,30,,246118,6422,IAM
31,,SING,CK1,HK13,no,N,31,,246118,6422,IAM
32,,SING,CK2,HK21,no,N,32,,246118,6422,IAM
33,,SING,CK2,HK22,no,N,33,,246118,6422,IAM
34,,SING,CK2,HK23,no,N,34,,246118,6422,IAM
35,,DOUB,C,O,no,N,35,,246118,6422,IAM
36,,SING,C,OXT,no,N,36,,246118,6422,IAM
37,,SING,OXT,HXT,no,N,37,,246118,6422,IAM
1,,SING,N,CA,no,N,1,,246133,6423,AA4
2,,SING,N,H,no,N,2,,246133,6423,AA4
3,,SING,N,H2,no,N,3,,246133,6423,AA4
4,,SING,CA,C,no,N,4,,246133,6423,AA4
5,,SING,CA,CB,no,N,5,,246133,6423,AA4
6,,SING,CA,HA,no,N,6,,246133,6423,AA4
7,,DOUB,C,O,no,N,7,,246133,6423,AA4
8,,SING,C,OXT,no,N,8,,246133,6423,AA4
9,,SING,CB,CG,no,N,9,,246133,6423,AA4
10,,SING,CB,HB2,no,N,10,,246133,6423,AA4
11,,SING,CB,HB3,no,N,11,,246133,6423,AA4
12,,SING,CG,CD,no,N,12,,246133,6423,AA4
13,,SING,CG,HG2,no,N,13,,246133,6423,AA4
14,,SING,CG,HG3,no,N,14,,246133,6423,AA4
15,,SING,CD,OE,no,N,15,,246133,6423,AA4
16,,SING,CD,HD2,no,N,16,,246133,6423,AA4
17,,SING,CD,HD3,no,N,17,,246133,6423,AA4
18,,SING,OE,HE,no,N,18,,246133,6423,AA4
19,,SING,OXT,HXT,no,N,19,,246133,6423,AA4
1,,SING,N,CA,no,N,1,,246134,6423,DTR
2,,SING,N,H,no,N,2,,246134,6423,DTR
3,,SING,N,HN2,no,N,3,,246134,6423,DTR
4,,SING,CA,CB,no,N,4,,246134,6423,DTR
5,,SING,CA,C,no,N,5,,246134,6423,DTR
6,,SING,CA,HA,no,N,6,,246134,6423,DTR
7,,SING,CB,CG,no,N,7,,246134,6423,DTR
8,,SING,CB,HB2,no,N,8,,246134,6423,DTR
9,,SING,CB,HB3,no,N,9,,246134,6423,DTR
10,,DOUB,CG,CD1,yes,N,10,,246134,6423,DTR
11,,SING,CG,CD2,yes,N,11,,246134,6423,DTR
12,,SING,CD1,NE1,yes,N,12,,246134,6423,DTR
13,,SING,CD1,HD1,no,N,13,,246134,6423,DTR
14,,SING,NE1,CE2,yes,N,14,,246134,6423,DTR
15,,SING,NE1,HE1,no,N,15,,246134,6423,DTR
16,,DOUB,CE2,CZ2,yes,N,16,,246134,6423,DTR
17,,SING,CE2,CD2,yes,N,17,,246134,6423,DTR
18,,SING,CZ2,CH2,yes,N,18,,246134,6423,DTR
19,,SING,CZ2,HZ2,no,N,19,,246134,6423,DTR
20,,DOUB,CH2,CZ3,yes,N,20,,246134,6423,DTR
21,,SING,CH2,HH2,no,N,21,,246134,6423,DTR
22,,SING,CZ3,CE3,yes,N,22,,246134,6423,DTR
23,,SING,CZ3,HZ3,no,N,23,,246134,6423,DTR
24,,DOUB,CE3,CD2,yes,N,24,,246134,6423,DTR
25,,SING,CE3,HE3,no,N,25,,246134,6423,DTR
26,,DOUB,C,O,no,N,26,,246134,6423,DTR
27,,SING,C,OXT,no,N,27,,246134,6423,DTR
28,,SING,OXT,HXT,no,N,28,,246134,6423,DTR
1,,SING,N,CA,no,N,1,,246135,6423,IAM
2,,SING,N,HN2,no,N,2,,246135,6423,IAM
3,,SING,N,H,no,N,3,,246135,6423,IAM
4,,SING,CA,CB,no,N,4,,246135,6423,IAM
5,,SING,CA,C,no,N,5,,246135,6423,IAM
6,,SING,CA,HA,no,N,6,,246135,6423,IAM
7,,SING,CB,CG,no,N,7,,246135,6423,IAM
8,,SING,CB,HB,no,N,8,,246135,6423,IAM
9,,SING,CB,HB1,no,N,9,,246135,6423,IAM
10,,DOUB,CG,CD1,yes,N,10,,246135,6423,IAM
11,,SING,CG,CD2,yes,N,11,,246135,6423,IAM
12,,SING,CD1,CE1,yes,N,12,,246135,6423,IAM
13,,SING,CD1,HD1,no,N,13,,246135,6423,IAM
14,,DOUB,CE1,CZ,yes,N,14,,246135,6423,IAM
15,,SING,CE1,HE1,no,N,15,,246135,6423,IAM
16,,SING,CZ,CE2,yes,N,16,,246135,6423,IAM
17,,SING,CZ,CT,no,N,17,,246135,6423,IAM
18,,DOUB,CE2,CD2,yes,N,18,,246135,6423,IAM
19,,SING,CE2,HE2,no,N,19,,246135,6423,IAM
20,,SING,CD2,HD2,no,N,20,,246135,6423,IAM
21,,SING,CT,NH,no,N,21,,246135,6423,IAM
22,,SING,CT,HT1,no,N,22,,246135,6423,IAM
23,,SING,CT,HT2,no,N,23,,246135,6423,IAM
24,,SING,NH,CI,no,N,24,,246135,6423,IAM
25,,SING,NH,HH,no,N,25,,246135,6423,IAM
26,,SING,CI,CK1,no,N,26,,246135,6423,IAM
27,,SING,CI,CK2,no,N,27,,246135,6423,IAM
28,,SING,CI,HI,no,N,28,,246135,6423,IAM
29,,SING,CK1,HK11,no,N,29,,246135,6423,IAM
30,,SING,CK1,HK12,no,N,30,,246135,6423,IAM
31,,SING,CK1,HK13,no,N,31,,246135,6423,IAM
32,,SING,CK2,HK21,no,N,32,,246135,6423,IAM
33,,SING,CK2,HK22,no,N,33,,246135,6423,IAM
34,,SING,CK2,HK23,no,N,34,,246135,6423,IAM
35,,DOUB,C,O,no,N,35,,246135,6423,IAM
36,,SING,C,OXT,no,N,36,,246135,6423,IAM
37,,SING,OXT,HXT,no,N,37,,246135,6423,IAM
1,,SING,N,CA,no,N,1,,246151,6424,DTR
2,,SING,N,H,no,N,2,,246151,6424,DTR
3,,SING,N,HN2,no,N,3,,246151,6424,DTR
4,,SING,CA,CB,no,N,4,,246151,6424,DTR
5,,SING,CA,C,no,N,5,,246151,6424,DTR
6,,SING,CA,HA,no,N,6,,246151,6424,DTR
7,,SING,CB,CG,no,N,7,,246151,6424,DTR
8,,SING,CB,HB2,no,N,8,,246151,6424,DTR
9,,SING,CB,HB3,no,N,9,,246151,6424,DTR
10,,DOUB,CG,CD1,yes,N,10,,246151,6424,DTR
11,,SING,CG,CD2,yes,N,11,,246151,6424,DTR
12,,SING,CD1,NE1,yes,N,12,,246151,6424,DTR
13,,SING,CD1,HD1,no,N,13,,246151,6424,DTR
14,,SING,NE1,CE2,yes,N,14,,246151,6424,DTR
15,,SING,NE1,HE1,no,N,15,,246151,6424,DTR
16,,DOUB,CE2,CZ2,yes,N,16,,246151,6424,DTR
17,,SING,CE2,CD2,yes,N,17,,246151,6424,DTR
18,,SING,CZ2,CH2,yes,N,18,,246151,6424,DTR
19,,SING,CZ2,HZ2,no,N,19,,246151,6424,DTR
20,,DOUB,CH2,CZ3,yes,N,20,,246151,6424,DTR
21,,SING,CH2,HH2,no,N,21,,246151,6424,DTR
22,,SING,CZ3,CE3,yes,N,22,,246151,6424,DTR
23,,SING,CZ3,HZ3,no,N,23,,246151,6424,DTR
24,,DOUB,CE3,CD2,yes,N,24,,246151,6424,DTR
25,,SING,CE3,HE3,no,N,25,,246151,6424,DTR
26,,DOUB,C,O,no,N,26,,246151,6424,DTR
27,,SING,C,OXT,no,N,27,,246151,6424,DTR
28,,SING,OXT,HXT,no,N,28,,246151,6424,DTR
1,,SING,N,CA,no,N,1,,246152,6424,IAM
2,,SING,N,HN2,no,N,2,,246152,6424,IAM
3,,SING,N,H,no,N,3,,246152,6424,IAM
4,,SING,CA,CB,no,N,4,,246152,6424,IAM
5,,SING,CA,C,no,N,5,,246152,6424,IAM
6,,SING,CA,HA,no,N,6,,246152,6424,IAM
7,,SING,CB,CG,no,N,7,,246152,6424,IAM
8,,SING,CB,HB,no,N,8,,246152,6424,IAM
9,,SING,CB,HB1,no,N,9,,246152,6424,IAM
10,,DOUB,CG,CD1,yes,N,10,,246152,6424,IAM
11,,SING,CG,CD2,yes,N,11,,246152,6424,IAM
12,,SING,CD1,CE1,yes,N,12,,246152,6424,IAM
13,,SING,CD1,HD1,no,N,13,,246152,6424,IAM
14,,DOUB,CE1,CZ,yes,N,14,,246152,6424,IAM
15,,SING,CE1,HE1,no,N,15,,246152,6424,IAM
16,,SING,CZ,CE2,yes,N,16,,246152,6424,IAM
17,,SING,CZ,CT,no,N,17,,246152,6424,IAM
18,,DOUB,CE2,CD2,yes,N,18,,246152,6424,IAM
19,,SING,CE2,HE2,no,N,19,,246152,6424,IAM
20,,SING,CD2,HD2,no,N,20,,246152,6424,IAM
21,,SING,CT,NH,no,N,21,,246152,6424,IAM
22,,SING,CT,HT1,no,N,22,,246152,6424,IAM
23,,SING,CT,HT2,no,N,23,,246152,6424,IAM
24,,SING,NH,CI,no,N,24,,246152,6424,IAM
25,,SING,NH,HH,no,N,25,,246152,6424,IAM
26,,SING,CI,CK1,no,N,26,,246152,6424,IAM
27,,SING,CI,CK2,no,N,27,,246152,6424,IAM
28,,SING,CI,HI,no,N,28,,246152,6424,IAM
29,,SING,CK1,HK11,no,N,29,,246152,6424,IAM
30,,SING,CK1,HK12,no,N,30,,246152,6424,IAM
31,,SING,CK1,HK13,no,N,31,,246152,6424,IAM
32,,SING,CK2,HK21,no,N,32,,246152,6424,IAM
33,,SING,CK2,HK22,no,N,33,,246152,6424,IAM
34,,SING,CK2,HK23,no,N,34,,246152,6424,IAM
35,,DOUB,C,O,no,N,35,,246152,6424,IAM
36,,SING,C,OXT,no,N,36,,246152,6424,IAM
37,,SING,OXT,HXT,no,N,37,,246152,6424,IAM
1,,SING,N,CA,no,N,1,,246167,6425,DTR
2,,SING,N,H,no,N,2,,246167,6425,DTR
3,,SING,N,HN2,no,N,3,,246167,6425,DTR
4,,SING,CA,CB,no,N,4,,246167,6425,DTR
5,,SING,CA,C,no,N,5,,246167,6425,DTR
6,,SING,CA,HA,no,N,6,,246167,6425,DTR
7,,SING,CB,CG,no,N,7,,246167,6425,DTR
8,,SING,CB,HB2,no,N,8,,246167,6425,DTR
9,,SING,CB,HB3,no,N,9,,246167,6425,DTR
10,,DOUB,CG,CD1,yes,N,10,,246167,6425,DTR
11,,SING,CG,CD2,yes,N,11,,246167,6425,DTR
12,,SING,CD1,NE1,yes,N,12,,246167,6425,DTR
13,,SING,CD1,HD1,no,N,13,,246167,6425,DTR
14,,SING,NE1,CE2,yes,N,14,,246167,6425,DTR
15,,SING,NE1,HE1,no,N,15,,246167,6425,DTR
16,,DOUB,CE2,CZ2,yes,N,16,,246167,6425,DTR
17,,SING,CE2,CD2,yes,N,17,,246167,6425,DTR
18,,SING,CZ2,CH2,yes,N,18,,246167,6425,DTR
19,,SING,CZ2,HZ2,no,N,19,,246167,6425,DTR
20,,DOUB,CH2,CZ3,yes,N,20,,246167,6425,DTR
21,,SING,CH2,HH2,no,N,21,,246167,6425,DTR
22,,SING,CZ3,CE3,yes,N,22,,246167,6425,DTR
23,,SING,CZ3,HZ3,no,N,23,,246167,6425,DTR
24,,DOUB,CE3,CD2,yes,N,24,,246167,6425,DTR
25,,SING,CE3,HE3,no,N,25,,246167,6425,DTR
26,,DOUB,C,O,no,N,26,,246167,6425,DTR
27,,SING,C,OXT,no,N,27,,246167,6425,DTR
28,,SING,OXT,HXT,no,N,28,,246167,6425,DTR
1,,SING,N,CA,no,N,1,,246168,6425,IAM
2,,SING,N,HN2,no,N,2,,246168,6425,IAM
3,,SING,N,H,no,N,3,,246168,6425,IAM
4,,SING,CA,CB,no,N,4,,246168,6425,IAM
5,,SING,CA,C,no,N,5,,246168,6425,IAM
6,,SING,CA,HA,no,N,6,,246168,6425,IAM
7,,SING,CB,CG,no,N,7,,246168,6425,IAM
8,,SING,CB,HB,no,N,8,,246168,6425,IAM
9,,SING,CB,HB1,no,N,9,,246168,6425,IAM
10,,DOUB,CG,CD1,yes,N,10,,246168,6425,IAM
11,,SING,CG,CD2,yes,N,11,,246168,6425,IAM
12,,SING,CD1,CE1,yes,N,12,,246168,6425,IAM
13,,SING,CD1,HD1,no,N,13,,246168,6425,IAM
14,,DOUB,CE1,CZ,yes,N,14,,246168,6425,IAM
15,,SING,CE1,HE1,no,N,15,,246168,6425,IAM
16,,SING,CZ,CE2,yes,N,16,,246168,6425,IAM
17,,SING,CZ,CT,no,N,17,,246168,6425,IAM
18,,DOUB,CE2,CD2,yes,N,18,,246168,6425,IAM
19,,SING,CE2,HE2,no,N,19,,246168,6425,IAM
20,,SING,CD2,HD2,no,N,20,,246168,6425,IAM
21,,SING,CT,NH,no,N,21,,246168,6425,IAM
22,,SING,CT,HT1,no,N,22,,246168,6425,IAM
23,,SING,CT,HT2,no,N,23,,246168,6425,IAM
24,,SING,NH,CI,no,N,24,,246168,6425,IAM
25,,SING,NH,HH,no,N,25,,246168,6425,IAM
26,,SING,CI,CK1,no,N,26,,246168,6425,IAM
27,,SING,CI,CK2,no,N,27,,246168,6425,IAM
28,,SING,CI,HI,no,N,28,,246168,6425,IAM
29,,SING,CK1,HK11,no,N,29,,246168,6425,IAM
30,,SING,CK1,HK12,no,N,30,,246168,6425,IAM
31,,SING,CK1,HK13,no,N,31,,246168,6425,IAM
32,,SING,CK2,HK21,no,N,32,,246168,6425,IAM
33,,SING,CK2,HK22,no,N,33,,246168,6425,IAM
34,,SING,CK2,HK23,no,N,34,,246168,6425,IAM
35,,DOUB,C,O,no,N,35,,246168,6425,IAM
36,,SING,C,OXT,no,N,36,,246168,6425,IAM
37,,SING,OXT,HXT,no,N,37,,246168,6425,IAM
1,,SING,N,CA,no,N,1,,246169,6425,HHK
2,,SING,N,H,no,N,2,,246169,6425,HHK
3,,SING,N,H2,no,N,3,,246169,6425,HHK
4,,SING,CA,CB,no,N,4,,246169,6425,HHK
5,,SING,CA,C,no,N,5,,246169,6425,HHK
6,,SING,CA,HA,no,N,6,,246169,6425,HHK
7,,SING,CB,CG,no,N,7,,246169,6425,HHK
8,,SING,CB,HB2,no,N,8,,246169,6425,HHK
9,,SING,CB,HB3,no,N,9,,246169,6425,HHK
10,,SING,CG,CD,no,N,10,,246169,6425,HHK
11,,SING,CG,HG2,no,N,11,,246169,6425,HHK
12,,SING,CG,HG3,no,N,12,,246169,6425,HHK
13,,SING,CD,CE,no,N,13,,246169,6425,HHK
14,,SING,CD,HD2,no,N,14,,246169,6425,HHK
15,,SING,CD,HD3,no,N,15,,246169,6425,HHK
16,,SING,CE,CZ,no,N,16,,246169,6425,HHK
17,,SING,CE,HE2,no,N,17,,246169,6425,HHK
18,,SING,CE,HE3,no,N,18,,246169,6425,HHK
19,,SING,CZ,CT,no,N,19,,246169,6425,HHK
20,,SING,CZ,HZ2,no,N,20,,246169,6425,HHK
21,,SING,CZ,HZ3,no,N,21,,246169,6425,HHK
22,,SING,CT,NH,no,N,22,,246169,6425,HHK
23,,SING,CT,HT2,no,N,23,,246169,6425,HHK
24,,SING,CT,HT1,no,N,24,,246169,6425,HHK
25,,SING,NH,HH1,no,N,25,,246169,6425,HHK
26,,SING,NH,HH2,no,N,26,,246169,6425,HHK
27,,DOUB,C,O,no,N,27,,246169,6425,HHK
28,,SING,C,OXT,no,N,28,,246169,6425,HHK
29,,SING,OXT,HXT,no,N,29,,246169,6425,HHK
1,,SING,N,CA,no,N,1,,246184,6426,DTR
2,,SING,N,H,no,N,2,,246184,6426,DTR
3,,SING,N,HN2,no,N,3,,246184,6426,DTR
4,,SING,CA,CB,no,N,4,,246184,6426,DTR
5,,SING,CA,C,no,N,5,,246184,6426,DTR
6,,SING,CA,HA,no,N,6,,246184,6426,DTR
7,,SING,CB,CG,no,N,7,,246184,6426,DTR
8,,SING,CB,HB2,no,N,8,,246184,6426,DTR
9,,SING,CB,HB3,no,N,9,,246184,6426,DTR
10,,DOUB,CG,CD1,yes,N,10,,246184,6426,DTR
11,,SING,CG,CD2,yes,N,11,,246184,6426,DTR
12,,SING,CD1,NE1,yes,N,12,,246184,6426,DTR
13,,SING,CD1,HD1,no,N,13,,246184,6426,DTR
14,,SING,NE1,CE2,yes,N,14,,246184,6426,DTR
15,,SING,NE1,HE1,no,N,15,,246184,6426,DTR
16,,DOUB,CE2,CZ2,yes,N,16,,246184,6426,DTR
17,,SING,CE2,CD2,yes,N,17,,246184,6426,DTR
18,,SING,CZ2,CH2,yes,N,18,,246184,6426,DTR
19,,SING,CZ2,HZ2,no,N,19,,246184,6426,DTR
20,,DOUB,CH2,CZ3,yes,N,20,,246184,6426,DTR
21,,SING,CH2,HH2,no,N,21,,246184,6426,DTR
22,,SING,CZ3,CE3,yes,N,22,,246184,6426,DTR
23,,SING,CZ3,HZ3,no,N,23,,246184,6426,DTR
24,,DOUB,CE3,CD2,yes,N,24,,246184,6426,DTR
25,,SING,CE3,HE3,no,N,25,,246184,6426,DTR
26,,DOUB,C,O,no,N,26,,246184,6426,DTR
27,,SING,C,OXT,no,N,27,,246184,6426,DTR
28,,SING,OXT,HXT,no,N,28,,246184,6426,DTR
1,,SING,N,CA,no,N,1,,246185,6426,IAM
2,,SING,N,HN2,no,N,2,,246185,6426,IAM
3,,SING,N,H,no,N,3,,246185,6426,IAM
4,,SING,CA,CB,no,N,4,,246185,6426,IAM
5,,SING,CA,C,no,N,5,,246185,6426,IAM
6,,SING,CA,HA,no,N,6,,246185,6426,IAM
7,,SING,CB,CG,no,N,7,,246185,6426,IAM
8,,SING,CB,HB,no,N,8,,246185,6426,IAM
9,,SING,CB,HB1,no,N,9,,246185,6426,IAM
10,,DOUB,CG,CD1,yes,N,10,,246185,6426,IAM
11,,SING,CG,CD2,yes,N,11,,246185,6426,IAM
12,,SING,CD1,CE1,yes,N,12,,246185,6426,IAM
13,,SING,CD1,HD1,no,N,13,,246185,6426,IAM
14,,DOUB,CE1,CZ,yes,N,14,,246185,6426,IAM
15,,SING,CE1,HE1,no,N,15,,246185,6426,IAM
16,,SING,CZ,CE2,yes,N,16,,246185,6426,IAM
17,,SING,CZ,CT,no,N,17,,246185,6426,IAM
18,,DOUB,CE2,CD2,yes,N,18,,246185,6426,IAM
19,,SING,CE2,HE2,no,N,19,,246185,6426,IAM
20,,SING,CD2,HD2,no,N,20,,246185,6426,IAM
21,,SING,CT,NH,no,N,21,,246185,6426,IAM
22,,SING,CT,HT1,no,N,22,,246185,6426,IAM
23,,SING,CT,HT2,no,N,23,,246185,6426,IAM
24,,SING,NH,CI,no,N,24,,246185,6426,IAM
25,,SING,NH,HH,no,N,25,,246185,6426,IAM
26,,SING,CI,CK1,no,N,26,,246185,6426,IAM
27,,SING,CI,CK2,no,N,27,,246185,6426,IAM
28,,SING,CI,HI,no,N,28,,246185,6426,IAM
29,,SING,CK1,HK11,no,N,29,,246185,6426,IAM
30,,SING,CK1,HK12,no,N,30,,246185,6426,IAM
31,,SING,CK1,HK13,no,N,31,,246185,6426,IAM
32,,SING,CK2,HK21,no,N,32,,246185,6426,IAM
33,,SING,CK2,HK22,no,N,33,,246185,6426,IAM
34,,SING,CK2,HK23,no,N,34,,246185,6426,IAM
35,,DOUB,C,O,no,N,35,,246185,6426,IAM
36,,SING,C,OXT,no,N,36,,246185,6426,IAM
37,,SING,OXT,HXT,no,N,37,,246185,6426,IAM
1,,SING,N,CA,no,N,1,,246186,6426,IYR
2,,SING,N,H,no,N,2,,246186,6426,IYR
3,,SING,N,H2,no,N,3,,246186,6426,IYR
4,,SING,CA,CB,no,N,4,,246186,6426,IYR
5,,SING,CA,C,no,N,5,,246186,6426,IYR
6,,SING,CA,HA,no,N,6,,246186,6426,IYR
7,,SING,CB,CC,no,N,7,,246186,6426,IYR
8,,SING,CB,HB2,no,N,8,,246186,6426,IYR
9,,SING,CB,HB3,no,N,9,,246186,6426,IYR
10,,DOUB,CC,CD,yes,N,10,,246186,6426,IYR
11,,SING,CC,CH,yes,N,11,,246186,6426,IYR
12,,SING,CD,CE,yes,N,12,,246186,6426,IYR
13,,SING,CD,HD,no,N,13,,246186,6426,IYR
14,,SING,CE,IE,no,N,14,,246186,6426,IYR
15,,DOUB,CE,CF,yes,N,15,,246186,6426,IYR
16,,SING,CF,OF,no,N,16,,246186,6426,IYR
17,,SING,CF,CG,yes,N,17,,246186,6426,IYR
18,,SING,OF,HF,no,N,18,,246186,6426,IYR
19,,DOUB,CG,CH,yes,N,19,,246186,6426,IYR
20,,SING,CG,HG,no,N,20,,246186,6426,IYR
21,,SING,CH,HH,no,N,21,,246186,6426,IYR
22,,DOUB,C,O,no,N,22,,246186,6426,IYR
23,,SING,C,OXT,no,N,23,,246186,6426,IYR
24,,SING,OXT,HXT,no,N,24,,246186,6426,IYR
1,,SING,N,CA,no,N,1,,246536,6441,PCA
2,,SING,N,CD,no,N,2,,246536,6441,PCA
3,,SING,N,H,no,N,3,,246536,6441,PCA
4,,SING,CA,CB,no,N,4,,246536,6441,PCA
5,,SING,CA,C,no,N,5,,246536,6441,PCA
6,,SING,CA,HA,no,N,6,,246536,6441,PCA
7,,SING,CB,CG,no,N,7,,246536,6441,PCA
8,,SING,CB,HB2,no,N,8,,246536,6441,PCA
9,,SING,CB,HB3,no,N,9,,246536,6441,PCA
10,,SING,CG,CD,no,N,10,,246536,6441,PCA
11,,SING,CG,HG2,no,N,11,,246536,6441,PCA
12,,SING,CG,HG3,no,N,12,,246536,6441,PCA
13,,DOUB,CD,OE,no,N,13,,246536,6441,PCA
14,,DOUB,C,O,no,N,14,,246536,6441,PCA
15,,SING,C,OXT,no,N,15,,246536,6441,PCA
16,,SING,OXT,HXT,no,N,16,,246536,6441,PCA
1,,SING,CD1,CG,no,N,1,,246537,6441,NLW
2,,SING,CG,CD2,no,N,2,,246537,6441,NLW
3,,SING,CG,CB,no,N,3,,246537,6441,NLW
4,,SING,CB,CA,no,N,4,,246537,6441,NLW
5,,SING,N,CA,no,N,5,,246537,6441,NLW
6,,SING,CA,C,no,N,6,,246537,6441,NLW
7,,SING,C,NH2,no,N,7,,246537,6441,NLW
8,,DOUB,C,O,no,N,8,,246537,6441,NLW
9,,SING,CD2,H1,no,N,9,,246537,6441,NLW
10,,SING,CD2,H2,no,N,10,,246537,6441,NLW
11,,SING,CD2,H3,no,N,11,,246537,6441,NLW
12,,SING,CG,H4,no,N,12,,246537,6441,NLW
13,,SING,CD1,H5,no,N,13,,246537,6441,NLW
14,,SING,CD1,H6,no,N,14,,246537,6441,NLW
15,,SING,CD1,H7,no,N,15,,246537,6441,NLW
16,,SING,CB,H8,no,N,16,,246537,6441,NLW
17,,SING,CB,H9,no,N,17,,246537,6441,NLW
18,,SING,CA,H10,no,N,18,,246537,6441,NLW
19,,SING,N,H11,no,N,19,,246537,6441,NLW
20,,SING,N,H12,no,N,20,,246537,6441,NLW
21,,SING,NH2,H14,no,N,21,,246537,6441,NLW
22,,SING,NH2,H15,no,N,22,,246537,6441,NLW
1,,DOUB,C1,C2,yes,N,1,,246594,6444,NGH
2,,SING,C1,C6,yes,N,2,,246594,6444,NGH
3,,SING,C1,H1,no,N,3,,246594,6444,NGH
4,,SING,C2,C3,yes,N,4,,246594,6444,NGH
5,,SING,C2,H2,no,N,5,,246594,6444,NGH
6,,DOUB,C3,C4,yes,N,6,,246594,6444,NGH
7,,SING,C3,O1,no,N,7,,246594,6444,NGH
8,,SING,C4,C5,yes,N,8,,246594,6444,NGH
9,,SING,C4,H4,no,N,9,,246594,6444,NGH
10,,DOUB,C5,C6,yes,N,10,,246594,6444,NGH
11,,SING,C5,H5,no,N,11,,246594,6444,NGH
12,,SING,C6,S1,no,N,12,,246594,6444,NGH
13,,SING,O1,C7,no,N,13,,246594,6444,NGH
14,,SING,C7,H71,no,N,14,,246594,6444,NGH
15,,SING,C7,H72,no,N,15,,246594,6444,NGH
16,,SING,C7,H73,no,N,16,,246594,6444,NGH
17,,DOUB,S1,O2,no,N,17,,246594,6444,NGH
18,,DOUB,S1,O3,no,N,18,,246594,6444,NGH
19,,SING,S1,N,no,N,19,,246594,6444,NGH
20,,SING,N,C9,no,N,20,,246594,6444,NGH
21,,SING,N,C10,no,N,21,,246594,6444,NGH
22,,SING,C9,C12,no,N,22,,246594,6444,NGH
23,,SING,C9,H91,no,N,23,,246594,6444,NGH
24,,SING,C9,H92,no,N,24,,246594,6444,NGH
25,,SING,C10,C11,no,N,25,,246594,6444,NGH
26,,SING,C10,H101,no,N,26,,246594,6444,NGH
27,,SING,C10,H102,no,N,27,,246594,6444,NGH
28,,SING,C11,N1,no,N,28,,246594,6444,NGH
29,,DOUB,C11,O5,no,N,29,,246594,6444,NGH
30,,SING,N1,O4,no,N,30,,246594,6444,NGH
31,,SING,N1,HN1,no,N,31,,246594,6444,NGH
32,,SING,O4,HO4,no,N,32,,246594,6444,NGH
33,,SING,C12,C13,no,N,33,,246594,6444,NGH
34,,SING,C12,C14,no,N,34,,246594,6444,NGH
35,,SING,C12,H12,no,N,35,,246594,6444,NGH
36,,SING,C13,H131,no,N,36,,246594,6444,NGH
37,,SING,C13,H132,no,N,37,,246594,6444,NGH
38,,SING,C13,H133,no,N,38,,246594,6444,NGH
39,,SING,C14,H141,no,N,39,,246594,6444,NGH
40,,SING,C14,H142,no,N,40,,246594,6444,NGH
41,,SING,C14,H143,no,N,41,,246594,6444,NGH
1,,SING,N,CA,no,N,1,,246641,6446,HSL
2,,SING,N,H,no,N,2,,246641,6446,HSL
3,,SING,N,H2,no,N,3,,246641,6446,HSL
4,,SING,CA,C,no,N,4,,246641,6446,HSL
5,,SING,CA,CB,no,N,5,,246641,6446,HSL
6,,SING,CA,HA,no,N,6,,246641,6446,HSL
7,,DOUB,C,O,no,N,7,,246641,6446,HSL
8,,SING,C,OD,no,N,8,,246641,6446,HSL
9,,SING,CB,CG,no,N,9,,246641,6446,HSL
10,,SING,CB,HB2,no,N,10,,246641,6446,HSL
11,,SING,CB,HB3,no,N,11,,246641,6446,HSL
12,,SING,CG,OD,no,N,12,,246641,6446,HSL
13,,SING,CG,HG2,no,N,13,,246641,6446,HSL
14,,SING,CG,HG3,no,N,14,,246641,6446,HSL
1,,SING,C1,C2,no,N,1,,246735,6449,REA
2,,SING,C1,C6,no,N,2,,246735,6449,REA
3,,SING,C1,C16,no,N,3,,246735,6449,REA
4,,SING,C1,C17,no,N,4,,246735,6449,REA
5,,SING,C2,C3,no,N,5,,246735,6449,REA
6,,SING,C2,H21,no,N,6,,246735,6449,REA
7,,SING,C2,H22,no,N,7,,246735,6449,REA
8,,SING,C3,C4,no,N,8,,246735,6449,REA
9,,SING,C3,H31,no,N,9,,246735,6449,REA
10,,SING,C3,H32,no,N,10,,246735,6449,REA
11,,SING,C4,C5,no,N,11,,246735,6449,REA
12,,SING,C4,H41,no,N,12,,246735,6449,REA
13,,SING,C4,H42,no,N,13,,246735,6449,REA
14,,DOUB,C5,C6,no,N,14,,246735,6449,REA
15,,SING,C5,C18,no,N,15,,246735,6449,REA
16,,SING,C6,C7,no,N,16,,246735,6449,REA
17,,DOUB,C7,C8,no,E,17,,246735,6449,REA
18,,SING,C7,H7,no,N,18,,246735,6449,REA
19,,SING,C8,C9,no,N,19,,246735,6449,REA
20,,SING,C8,H8,no,N,20,,246735,6449,REA
21,,DOUB,C9,C10,no,E,21,,246735,6449,REA
22,,SING,C9,C19,no,N,22,,246735,6449,REA
23,,SING,C10,C11,no,N,23,,246735,6449,REA
24,,SING,C10,H10,no,N,24,,246735,6449,REA
25,,DOUB,C11,C12,no,E,25,,246735,6449,REA
26,,SING,C11,H11,no,N,26,,246735,6449,REA
27,,SING,C12,C13,no,N,27,,246735,6449,REA
28,,SING,C12,H12,no,N,28,,246735,6449,REA
29,,DOUB,C13,C14,no,E,29,,246735,6449,REA
30,,SING,C13,C20,no,N,30,,246735,6449,REA
31,,SING,C14,C15,no,N,31,,246735,6449,REA
32,,SING,C14,H14,no,N,32,,246735,6449,REA
33,,DOUB,C15,O1,no,N,33,,246735,6449,REA
34,,SING,C15,O2,no,N,34,,246735,6449,REA
35,,SING,C16,H161,no,N,35,,246735,6449,REA
36,,SING,C16,H162,no,N,36,,246735,6449,REA
37,,SING,C16,H163,no,N,37,,246735,6449,REA
38,,SING,C17,H171,no,N,38,,246735,6449,REA
39,,SING,C17,H172,no,N,39,,246735,6449,REA
40,,SING,C17,H173,no,N,40,,246735,6449,REA
41,,SING,C18,H181,no,N,41,,246735,6449,REA
42,,SING,C18,H182,no,N,42,,246735,6449,REA
43,,SING,C18,H183,no,N,43,,246735,6449,REA
44,,SING,C19,H191,no,N,44,,246735,6449,REA
45,,SING,C19,H192,no,N,45,,246735,6449,REA
46,,SING,C19,H193,no,N,46,,246735,6449,REA
47,,SING,C20,H201,no,N,47,,246735,6449,REA
48,,SING,C20,H202,no,N,48,,246735,6449,REA
49,,SING,C20,H203,no,N,49,,246735,6449,REA
50,,SING,O2,HO2,no,N,50,,246735,6449,REA
1,,SING,C1,C2,no,N,1,,246760,645,AAC
2,,SING,C1,O1,no,N,2,,246760,645,AAC
3,,DOUB,C1,O2,no,N,3,,246760,645,AAC
4,,SING,C2,N1,no,N,4,,246760,645,AAC
5,,SING,C2,HC21,no,N,5,,246760,645,AAC
6,,SING,C2,HC22,no,N,6,,246760,645,AAC
7,,SING,C3,C4,no,N,7,,246760,645,AAC
8,,SING,C3,N1,no,N,8,,246760,645,AAC
9,,DOUB,C3,O3,no,N,9,,246760,645,AAC
10,,SING,C4,HC41,no,N,10,,246760,645,AAC
11,,SING,C4,HC42,no,N,11,,246760,645,AAC
12,,SING,C4,HC43,no,N,12,,246760,645,AAC
13,,SING,N1,HN1,no,N,13,,246760,645,AAC
14,,SING,O1,HO1,no,N,14,,246760,645,AAC
1,,SING,FE,NA,no,N,1,,246761,645,HEC
2,,SING,FE,NB,no,N,2,,246761,645,HEC
3,,SING,FE,NC,no,N,3,,246761,645,HEC
4,,SING,FE,ND,no,N,4,,246761,645,HEC
5,,DOUB,CHA,C1A,no,N,5,,246761,645,HEC
6,,SING,CHA,C4D,no,N,6,,246761,645,HEC
7,,SING,CHA,HHA,no,N,7,,246761,645,HEC
8,,DOUB,CHB,C4A,no,N,8,,246761,645,HEC
9,,SING,CHB,C1B,no,N,9,,246761,645,HEC
10,,SING,CHB,HHB,no,N,10,,246761,645,HEC
11,,DOUB,CHC,C4B,no,N,11,,246761,645,HEC
12,,SING,CHC,C1C,no,N,12,,246761,645,HEC
13,,SING,CHC,HHC,no,N,13,,246761,645,HEC
14,,DOUB,CHD,C4C,no,N,14,,246761,645,HEC
15,,SING,CHD,C1D,no,N,15,,246761,645,HEC
16,,SING,CHD,HHD,no,N,16,,246761,645,HEC
17,,SING,NA,C1A,yes,N,17,,246761,645,HEC
18,,SING,NA,C4A,yes,N,18,,246761,645,HEC
19,,SING,C1A,C2A,yes,N,19,,246761,645,HEC
20,,DOUB,C2A,C3A,yes,N,20,,246761,645,HEC
21,,SING,C2A,CAA,no,N,21,,246761,645,HEC
22,,SING,C3A,C4A,yes,N,22,,246761,645,HEC
23,,SING,C3A,CMA,no,N,23,,246761,645,HEC
24,,SING,CMA,HMA1,no,N,24,,246761,645,HEC
25,,SING,CMA,HMA2,no,N,25,,246761,645,HEC
26,,SING,CMA,HMA3,no,N,26,,246761,645,HEC
27,,SING,CAA,CBA,no,N,27,,246761,645,HEC
28,,SING,CAA,HAA1,no,N,28,,246761,645,HEC
29,,SING,CAA,HAA2,no,N,29,,246761,645,HEC
30,,SING,CBA,CGA,no,N,30,,246761,645,HEC
31,,SING,CBA,HBA1,no,N,31,,246761,645,HEC
32,,SING,CBA,HBA2,no,N,32,,246761,645,HEC
33,,DOUB,CGA,O1A,no,N,33,,246761,645,HEC
34,,SING,CGA,O2A,no,N,34,,246761,645,HEC
35,,SING,O2A,H2A,no,N,35,,246761,645,HEC
36,,SING,NB,C1B,yes,N,36,,246761,645,HEC
37,,SING,NB,C4B,yes,N,37,,246761,645,HEC
38,,DOUB,C1B,C2B,yes,N,38,,246761,645,HEC
39,,SING,C2B,C3B,yes,N,39,,246761,645,HEC
40,,SING,C2B,CMB,no,N,40,,246761,645,HEC
41,,SING,C3B,C4B,yes,N,41,,246761,645,HEC
42,,DOUB,C3B,CAB,no,E,42,,246761,645,HEC
43,,SING,CMB,HMB1,no,N,43,,246761,645,HEC
44,,SING,CMB,HMB2,no,N,44,,246761,645,HEC
45,,SING,CMB,HMB3,no,N,45,,246761,645,HEC
46,,SING,CAB,CBB,no,N,46,,246761,645,HEC
47,,SING,CAB,HAB,no,N,47,,246761,645,HEC
48,,SING,CBB,HBB1,no,N,48,,246761,645,HEC
49,,SING,CBB,HBB2,no,N,49,,246761,645,HEC
50,,SING,CBB,HBB3,no,N,50,,246761,645,HEC
51,,SING,NC,C1C,yes,N,51,,246761,645,HEC
52,,SING,NC,C4C,yes,N,52,,246761,645,HEC
53,,DOUB,C1C,C2C,yes,N,53,,246761,645,HEC
54,,SING,C2C,C3C,yes,N,54,,246761,645,HEC
55,,SING,C2C,CMC,no,N,55,,246761,645,HEC
56,,SING,C3C,C4C,yes,N,56,,246761,645,HEC
57,,DOUB,C3C,CAC,no,E,57,,246761,645,HEC
58,,SING,CMC,HMC1,no,N,58,,246761,645,HEC
59,,SING,CMC,HMC2,no,N,59,,246761,645,HEC
60,,SING,CMC,HMC3,no,N,60,,246761,645,HEC
61,,SING,CAC,CBC,no,N,61,,246761,645,HEC
62,,SING,CAC,HAC,no,N,62,,246761,645,HEC
63,,SING,CBC,HBC1,no,N,63,,246761,645,HEC
64,,SING,CBC,HBC2,no,N,64,,246761,645,HEC
65,,SING,CBC,HBC3,no,N,65,,246761,645,HEC
66,,SING,ND,C1D,yes,N,66,,246761,645,HEC
67,,SING,ND,C4D,yes,N,67,,246761,645,HEC
68,,DOUB,C1D,C2D,yes,N,68,,246761,645,HEC
69,,SING,C2D,C3D,yes,N,69,,246761,645,HEC
70,,SING,C2D,CMD,no,N,70,,246761,645,HEC
71,,DOUB,C3D,C4D,yes,N,71,,246761,645,HEC
72,,SING,C3D,CAD,no,N,72,,246761,645,HEC
73,,SING,CMD,HMD1,no,N,73,,246761,645,HEC
74,,SING,CMD,HMD2,no,N,74,,246761,645,HEC
75,,SING,CMD,HMD3,no,N,75,,246761,645,HEC
76,,SING,CAD,CBD,no,N,76,,246761,645,HEC
77,,SING,CAD,HAD1,no,N,77,,246761,645,HEC
78,,SING,CAD,HAD2,no,N,78,,246761,645,HEC
79,,SING,CBD,CGD,no,N,79,,246761,645,HEC
80,,SING,CBD,HBD1,no,N,80,,246761,645,HEC
81,,SING,CBD,HBD2,no,N,81,,246761,645,HEC
82,,DOUB,CGD,O1D,no,N,82,,246761,645,HEC
83,,SING,CGD,O2D,no,N,83,,246761,645,HEC
84,,SING,O2D,H2D,no,N,84,,246761,645,HEC
1,,SING,N,HN1,no,N,1,,247003,6463,NH2
2,,SING,N,HN2,no,N,2,,247003,6463,NH2
1,,SING,N1,C2,no,N,1,,247042,6465,UDP
2,,SING,N1,C6,no,N,2,,247042,6465,UDP
3,,SING,N1,C1',no,N,3,,247042,6465,UDP
4,,SING,C2,N3,no,N,4,,247042,6465,UDP
5,,DOUB,C2,O2,no,N,5,,247042,6465,UDP
6,,SING,N3,C4,no,N,6,,247042,6465,UDP
7,,SING,N3,HN3,no,N,7,,247042,6465,UDP
8,,SING,C4,C5,no,N,8,,247042,6465,UDP
9,,DOUB,C4,O4,no,N,9,,247042,6465,UDP
10,,DOUB,C5,C6,no,N,10,,247042,6465,UDP
11,,SING,C5,H5,no,N,11,,247042,6465,UDP
12,,SING,C6,H6,no,N,12,,247042,6465,UDP
13,,SING,C1',C2',no,N,13,,247042,6465,UDP
14,,SING,C1',O4',no,N,14,,247042,6465,UDP
15,,SING,C1',H1',no,N,15,,247042,6465,UDP
16,,SING,C2',O2',no,N,16,,247042,6465,UDP
17,,SING,C2',C3',no,N,17,,247042,6465,UDP
18,,SING,C2',H2',no,N,18,,247042,6465,UDP
19,,SING,O2',HO2',no,N,19,,247042,6465,UDP
20,,SING,C3',C4',no,N,20,,247042,6465,UDP
21,,SING,C3',O3',no,N,21,,247042,6465,UDP
22,,SING,C3',H3',no,N,22,,247042,6465,UDP
23,,SING,C4',O4',no,N,23,,247042,6465,UDP
24,,SING,C4',C5',no,N,24,,247042,6465,UDP
25,,SING,C4',H4',no,N,25,,247042,6465,UDP
26,,SING,O3',HO3',no,N,26,,247042,6465,UDP
27,,SING,C5',O5',no,N,27,,247042,6465,UDP
28,,SING,C5',H5'1,no,N,28,,247042,6465,UDP
29,,SING,C5',H5'2,no,N,29,,247042,6465,UDP
30,,SING,O5',PA,no,N,30,,247042,6465,UDP
31,,DOUB,PA,O1A,no,N,31,,247042,6465,UDP
32,,SING,PA,O2A,no,N,32,,247042,6465,UDP
33,,SING,PA,O3A,no,N,33,,247042,6465,UDP
34,,SING,O2A,HOA2,no,N,34,,247042,6465,UDP
35,,SING,O3A,PB,no,N,35,,247042,6465,UDP
36,,DOUB,PB,O1B,no,N,36,,247042,6465,UDP
37,,SING,PB,O2B,no,N,37,,247042,6465,UDP
38,,SING,PB,O3B,no,N,38,,247042,6465,UDP
39,,SING,O2B,HOB2,no,N,39,,247042,6465,UDP
40,,SING,O3B,HOB3,no,N,40,,247042,6465,UDP
1,,SING,C1,C2,no,N,1,,247043,6465,AMU
2,,SING,C1,O1,no,N,2,,247043,6465,AMU
3,,SING,C1,O5,no,N,3,,247043,6465,AMU
4,,SING,C1,H1,no,N,4,,247043,6465,AMU
5,,SING,C2,C3,no,N,5,,247043,6465,AMU
6,,SING,C2,N2,no,N,6,,247043,6465,AMU
7,,SING,C2,H2,no,N,7,,247043,6465,AMU
8,,SING,C3,C4,no,N,8,,247043,6465,AMU
9,,SING,C3,O3,no,N,9,,247043,6465,AMU
10,,SING,C3,H3,no,N,10,,247043,6465,AMU
11,,SING,C4,C5,no,N,11,,247043,6465,AMU
12,,SING,C4,O4,no,N,12,,247043,6465,AMU
13,,SING,C4,H4,no,N,13,,247043,6465,AMU
14,,SING,C5,C6,no,N,14,,247043,6465,AMU
15,,SING,C5,O5,no,N,15,,247043,6465,AMU
16,,SING,C5,H5,no,N,16,,247043,6465,AMU
17,,SING,C6,O6,no,N,17,,247043,6465,AMU
18,,SING,C6,H61,no,N,18,,247043,6465,AMU
19,,SING,C6,H62,no,N,19,,247043,6465,AMU
20,,SING,C7,C8,no,N,20,,247043,6465,AMU
21,,DOUB,C7,O7,no,N,21,,247043,6465,AMU
22,,SING,C7,N2,no,N,22,,247043,6465,AMU
23,,SING,C8,H81,no,N,23,,247043,6465,AMU
24,,SING,C8,H82,no,N,24,,247043,6465,AMU
25,,SING,C8,H83,no,N,25,,247043,6465,AMU
26,,SING,C9,C10,no,N,26,,247043,6465,AMU
27,,SING,C9,C11,no,N,27,,247043,6465,AMU
28,,SING,C9,O3,no,N,28,,247043,6465,AMU
29,,SING,C9,H9,no,N,29,,247043,6465,AMU
30,,DOUB,C10,O10,no,N,30,,247043,6465,AMU
31,,SING,C10,O11,no,N,31,,247043,6465,AMU
32,,SING,C11,H111,no,N,32,,247043,6465,AMU
33,,SING,C11,H112,no,N,33,,247043,6465,AMU
34,,SING,C11,H113,no,N,34,,247043,6465,AMU
35,,SING,O1,HO1,no,N,35,,247043,6465,AMU
36,,SING,O4,HO4,no,N,36,,247043,6465,AMU
37,,SING,O6,HO6,no,N,37,,247043,6465,AMU
38,,SING,O11,HO11,no,N,38,,247043,6465,AMU
39,,SING,N2,HN2,no,N,39,,247043,6465,AMU
1,,SING,N,CA,no,N,1,,247044,6465,DGN
2,,SING,N,H,no,N,2,,247044,6465,DGN
3,,SING,N,H2,no,N,3,,247044,6465,DGN
4,,SING,CA,C,no,N,4,,247044,6465,DGN
5,,SING,CA,CB,no,N,5,,247044,6465,DGN
6,,SING,CA,HA,no,N,6,,247044,6465,DGN
7,,DOUB,C,O,no,N,7,,247044,6465,DGN
8,,SING,C,OXT,no,N,8,,247044,6465,DGN
9,,SING,OXT,HXT,no,N,9,,247044,6465,DGN
10,,SING,CB,CG,no,N,10,,247044,6465,DGN
11,,SING,CB,HB2,no,N,11,,247044,6465,DGN
12,,SING,CB,HB3,no,N,12,,247044,6465,DGN
13,,SING,CG,CD,no,N,13,,247044,6465,DGN
14,,SING,CG,HG2,no,N,14,,247044,6465,DGN
15,,SING,CG,HG3,no,N,15,,247044,6465,DGN
16,,DOUB,CD,OE1,no,N,16,,247044,6465,DGN
17,,SING,CD,NE2,no,N,17,,247044,6465,DGN
18,,SING,NE2,HE21,no,N,18,,247044,6465,DGN
19,,SING,NE2,HE22,no,N,19,,247044,6465,DGN
1,,SING,N,CA,no,N,1,,247045,6465,KCX
2,,SING,N,H,no,N,2,,247045,6465,KCX
3,,SING,N,HN2,no,N,3,,247045,6465,KCX
4,,SING,CA,CB,no,N,4,,247045,6465,KCX
5,,SING,CA,C,no,N,5,,247045,6465,KCX
6,,SING,CA,HA,no,N,6,,247045,6465,KCX
7,,SING,CB,CG,no,N,7,,247045,6465,KCX
8,,SING,CB,HB2,no,N,8,,247045,6465,KCX
9,,SING,CB,HB3,no,N,9,,247045,6465,KCX
10,,SING,CG,CD,no,N,10,,247045,6465,KCX
11,,SING,CG,HG2,no,N,11,,247045,6465,KCX
12,,SING,CG,HG3,no,N,12,,247045,6465,KCX
13,,SING,CD,CE,no,N,13,,247045,6465,KCX
14,,SING,CD,HD2,no,N,14,,247045,6465,KCX
15,,SING,CD,HD3,no,N,15,,247045,6465,KCX
16,,SING,CE,NZ,no,N,16,,247045,6465,KCX
17,,SING,CE,HE2,no,N,17,,247045,6465,KCX
18,,SING,CE,HE3,no,N,18,,247045,6465,KCX
19,,SING,NZ,CX,no,N,19,,247045,6465,KCX
20,,SING,NZ,HZ,no,N,20,,247045,6465,KCX
21,,DOUB,C,O,no,N,21,,247045,6465,KCX
22,,SING,C,OXT,no,N,22,,247045,6465,KCX
23,,DOUB,CX,OQ1,no,N,23,,247045,6465,KCX
24,,SING,CX,OQ2,no,N,24,,247045,6465,KCX
25,,SING,OXT,HXT,no,N,25,,247045,6465,KCX
26,,SING,OQ2,HQ2,no,N,26,,247045,6465,KCX
1,,SING,N,CA,no,N,1,,247046,6465,DAL
2,,SING,N,H,no,N,2,,247046,6465,DAL
3,,SING,N,H2,no,N,3,,247046,6465,DAL
4,,SING,CA,CB,no,N,4,,247046,6465,DAL
5,,SING,CA,C,no,N,5,,247046,6465,DAL
6,,SING,CA,HA,no,N,6,,247046,6465,DAL
7,,SING,CB,HB1,no,N,7,,247046,6465,DAL
8,,SING,CB,HB2,no,N,8,,247046,6465,DAL
9,,SING,CB,HB3,no,N,9,,247046,6465,DAL
10,,DOUB,C,O,no,N,10,,247046,6465,DAL
11,,SING,C,OXT,no,N,11,,247046,6465,DAL
12,,SING,OXT,HXT,no,N,12,,247046,6465,DAL
1,,SING,,,,,,,247599,6495,TSA
1,,SING,C1,C2,no,N,1,,247624,6496,PRE
2,,SING,C1,C6,no,N,2,,247624,6496,PRE
3,,SING,C1,C7,no,N,3,,247624,6496,PRE
4,,SING,C1,C8,no,N,4,,247624,6496,PRE
5,,DOUB,C2,C3,no,N,5,,247624,6496,PRE
6,,SING,C2,H2,no,N,6,,247624,6496,PRE
7,,SING,C3,C4,no,N,7,,247624,6496,PRE
8,,SING,C3,H3,no,N,8,,247624,6496,PRE
9,,SING,C4,O4,no,N,9,,247624,6496,PRE
10,,SING,C4,C5,no,N,10,,247624,6496,PRE
11,,SING,C4,H4,no,N,11,,247624,6496,PRE
12,,SING,O4,HO4,no,N,12,,247624,6496,PRE
13,,DOUB,C5,C6,no,N,13,,247624,6496,PRE
14,,SING,C5,H5,no,N,14,,247624,6496,PRE
15,,SING,C6,H6,no,N,15,,247624,6496,PRE
16,,DOUB,C7,O71,no,N,16,,247624,6496,PRE
17,,SING,C7,O72,no,N,17,,247624,6496,PRE
18,,SING,O72,HO72,no,N,18,,247624,6496,PRE
19,,SING,C8,C1',no,N,19,,247624,6496,PRE
20,,SING,C8,H81,no,N,20,,247624,6496,PRE
21,,SING,C8,H82,no,N,21,,247624,6496,PRE
22,,DOUB,C1',O1',no,N,22,,247624,6496,PRE
23,,SING,C1',C2',no,N,23,,247624,6496,PRE
24,,DOUB,C2',O'L,no,N,24,,247624,6496,PRE
25,,SING,C2',O'M,no,N,25,,247624,6496,PRE
26,,SING,O'M,HO2',no,N,26,,247624,6496,PRE
1,,SING,N1,O1,no,N,1,,247850,6507,NPP
2,,SING,N1,C2,no,N,2,,247850,6507,NPP
3,,SING,N1,C6,no,N,3,,247850,6507,NPP
4,,SING,C2,CM1,no,N,4,,247850,6507,NPP
5,,SING,C2,CM2,no,N,5,,247850,6507,NPP
6,,SING,C2,C3,no,N,6,,247850,6507,NPP
7,,SING,CM1,HM11,no,N,7,,247850,6507,NPP
8,,SING,CM1,HM12,no,N,8,,247850,6507,NPP
9,,SING,CM1,HM13,no,N,9,,247850,6507,NPP
10,,SING,CM2,HM21,no,N,10,,247850,6507,NPP
11,,SING,CM2,HM22,no,N,11,,247850,6507,NPP
12,,SING,CM2,HM23,no,N,12,,247850,6507,NPP
13,,SING,C3,C4,no,N,13,,247850,6507,NPP
14,,SING,C3,H31,no,N,14,,247850,6507,NPP
15,,SING,C3,H32,no,N,15,,247850,6507,NPP
16,,SING,C4,C5,no,N,16,,247850,6507,NPP
17,,SING,C4,N2,no,N,17,,247850,6507,NPP
18,,SING,C4,H4,no,N,18,,247850,6507,NPP
19,,SING,C5,C6,no,N,19,,247850,6507,NPP
20,,SING,C5,H51,no,N,20,,247850,6507,NPP
21,,SING,C5,H52,no,N,21,,247850,6507,NPP
22,,SING,C6,CM3,no,N,22,,247850,6507,NPP
23,,SING,C6,CM4,no,N,23,,247850,6507,NPP
24,,SING,CM3,HM31,no,N,24,,247850,6507,NPP
25,,SING,CM3,HM32,no,N,25,,247850,6507,NPP
26,,SING,CM3,HM33,no,N,26,,247850,6507,NPP
27,,SING,CM4,HM41,no,N,27,,247850,6507,NPP
28,,SING,CM4,HM42,no,N,28,,247850,6507,NPP
29,,SING,CM4,HM43,no,N,29,,247850,6507,NPP
30,,SING,N2,C7,no,N,30,,247850,6507,NPP
31,,SING,N2,HN2,no,N,31,,247850,6507,NPP
32,,DOUB,C7,C8,yes,N,32,,247850,6507,NPP
33,,SING,C7,C12,yes,N,33,,247850,6507,NPP
34,,SING,C8,N3,no,N,34,,247850,6507,NPP
35,,SING,C8,C9,yes,N,35,,247850,6507,NPP
36,,SING,N3,O2,no,N,36,,247850,6507,NPP
37,,DOUB,N3,O3,no,N,37,,247850,6507,NPP
38,,DOUB,C9,C10,yes,N,38,,247850,6507,NPP
39,,SING,C9,H9,no,N,39,,247850,6507,NPP
40,,SING,C10,N4,no,N,40,,247850,6507,NPP
41,,SING,C10,C11,yes,N,41,,247850,6507,NPP
42,,SING,N4,O4,no,N,42,,247850,6507,NPP
43,,DOUB,N4,O5,no,N,43,,247850,6507,NPP
44,,DOUB,C11,C12,yes,N,44,,247850,6507,NPP
45,,SING,C11,N5,no,N,45,,247850,6507,NPP
46,,SING,C12,H12,no,N,46,,247850,6507,NPP
47,,SING,N5,C13,no,N,47,,247850,6507,NPP
48,,SING,N5,HN5,no,N,48,,247850,6507,NPP
49,,SING,C13,C14,no,N,49,,247850,6507,NPP
50,,SING,C13,H131,no,N,50,,247850,6507,NPP
51,,SING,C13,H132,no,N,51,,247850,6507,NPP
52,,SING,C14,N6,no,N,52,,247850,6507,NPP
53,,SING,C14,H141,no,N,53,,247850,6507,NPP
54,,SING,C14,H142,no,N,54,,247850,6507,NPP
55,,SING,N6,HN61,no,N,55,,247850,6507,NPP
56,,SING,N6,HN62,no,N,56,,247850,6507,NPP
1,,SING,NZ,CA,no,N,1,,247874,6508,NP1
2,,SING,NZ,HNZ1,no,N,2,,247874,6508,NP1
3,,SING,NZ,HNZ2,no,N,3,,247874,6508,NP1
4,,SING,CA,CB,no,N,4,,247874,6508,NP1
5,,SING,CA,HA1,no,N,5,,247874,6508,NP1
6,,SING,CA,HA2,no,N,6,,247874,6508,NP1
7,,SING,CB,CG,no,N,7,,247874,6508,NP1
8,,SING,CB,HB1,no,N,8,,247874,6508,NP1
9,,SING,CB,HB2,no,N,9,,247874,6508,NP1
10,,SING,CG,NE,no,N,10,,247874,6508,NP1
11,,SING,CG,HG1,no,N,11,,247874,6508,NP1
12,,SING,CG,HG2,no,N,12,,247874,6508,NP1
13,,SING,NE,CD,no,N,13,,247874,6508,NP1
14,,SING,NE,HNE,no,N,14,,247874,6508,NP1
15,,DOUB,CD,CE1,yes,N,15,,247874,6508,NP1
16,,SING,CD,CE2,yes,N,16,,247874,6508,NP1
17,,SING,CE1,CR1,yes,N,17,,247874,6508,NP1
18,,SING,CE1,HE1,no,N,18,,247874,6508,NP1
19,,SING,CE2,NO2,no,N,19,,247874,6508,NP1
20,,DOUB,CE2,CR2,yes,N,20,,247874,6508,NP1
21,,DOUB,NO2,OC1,no,N,21,,247874,6508,NP1
22,,SING,NO2,OC2,no,N,22,,247874,6508,NP1
23,,DOUB,CR1,CZ,yes,N,23,,247874,6508,NP1
24,,SING,CR1,HR1,no,N,24,,247874,6508,NP1
25,,SING,CR2,CZ,yes,N,25,,247874,6508,NP1
26,,SING,CR2,HR2,no,N,26,,247874,6508,NP1
27,,SING,CZ,CM,no,N,27,,247874,6508,NP1
28,,SING,CM,HM1,no,N,28,,247874,6508,NP1
29,,SING,CM,HM2,no,N,29,,247874,6508,NP1
30,,SING,CM,HM3,no,N,30,,247874,6508,NP1
1,,SING,OP3,P,no,N,1,,247893,6509,CH
2,,SING,OP3,HOP3,no,N,2,,247893,6509,CH
3,,DOUB,P,OP1,no,N,3,,247893,6509,CH
4,,SING,P,OP2,no,N,4,,247893,6509,CH
5,,SING,P,O5',no,N,5,,247893,6509,CH
6,,SING,OP2,HOP2,no,N,6,,247893,6509,CH
7,,SING,O5',C5',no,N,7,,247893,6509,CH
8,,SING,C5',C4',no,N,8,,247893,6509,CH
9,,SING,C5',H5',no,N,9,,247893,6509,CH
10,,SING,C5',H5'',no,N,10,,247893,6509,CH
11,,SING,C4',O4',no,N,11,,247893,6509,CH
12,,SING,C4',C3',no,N,12,,247893,6509,CH
13,,SING,C4',H4',no,N,13,,247893,6509,CH
14,,SING,O4',C1',no,N,14,,247893,6509,CH
15,,SING,C3',O3',no,N,15,,247893,6509,CH
16,,SING,C3',C2',no,N,16,,247893,6509,CH
17,,SING,C3',H3',no,N,17,,247893,6509,CH
18,,SING,O3',HO3',no,N,18,,247893,6509,CH
19,,SING,C2',O2',no,N,19,,247893,6509,CH
20,,SING,C2',C1',no,N,20,,247893,6509,CH
21,,SING,C2',H2',no,N,21,,247893,6509,CH
22,,SING,O2',HO2',no,N,22,,247893,6509,CH
23,,SING,C1',N1,no,N,23,,247893,6509,CH
24,,SING,C1',H1',no,N,24,,247893,6509,CH
25,,SING,N1,C2,no,N,25,,247893,6509,CH
26,,DOUB,N1,C6,no,N,26,,247893,6509,CH
27,,DOUB,C2,O2,no,N,27,,247893,6509,CH
28,,SING,C2,N3,no,N,28,,247893,6509,CH
29,,SING,N3,C4,no,N,29,,247893,6509,CH
30,,SING,N3,HN3,no,N,30,,247893,6509,CH
31,,SING,C4,N4,no,N,31,,247893,6509,CH
32,,DOUB,C4,C5,no,N,32,,247893,6509,CH
33,,SING,N4,H41,no,N,33,,247893,6509,CH
34,,SING,N4,H42,no,N,34,,247893,6509,CH
35,,SING,C5,C6,no,N,35,,247893,6509,CH
36,,SING,C5,H5,no,N,36,,247893,6509,CH
37,,SING,C6,H6,no,N,37,,247893,6509,CH
1,,SING,O23,P24,no,N,1,,248041,6516,PNS
2,,SING,O23,HOP1,no,N,2,,248041,6516,PNS
3,,SING,P24,O25,no,N,3,,248041,6516,PNS
4,,DOUB,P24,O26,no,N,4,,248041,6516,PNS
5,,SING,P24,O27,no,N,5,,248041,6516,PNS
6,,SING,O25,HOP2,no,N,6,,248041,6516,PNS
7,,SING,O27,C28,no,N,7,,248041,6516,PNS
8,,SING,C28,C29,no,N,8,,248041,6516,PNS
9,,SING,C28,H282,no,N,9,,248041,6516,PNS
10,,SING,C28,H281,no,N,10,,248041,6516,PNS
11,,SING,C29,C30,no,N,11,,248041,6516,PNS
12,,SING,C29,C31,no,N,12,,248041,6516,PNS
13,,SING,C29,C32,no,N,13,,248041,6516,PNS
14,,SING,C30,H303,no,N,14,,248041,6516,PNS
15,,SING,C30,H302,no,N,15,,248041,6516,PNS
16,,SING,C30,H301,no,N,16,,248041,6516,PNS
17,,SING,C31,H313,no,N,17,,248041,6516,PNS
18,,SING,C31,H312,no,N,18,,248041,6516,PNS
19,,SING,C31,H311,no,N,19,,248041,6516,PNS
20,,SING,C32,O33,no,N,20,,248041,6516,PNS
21,,SING,C32,C34,no,N,21,,248041,6516,PNS
22,,SING,C32,H32,no,N,22,,248041,6516,PNS
23,,SING,O33,H33,no,N,23,,248041,6516,PNS
24,,DOUB,C34,O35,no,N,24,,248041,6516,PNS
25,,SING,C34,N36,no,N,25,,248041,6516,PNS
26,,SING,N36,C37,no,N,26,,248041,6516,PNS
27,,SING,N36,H36,no,N,27,,248041,6516,PNS
28,,SING,C37,C38,no,N,28,,248041,6516,PNS
29,,SING,C37,H372,no,N,29,,248041,6516,PNS
30,,SING,C37,H371,no,N,30,,248041,6516,PNS
31,,SING,C38,C39,no,N,31,,248041,6516,PNS
32,,SING,C38,H382,no,N,32,,248041,6516,PNS
33,,SING,C38,H381,no,N,33,,248041,6516,PNS
34,,DOUB,C39,O40,no,N,34,,248041,6516,PNS
35,,SING,C39,N41,no,N,35,,248041,6516,PNS
36,,SING,N41,C42,no,N,36,,248041,6516,PNS
37,,SING,N41,H41,no,N,37,,248041,6516,PNS
38,,SING,C42,C43,no,N,38,,248041,6516,PNS
39,,SING,C42,H422,no,N,39,,248041,6516,PNS
40,,SING,C42,H421,no,N,40,,248041,6516,PNS
41,,SING,C43,S44,no,N,41,,248041,6516,PNS
42,,SING,C43,H431,no,N,42,,248041,6516,PNS
43,,SING,C43,H432,no,N,43,,248041,6516,PNS
44,,SING,S44,H44,no,N,44,,248041,6516,PNS
1,,SING,C1,N23,no,N,1,,248388,6537,NAZ
2,,SING,C1,C32,no,N,2,,248388,6537,NAZ
3,,SING,C1,H36,no,N,3,,248388,6537,NAZ
4,,SING,C1,H37,no,N,4,,248388,6537,NAZ
5,,DOUB,O2,C22,no,N,5,,248388,6537,NAZ
6,,SING,C3,N4,no,N,6,,248388,6537,NAZ
7,,SING,C3,C21,no,N,7,,248388,6537,NAZ
8,,SING,C3,H38,no,N,8,,248388,6537,NAZ
9,,SING,C3,H39,no,N,9,,248388,6537,NAZ
10,,SING,N4,C5,no,N,10,,248388,6537,NAZ
11,,SING,N4,H40,no,N,11,,248388,6537,NAZ
12,,SING,C5,C6,no,N,12,,248388,6537,NAZ
13,,SING,C5,H41,no,N,13,,248388,6537,NAZ
14,,SING,C5,H42,no,N,14,,248388,6537,NAZ
15,,SING,C6,C7,no,N,15,,248388,6537,NAZ
16,,SING,C6,H43,no,N,16,,248388,6537,NAZ
17,,SING,C6,H44,no,N,17,,248388,6537,NAZ
18,,SING,C7,N18,no,N,18,,248388,6537,NAZ
19,,DOUB,C7,O20,no,N,19,,248388,6537,NAZ
20,,SING,C8,C9,yes,N,20,,248388,6537,NAZ
21,,DOUB,C8,N10,yes,N,21,,248388,6537,NAZ
22,,SING,C8,N18,no,N,22,,248388,6537,NAZ
23,,DOUB,C9,C11,yes,N,23,,248388,6537,NAZ
24,,SING,C9,H45,no,N,24,,248388,6537,NAZ
25,,SING,N10,C12,yes,N,25,,248388,6537,NAZ
26,,SING,C11,C13,yes,N,26,,248388,6537,NAZ
27,,SING,C11,H46,no,N,27,,248388,6537,NAZ
28,,SING,C12,C13,yes,N,28,,248388,6537,NAZ
29,,DOUB,C12,N17,yes,N,29,,248388,6537,NAZ
30,,DOUB,C13,C15,yes,N,30,,248388,6537,NAZ
31,,SING,C14,C15,yes,N,31,,248388,6537,NAZ
32,,DOUB,C14,C16,yes,N,32,,248388,6537,NAZ
33,,SING,C14,H47,no,N,33,,248388,6537,NAZ
34,,SING,C15,H48,no,N,34,,248388,6537,NAZ
35,,SING,C16,N17,yes,N,35,,248388,6537,NAZ
36,,SING,C16,C19,no,N,36,,248388,6537,NAZ
37,,SING,N18,H49,no,N,37,,248388,6537,NAZ
38,,SING,C19,H50,no,N,38,,248388,6537,NAZ
39,,SING,C19,H51,no,N,39,,248388,6537,NAZ
40,,SING,C19,H52,no,N,40,,248388,6537,NAZ
41,,SING,C21,C22,no,N,41,,248388,6537,NAZ
42,,SING,C21,H53,no,N,42,,248388,6537,NAZ
43,,SING,C21,H54,no,N,43,,248388,6537,NAZ
44,,SING,C22,N23,no,N,44,,248388,6537,NAZ
45,,SING,N23,H55,no,N,45,,248388,6537,NAZ
46,,SING,C24,C25,yes,N,46,,248388,6537,NAZ
47,,SING,C24,N26,yes,N,47,,248388,6537,NAZ
48,,DOUB,C24,O34,no,N,48,,248388,6537,NAZ
49,,DOUB,C25,C27,yes,N,49,,248388,6537,NAZ
50,,SING,C25,H56,no,N,50,,248388,6537,NAZ
51,,SING,N26,C28,yes,N,51,,248388,6537,NAZ
52,,SING,N26,H35,no,N,52,,248388,6537,NAZ
53,,SING,C27,C29,yes,N,53,,248388,6537,NAZ
54,,SING,C27,H57,no,N,54,,248388,6537,NAZ
55,,SING,C28,C29,yes,N,55,,248388,6537,NAZ
56,,DOUB,C28,N33,yes,N,56,,248388,6537,NAZ
57,,DOUB,C29,C31,yes,N,57,,248388,6537,NAZ
58,,SING,C30,C31,yes,N,58,,248388,6537,NAZ
59,,DOUB,C30,C32,yes,N,59,,248388,6537,NAZ
60,,SING,C30,H58,no,N,60,,248388,6537,NAZ
61,,SING,C31,H59,no,N,61,,248388,6537,NAZ
62,,SING,C32,N33,yes,N,62,,248388,6537,NAZ
1,,SING,N,HN1,no,N,1,,248542,6547,NH2
2,,SING,N,HN2,no,N,2,,248542,6547,NH2
1,,SING,CHA,C1A,yes,N,1,,249044,6572,HEM
2,,DOUB,CHA,C4D,yes,N,2,,249044,6572,HEM
3,,SING,CHA,HHA,no,N,3,,249044,6572,HEM
4,,SING,CHB,C4A,yes,N,4,,249044,6572,HEM
5,,DOUB,CHB,C1B,yes,N,5,,249044,6572,HEM
6,,SING,CHB,HHB,no,N,6,,249044,6572,HEM
7,,SING,CHC,C4B,yes,N,7,,249044,6572,HEM
8,,DOUB,CHC,C1C,yes,N,8,,249044,6572,HEM
9,,SING,CHC,HHC,no,N,9,,249044,6572,HEM
10,,DOUB,CHD,C4C,yes,N,10,,249044,6572,HEM
11,,SING,CHD,C1D,yes,N,11,,249044,6572,HEM
12,,SING,CHD,HHD,no,N,12,,249044,6572,HEM
13,,DOUB,C1A,C2A,yes,N,13,,249044,6572,HEM
14,,SING,C1A,NA,yes,N,14,,249044,6572,HEM
15,,SING,C2A,C3A,yes,N,15,,249044,6572,HEM
16,,SING,C2A,CAA,no,N,16,,249044,6572,HEM
17,,DOUB,C3A,C4A,yes,N,17,,249044,6572,HEM
18,,SING,C3A,CMA,no,N,18,,249044,6572,HEM
19,,SING,C4A,NA,yes,N,19,,249044,6572,HEM
20,,SING,CMA,HMA,no,N,20,,249044,6572,HEM
21,,SING,CMA,HMAA,no,N,21,,249044,6572,HEM
22,,SING,CMA,HMAB,no,N,22,,249044,6572,HEM
23,,SING,CAA,CBA,no,N,23,,249044,6572,HEM
24,,SING,CAA,HAA,no,N,24,,249044,6572,HEM
25,,SING,CAA,HAAA,no,N,25,,249044,6572,HEM
26,,SING,CBA,CGA,no,N,26,,249044,6572,HEM
27,,SING,CBA,HBA,no,N,27,,249044,6572,HEM
28,,SING,CBA,HBAA,no,N,28,,249044,6572,HEM
29,,DOUB,CGA,O1A,no,N,29,,249044,6572,HEM
30,,SING,CGA,O2A,no,N,30,,249044,6572,HEM
31,,SING,C1B,C2B,no,N,31,,249044,6572,HEM
32,,SING,C1B,NB,yes,N,32,,249044,6572,HEM
33,,DOUB,C2B,C3B,yes,N,33,,249044,6572,HEM
34,,SING,C2B,CMB,yes,N,34,,249044,6572,HEM
35,,SING,C3B,C4B,no,N,35,,249044,6572,HEM
36,,SING,C3B,CAB,yes,N,36,,249044,6572,HEM
37,,DOUB,C4B,NB,no,N,37,,249044,6572,HEM
38,,SING,CMB,HMB,yes,N,38,,249044,6572,HEM
39,,SING,CMB,HMBA,no,N,39,,249044,6572,HEM
40,,SING,CMB,HMBB,no,N,40,,249044,6572,HEM
41,,DOUB,CAB,CBB,no,N,41,,249044,6572,HEM
42,,SING,CAB,HAB,no,N,42,,249044,6572,HEM
43,,SING,CBB,HBB,no,N,43,,249044,6572,HEM
44,,SING,CBB,HBBA,no,N,44,,249044,6572,HEM
45,,SING,C1C,C2C,no,N,45,,249044,6572,HEM
46,,SING,C1C,NC,yes,N,46,,249044,6572,HEM
47,,DOUB,C2C,C3C,yes,N,47,,249044,6572,HEM
48,,SING,C2C,CMC,yes,N,48,,249044,6572,HEM
49,,SING,C3C,C4C,no,N,49,,249044,6572,HEM
50,,SING,C3C,CAC,yes,N,50,,249044,6572,HEM
51,,SING,C4C,NC,no,N,51,,249044,6572,HEM
52,,SING,CMC,HMC,yes,N,52,,249044,6572,HEM
53,,SING,CMC,HMCA,no,N,53,,249044,6572,HEM
54,,SING,CMC,HMCB,no,N,54,,249044,6572,HEM
55,,DOUB,CAC,CBC,no,N,55,,249044,6572,HEM
56,,SING,CAC,HAC,no,N,56,,249044,6572,HEM
57,,SING,CBC,HBC,no,N,57,,249044,6572,HEM
58,,SING,CBC,HBCA,no,N,58,,249044,6572,HEM
59,,SING,C1D,C2D,no,N,59,,249044,6572,HEM
60,,DOUB,C1D,ND,yes,N,60,,249044,6572,HEM
61,,DOUB,C2D,C3D,yes,N,61,,249044,6572,HEM
62,,SING,C2D,CMD,yes,N,62,,249044,6572,HEM
63,,SING,C3D,C4D,no,N,63,,249044,6572,HEM
64,,SING,C3D,CAD,yes,N,64,,249044,6572,HEM
65,,SING,C4D,ND,no,N,65,,249044,6572,HEM
66,,SING,CMD,HMD,yes,N,66,,249044,6572,HEM
67,,SING,CMD,HMDA,no,N,67,,249044,6572,HEM
68,,SING,CMD,HMDB,no,N,68,,249044,6572,HEM
69,,SING,CAD,CBD,no,N,69,,249044,6572,HEM
70,,SING,CAD,HAD,no,N,70,,249044,6572,HEM
71,,SING,CAD,HADA,no,N,71,,249044,6572,HEM
72,,SING,CBD,CGD,no,N,72,,249044,6572,HEM
73,,SING,CBD,HBD,no,N,73,,249044,6572,HEM
74,,SING,CBD,HBDA,no,N,74,,249044,6572,HEM
75,,DOUB,CGD,O1D,no,N,75,,249044,6572,HEM
76,,SING,CGD,O2D,no,N,76,,249044,6572,HEM
77,,SING,O2A,H2A,no,N,77,,249044,6572,HEM
78,,SING,O2D,H2D,no,N,78,,249044,6572,HEM
79,,SING,FE,NA,no,N,79,,249044,6572,HEM
80,,SING,FE,NB,no,N,80,,249044,6572,HEM
81,,SING,FE,NC,no,N,81,,249044,6572,HEM
82,,SING,FE,ND,no,N,82,,249044,6572,HEM
1,,SING,N,CA,no,N,1,,249212,6580,PTR
2,,SING,N,H,no,N,2,,249212,6580,PTR
3,,SING,N,HN2,no,N,3,,249212,6580,PTR
4,,SING,CA,C,no,N,4,,249212,6580,PTR
5,,SING,CA,CB,no,N,5,,249212,6580,PTR
6,,SING,CA,HA,no,N,6,,249212,6580,PTR
7,,DOUB,C,O,no,N,7,,249212,6580,PTR
8,,SING,C,OXT,no,N,8,,249212,6580,PTR
9,,SING,OXT,HXT,no,N,9,,249212,6580,PTR
10,,SING,CB,CG,no,N,10,,249212,6580,PTR
11,,SING,CB,HB2,no,N,11,,249212,6580,PTR
12,,SING,CB,HB3,no,N,12,,249212,6580,PTR
13,,DOUB,CG,CD1,yes,N,13,,249212,6580,PTR
14,,SING,CG,CD2,yes,N,14,,249212,6580,PTR
15,,SING,CD1,CE1,yes,N,15,,249212,6580,PTR
16,,SING,CD1,HD1,no,N,16,,249212,6580,PTR
17,,DOUB,CD2,CE2,yes,N,17,,249212,6580,PTR
18,,SING,CD2,HD2,no,N,18,,249212,6580,PTR
19,,DOUB,CE1,CZ,yes,N,19,,249212,6580,PTR
20,,SING,CE1,HE1,no,N,20,,249212,6580,PTR
21,,SING,CE2,CZ,yes,N,21,,249212,6580,PTR
22,,SING,CE2,HE2,no,N,22,,249212,6580,PTR
23,,SING,CZ,OH,no,N,23,,249212,6580,PTR
24,,SING,OH,P,no,N,24,,249212,6580,PTR
25,,DOUB,P,O1P,no,N,25,,249212,6580,PTR
26,,SING,P,O2P,no,N,26,,249212,6580,PTR
27,,SING,P,O3P,no,N,27,,249212,6580,PTR
28,,SING,O2P,HO2P,no,N,28,,249212,6580,PTR
29,,SING,O3P,HO3P,no,N,29,,249212,6580,PTR
1,,DOUB,C,O,no,N,1,,249233,6581,ACE
2,,SING,C,CH3,no,N,2,,249233,6581,ACE
3,,SING,C,H,no,N,3,,249233,6581,ACE
4,,SING,CH3,H1,no,N,4,,249233,6581,ACE
5,,SING,CH3,H2,no,N,5,,249233,6581,ACE
6,,SING,CH3,H3,no,N,6,,249233,6581,ACE
1,,SING,N,HN1,no,N,1,,249234,6581,NH2
2,,SING,N,HN2,no,N,2,,249234,6581,NH2
1,,SING,N,CA,no,N,1,,249441,6591,PFF
2,,SING,N,H,no,N,2,,249441,6591,PFF
3,,SING,N,H2,no,N,3,,249441,6591,PFF
4,,SING,CA,C,no,N,4,,249441,6591,PFF
5,,SING,CA,CB,no,N,5,,249441,6591,PFF
6,,SING,CA,HA,no,N,6,,249441,6591,PFF
7,,DOUB,C,O,no,N,7,,249441,6591,PFF
8,,SING,C,OXT,no,N,8,,249441,6591,PFF
9,,SING,OXT,HXT,no,N,9,,249441,6591,PFF
10,,SING,CB,CG,no,N,10,,249441,6591,PFF
11,,SING,CB,HB2,no,N,11,,249441,6591,PFF
12,,SING,CB,HB3,no,N,12,,249441,6591,PFF
13,,DOUB,CG,CD1,yes,N,13,,249441,6591,PFF
14,,SING,CG,CD2,yes,N,14,,249441,6591,PFF
15,,SING,CD1,CE1,yes,N,15,,249441,6591,PFF
16,,SING,CD1,HD1,no,N,16,,249441,6591,PFF
17,,DOUB,CD2,CE2,yes,N,17,,249441,6591,PFF
18,,SING,CD2,HD2,no,N,18,,249441,6591,PFF
19,,DOUB,CE1,CZ,yes,N,19,,249441,6591,PFF
20,,SING,CE1,HE1,no,N,20,,249441,6591,PFF
21,,SING,CE2,CZ,yes,N,21,,249441,6591,PFF
22,,SING,CE2,HE2,no,N,22,,249441,6591,PFF
23,,SING,CZ,F,no,N,23,,249441,6591,PFF
1,,SING,C11,C21,no,N,1,,249442,6591,CTO
2,,SING,C11,O51,no,N,2,,249442,6591,CTO
3,,SING,C11,O42,no,N,3,,249442,6591,CTO
4,,SING,C11,H11,no,N,4,,249442,6591,CTO
5,,SING,C21,N21,no,N,5,,249442,6591,CTO
6,,SING,C21,C31,no,N,6,,249442,6591,CTO
7,,SING,C21,H21,no,N,7,,249442,6591,CTO
8,,SING,N21,C71,no,N,8,,249442,6591,CTO
9,,SING,N21,HNL,no,N,9,,249442,6591,CTO
10,,DOUB,C71,O71,no,N,10,,249442,6591,CTO
11,,SING,C71,C81,no,N,11,,249442,6591,CTO
12,,SING,C81,H811,no,N,12,,249442,6591,CTO
13,,SING,C81,H812,no,N,13,,249442,6591,CTO
14,,SING,C81,H813,no,N,14,,249442,6591,CTO
15,,SING,C31,O31,no,N,15,,249442,6591,CTO
16,,SING,C31,C41,no,N,16,,249442,6591,CTO
17,,SING,C31,H31,no,N,17,,249442,6591,CTO
18,,SING,O31,HOV,no,N,18,,249442,6591,CTO
19,,SING,C41,O41,no,N,19,,249442,6591,CTO
20,,SING,C41,C51,no,N,20,,249442,6591,CTO
21,,SING,C41,H41,no,N,21,,249442,6591,CTO
22,,SING,O41,HO4,no,N,22,,249442,6591,CTO
23,,SING,C51,O51,no,N,23,,249442,6591,CTO
24,,SING,C51,C61,no,N,24,,249442,6591,CTO
25,,SING,C51,H51,no,N,25,,249442,6591,CTO
26,,SING,C61,O61,no,N,26,,249442,6591,CTO
27,,SING,C61,H611,no,N,27,,249442,6591,CTO
28,,SING,C61,H612,no,N,28,,249442,6591,CTO
29,,SING,O61,HO6,no,N,29,,249442,6591,CTO
30,,SING,C12,C22,no,N,30,,249442,6591,CTO
31,,SING,C12,O52,no,N,31,,249442,6591,CTO
32,,SING,C12,O43,no,N,32,,249442,6591,CTO
33,,SING,C12,H12,no,N,33,,249442,6591,CTO
34,,SING,C22,N22,no,N,34,,249442,6591,CTO
35,,SING,C22,C32,no,N,35,,249442,6591,CTO
36,,SING,C22,H22,no,N,36,,249442,6591,CTO
37,,SING,N22,C72,no,N,37,,249442,6591,CTO
38,,SING,N22,HNM,no,N,38,,249442,6591,CTO
39,,DOUB,C72,O72,no,N,39,,249442,6591,CTO
40,,SING,C72,C82,no,N,40,,249442,6591,CTO
41,,SING,C82,H821,no,N,41,,249442,6591,CTO
42,,SING,C82,H822,no,N,42,,249442,6591,CTO
43,,SING,C82,H823,no,N,43,,249442,6591,CTO
44,,SING,C32,O32,no,N,44,,249442,6591,CTO
45,,SING,C32,C42,no,N,45,,249442,6591,CTO
46,,SING,C32,H32,no,N,46,,249442,6591,CTO
47,,SING,O32,HOW,no,N,47,,249442,6591,CTO
48,,SING,C42,O42,no,N,48,,249442,6591,CTO
49,,SING,C42,C52,no,N,49,,249442,6591,CTO
50,,SING,C42,H42,no,N,50,,249442,6591,CTO
51,,SING,C52,O52,no,N,51,,249442,6591,CTO
52,,SING,C52,C62,no,N,52,,249442,6591,CTO
53,,SING,C52,H52,no,N,53,,249442,6591,CTO
54,,SING,C62,O62,no,N,54,,249442,6591,CTO
55,,SING,C62,H621,no,N,55,,249442,6591,CTO
56,,SING,C62,H622,no,N,56,,249442,6591,CTO
57,,SING,O62,HO2,no,N,57,,249442,6591,CTO
58,,SING,C13,O13,no,N,58,,249442,6591,CTO
59,,SING,C13,C23,no,N,59,,249442,6591,CTO
60,,SING,C13,O53,no,N,60,,249442,6591,CTO
61,,SING,C13,H13,no,N,61,,249442,6591,CTO
62,,SING,O13,HOD,no,N,62,,249442,6591,CTO
63,,SING,C23,N23,no,N,63,,249442,6591,CTO
64,,SING,C23,C33,no,N,64,,249442,6591,CTO
65,,SING,C23,H23,no,N,65,,249442,6591,CTO
66,,SING,N23,C73,no,N,66,,249442,6591,CTO
67,,SING,N23,HNN,no,N,67,,249442,6591,CTO
68,,DOUB,C73,O73,no,N,68,,249442,6591,CTO
69,,SING,C73,C83,no,N,69,,249442,6591,CTO
70,,SING,C83,H831,no,N,70,,249442,6591,CTO
71,,SING,C83,H832,no,N,71,,249442,6591,CTO
72,,SING,C83,H833,no,N,72,,249442,6591,CTO
73,,SING,C33,O33,no,N,73,,249442,6591,CTO
74,,SING,C33,C43,no,N,74,,249442,6591,CTO
75,,SING,C33,H33,no,N,75,,249442,6591,CTO
76,,SING,O33,HOX,no,N,76,,249442,6591,CTO
77,,SING,C43,O43,no,N,77,,249442,6591,CTO
78,,SING,C43,C53,no,N,78,,249442,6591,CTO
79,,SING,C43,H43,no,N,79,,249442,6591,CTO
80,,SING,C53,O53,no,N,80,,249442,6591,CTO
81,,SING,C53,C63,no,N,81,,249442,6591,CTO
82,,SING,C53,H53,no,N,82,,249442,6591,CTO
83,,SING,C63,O63,no,N,83,,249442,6591,CTO
84,,SING,C63,H631,no,N,84,,249442,6591,CTO
85,,SING,C63,H632,no,N,85,,249442,6591,CTO
86,,SING,O63,HO3,no,N,86,,249442,6591,CTO
1,,SING,C11,O11,,,,,249582,6599,BTI
2,,SING,C11,C10,,,,,249582,6599,BTI
3,,SING,C10,C9,,,,,249582,6599,BTI
4,,SING,C10,H102,,,,,249582,6599,BTI
5,,SING,C10,H103,,,,,249582,6599,BTI
6,,SING,C9,C8,,,,,249582,6599,BTI
7,,SING,C9,H92,,,,,249582,6599,BTI
8,,SING,C9,H93,,,,,249582,6599,BTI
9,,SING,C8,C7,,,,,249582,6599,BTI
10,,SING,C8,H82,,,,,249582,6599,BTI
11,,SING,C8,H83,,,,,249582,6599,BTI
12,,SING,C7,C2,,,,,249582,6599,BTI
13,,SING,C7,H72,,,,,249582,6599,BTI
14,,SING,C7,H73,,,,,249582,6599,BTI
15,,SING,C2,S1,,,,,249582,6599,BTI
16,,SING,C2,C4,,,,,249582,6599,BTI
17,,SING,C2,H2,,,,,249582,6599,BTI
18,,SING,S1,C6,,,,,249582,6599,BTI
19,,SING,C6,C5,,,,,249582,6599,BTI
20,,SING,C6,H62,,,,,249582,6599,BTI
21,,SING,C6,H63,,,,,249582,6599,BTI
22,,SING,C5,N3,,,,,249582,6599,BTI
23,,SING,C5,C4,,,,,249582,6599,BTI
24,,SING,C5,H5,,,,,249582,6599,BTI
25,,SING,N3,C3,,,,,249582,6599,BTI
26,,SING,N3,HN3,,,,,249582,6599,BTI
27,,SING,C3,O3,,,,,249582,6599,BTI
28,,SING,C3,N2,,,,,249582,6599,BTI
29,,SING,N2,C4,,,,,249582,6599,BTI
30,,SING,N2,HN2,,,,,249582,6599,BTI
31,,SING,C4,H4,,,,,249582,6599,BTI
1,,DOUB,P,O1P,no,N,1,,249668,6602,35G
2,,SING,P,O2P,no,N,2,,249668,6602,35G
3,,SING,P,O5',no,N,3,,249668,6602,35G
4,,SING,P,O3',no,N,4,,249668,6602,35G
5,,SING,O2P,HOP2,no,N,5,,249668,6602,35G
6,,SING,O5',C5',no,N,6,,249668,6602,35G
7,,SING,C5',C4',no,N,7,,249668,6602,35G
8,,SING,C5',H5'1,no,N,8,,249668,6602,35G
9,,SING,C5',H5'2,no,N,9,,249668,6602,35G
10,,SING,C4',O4',no,N,10,,249668,6602,35G
11,,SING,C4',C3',no,N,11,,249668,6602,35G
12,,SING,C4',H4',no,N,12,,249668,6602,35G
13,,SING,O4',C1',no,N,13,,249668,6602,35G
14,,SING,C3',O3',no,N,14,,249668,6602,35G
15,,SING,C3',C2',no,N,15,,249668,6602,35G
16,,SING,C3',H3',no,N,16,,249668,6602,35G
17,,SING,C2',O2',no,N,17,,249668,6602,35G
18,,SING,C2',C1',no,N,18,,249668,6602,35G
19,,SING,C2',H2',no,N,19,,249668,6602,35G
20,,SING,O2',HO2',no,N,20,,249668,6602,35G
21,,SING,C1',N9,no,N,21,,249668,6602,35G
22,,SING,C1',H1',no,N,22,,249668,6602,35G
23,,SING,N9,C8,yes,N,23,,249668,6602,35G
24,,SING,N9,C4,yes,N,24,,249668,6602,35G
25,,DOUB,C8,N7,yes,N,25,,249668,6602,35G
26,,SING,C8,H8,no,N,26,,249668,6602,35G
27,,SING,N7,C5,yes,N,27,,249668,6602,35G
28,,SING,C5,C6,no,N,28,,249668,6602,35G
29,,DOUB,C5,C4,yes,N,29,,249668,6602,35G
30,,DOUB,C6,O6,no,N,30,,249668,6602,35G
31,,SING,C6,N1,no,N,31,,249668,6602,35G
32,,SING,N1,C2,no,N,32,,249668,6602,35G
33,,SING,N1,HN1,no,N,33,,249668,6602,35G
34,,SING,C2,N2,no,N,34,,249668,6602,35G
35,,DOUB,C2,N3,no,N,35,,249668,6602,35G
36,,SING,N2,HN21,no,N,36,,249668,6602,35G
37,,SING,N2,HN22,no,N,37,,249668,6602,35G
38,,SING,N3,C4,no,N,38,,249668,6602,35G
1,,SING,N,CA,no,N,1,,249704,6604,PTR
2,,SING,N,H,no,N,2,,249704,6604,PTR
3,,SING,N,HN2,no,N,3,,249704,6604,PTR
4,,SING,CA,C,no,N,4,,249704,6604,PTR
5,,SING,CA,CB,no,N,5,,249704,6604,PTR
6,,SING,CA,HA,no,N,6,,249704,6604,PTR
7,,DOUB,C,O,no,N,7,,249704,6604,PTR
8,,SING,C,OXT,no,N,8,,249704,6604,PTR
9,,SING,OXT,HXT,no,N,9,,249704,6604,PTR
10,,SING,CB,CG,no,N,10,,249704,6604,PTR
11,,SING,CB,HB2,no,N,11,,249704,6604,PTR
12,,SING,CB,HB3,no,N,12,,249704,6604,PTR
13,,DOUB,CG,CD1,yes,N,13,,249704,6604,PTR
14,,SING,CG,CD2,yes,N,14,,249704,6604,PTR
15,,SING,CD1,CE1,yes,N,15,,249704,6604,PTR
16,,SING,CD1,HD1,no,N,16,,249704,6604,PTR
17,,DOUB,CD2,CE2,yes,N,17,,249704,6604,PTR
18,,SING,CD2,HD2,no,N,18,,249704,6604,PTR
19,,DOUB,CE1,CZ,yes,N,19,,249704,6604,PTR
20,,SING,CE1,HE1,no,N,20,,249704,6604,PTR
21,,SING,CE2,CZ,yes,N,21,,249704,6604,PTR
22,,SING,CE2,HE2,no,N,22,,249704,6604,PTR
23,,SING,CZ,OH,no,N,23,,249704,6604,PTR
24,,SING,OH,P,no,N,24,,249704,6604,PTR
25,,DOUB,P,O1P,no,N,25,,249704,6604,PTR
26,,SING,P,O2P,no,N,26,,249704,6604,PTR
27,,SING,P,O3P,no,N,27,,249704,6604,PTR
28,,SING,O2P,HO2P,no,N,28,,249704,6604,PTR
29,,SING,O3P,HO3P,no,N,29,,249704,6604,PTR
1,,SING,N,CA,no,N,1,,249724,6605,SMC
2,,SING,N,H,no,N,2,,249724,6605,SMC
3,,SING,N,H2,no,N,3,,249724,6605,SMC
4,,SING,CA,CB,no,N,4,,249724,6605,SMC
5,,SING,CA,C,no,N,5,,249724,6605,SMC
6,,SING,CA,HA,no,N,6,,249724,6605,SMC
7,,SING,CB,SG,no,N,7,,249724,6605,SMC
8,,SING,CB,HB2,no,N,8,,249724,6605,SMC
9,,SING,CB,HB3,no,N,9,,249724,6605,SMC
10,,SING,SG,CS,no,N,10,,249724,6605,SMC
11,,SING,CS,HCS1,no,N,11,,249724,6605,SMC
12,,SING,CS,HCS2,no,N,12,,249724,6605,SMC
13,,SING,CS,HCS3,no,N,13,,249724,6605,SMC
14,,DOUB,C,O,no,N,14,,249724,6605,SMC
15,,SING,C,OXT,no,N,15,,249724,6605,SMC
16,,SING,OXT,HXT,no,N,16,,249724,6605,SMC
1,,SING,N,CA,no,N,1,,249775,6608,AAR
2,,SING,N,H,no,N,2,,249775,6608,AAR
3,,SING,N,H2,no,N,3,,249775,6608,AAR
4,,SING,CA,CB,no,N,4,,249775,6608,AAR
5,,SING,CA,C,no,N,5,,249775,6608,AAR
6,,SING,CA,HA,no,N,6,,249775,6608,AAR
7,,SING,CB,CG,no,N,7,,249775,6608,AAR
8,,SING,CB,HB2,no,N,8,,249775,6608,AAR
9,,SING,CB,HB3,no,N,9,,249775,6608,AAR
10,,SING,CG,CD,no,N,10,,249775,6608,AAR
11,,SING,CG,HG2,no,N,11,,249775,6608,AAR
12,,SING,CG,HG3,no,N,12,,249775,6608,AAR
13,,SING,CD,NE,no,N,13,,249775,6608,AAR
14,,SING,CD,HD2,no,N,14,,249775,6608,AAR
15,,SING,CD,HD3,no,N,15,,249775,6608,AAR
16,,SING,NE,CZ,no,N,16,,249775,6608,AAR
17,,SING,NE,HE,no,N,17,,249775,6608,AAR
18,,SING,CZ,NH1,no,N,18,,249775,6608,AAR
19,,DOUB,CZ,NH2,no,N,19,,249775,6608,AAR
20,,SING,NH1,HH11,no,N,20,,249775,6608,AAR
21,,SING,NH1,HH12,no,N,21,,249775,6608,AAR
22,,SING,NH2,HH21,no,N,22,,249775,6608,AAR
23,,SING,NH2,HH22,no,N,23,,249775,6608,AAR
24,,DOUB,C,O,no,N,24,,249775,6608,AAR
25,,SING,C,NT,no,N,25,,249775,6608,AAR
26,,SING,NT,HNT1,no,N,26,,249775,6608,AAR
27,,SING,NT,HNT2,no,N,27,,249775,6608,AAR
1,,SING,N,CA,no,N,1,,250036,6622,SMC
2,,SING,N,H,no,N,2,,250036,6622,SMC
3,,SING,N,H2,no,N,3,,250036,6622,SMC
4,,SING,CA,CB,no,N,4,,250036,6622,SMC
5,,SING,CA,C,no,N,5,,250036,6622,SMC
6,,SING,CA,HA,no,N,6,,250036,6622,SMC
7,,SING,CB,SG,no,N,7,,250036,6622,SMC
8,,SING,CB,HB2,no,N,8,,250036,6622,SMC
9,,SING,CB,HB3,no,N,9,,250036,6622,SMC
10,,SING,SG,CS,no,N,10,,250036,6622,SMC
11,,SING,CS,HCS1,no,N,11,,250036,6622,SMC
12,,SING,CS,HCS2,no,N,12,,250036,6622,SMC
13,,SING,CS,HCS3,no,N,13,,250036,6622,SMC
14,,DOUB,C,O,no,N,14,,250036,6622,SMC
15,,SING,C,OXT,no,N,15,,250036,6622,SMC
16,,SING,OXT,HXT,no,N,16,,250036,6622,SMC
1,,SING,FE,NA,no,N,1,,250230,6634,HEC
2,,SING,FE,NB,no,N,2,,250230,6634,HEC
3,,SING,FE,NC,no,N,3,,250230,6634,HEC
4,,SING,FE,ND,no,N,4,,250230,6634,HEC
5,,DOUB,CHA,C1A,no,N,5,,250230,6634,HEC
6,,SING,CHA,C4D,no,N,6,,250230,6634,HEC
7,,SING,CHA,HHA,no,N,7,,250230,6634,HEC
8,,DOUB,CHB,C4A,no,N,8,,250230,6634,HEC
9,,SING,CHB,C1B,no,N,9,,250230,6634,HEC
10,,SING,CHB,HHB,no,N,10,,250230,6634,HEC
11,,DOUB,CHC,C4B,no,N,11,,250230,6634,HEC
12,,SING,CHC,C1C,no,N,12,,250230,6634,HEC
13,,SING,CHC,HHC,no,N,13,,250230,6634,HEC
14,,DOUB,CHD,C4C,no,N,14,,250230,6634,HEC
15,,SING,CHD,C1D,no,N,15,,250230,6634,HEC
16,,SING,CHD,HHD,no,N,16,,250230,6634,HEC
17,,SING,NA,C1A,yes,N,17,,250230,6634,HEC
18,,SING,NA,C4A,yes,N,18,,250230,6634,HEC
19,,SING,C1A,C2A,yes,N,19,,250230,6634,HEC
20,,DOUB,C2A,C3A,yes,N,20,,250230,6634,HEC
21,,SING,C2A,CAA,no,N,21,,250230,6634,HEC
22,,SING,C3A,C4A,yes,N,22,,250230,6634,HEC
23,,SING,C3A,CMA,no,N,23,,250230,6634,HEC
24,,SING,CMA,HMA1,no,N,24,,250230,6634,HEC
25,,SING,CMA,HMA2,no,N,25,,250230,6634,HEC
26,,SING,CMA,HMA3,no,N,26,,250230,6634,HEC
27,,SING,CAA,CBA,no,N,27,,250230,6634,HEC
28,,SING,CAA,HAA1,no,N,28,,250230,6634,HEC
29,,SING,CAA,HAA2,no,N,29,,250230,6634,HEC
30,,SING,CBA,CGA,no,N,30,,250230,6634,HEC
31,,SING,CBA,HBA1,no,N,31,,250230,6634,HEC
32,,SING,CBA,HBA2,no,N,32,,250230,6634,HEC
33,,DOUB,CGA,O1A,no,N,33,,250230,6634,HEC
34,,SING,CGA,O2A,no,N,34,,250230,6634,HEC
35,,SING,O2A,H2A,no,N,35,,250230,6634,HEC
36,,SING,NB,C1B,yes,N,36,,250230,6634,HEC
37,,SING,NB,C4B,yes,N,37,,250230,6634,HEC
38,,DOUB,C1B,C2B,yes,N,38,,250230,6634,HEC
39,,SING,C2B,C3B,yes,N,39,,250230,6634,HEC
40,,SING,C2B,CMB,no,N,40,,250230,6634,HEC
41,,SING,C3B,C4B,yes,N,41,,250230,6634,HEC
42,,DOUB,C3B,CAB,no,E,42,,250230,6634,HEC
43,,SING,CMB,HMB1,no,N,43,,250230,6634,HEC
44,,SING,CMB,HMB2,no,N,44,,250230,6634,HEC
45,,SING,CMB,HMB3,no,N,45,,250230,6634,HEC
46,,SING,CAB,CBB,no,N,46,,250230,6634,HEC
47,,SING,CAB,HAB,no,N,47,,250230,6634,HEC
48,,SING,CBB,HBB1,no,N,48,,250230,6634,HEC
49,,SING,CBB,HBB2,no,N,49,,250230,6634,HEC
50,,SING,CBB,HBB3,no,N,50,,250230,6634,HEC
51,,SING,NC,C1C,yes,N,51,,250230,6634,HEC
52,,SING,NC,C4C,yes,N,52,,250230,6634,HEC
53,,DOUB,C1C,C2C,yes,N,53,,250230,6634,HEC
54,,SING,C2C,C3C,yes,N,54,,250230,6634,HEC
55,,SING,C2C,CMC,no,N,55,,250230,6634,HEC
56,,SING,C3C,C4C,yes,N,56,,250230,6634,HEC
57,,DOUB,C3C,CAC,no,E,57,,250230,6634,HEC
58,,SING,CMC,HMC1,no,N,58,,250230,6634,HEC
59,,SING,CMC,HMC2,no,N,59,,250230,6634,HEC
60,,SING,CMC,HMC3,no,N,60,,250230,6634,HEC
61,,SING,CAC,CBC,no,N,61,,250230,6634,HEC
62,,SING,CAC,HAC,no,N,62,,250230,6634,HEC
63,,SING,CBC,HBC1,no,N,63,,250230,6634,HEC
64,,SING,CBC,HBC2,no,N,64,,250230,6634,HEC
65,,SING,CBC,HBC3,no,N,65,,250230,6634,HEC
66,,SING,ND,C1D,yes,N,66,,250230,6634,HEC
67,,SING,ND,C4D,yes,N,67,,250230,6634,HEC
68,,DOUB,C1D,C2D,yes,N,68,,250230,6634,HEC
69,,SING,C2D,C3D,yes,N,69,,250230,6634,HEC
70,,SING,C2D,CMD,no,N,70,,250230,6634,HEC
71,,DOUB,C3D,C4D,yes,N,71,,250230,6634,HEC
72,,SING,C3D,CAD,no,N,72,,250230,6634,HEC
73,,SING,CMD,HMD1,no,N,73,,250230,6634,HEC
74,,SING,CMD,HMD2,no,N,74,,250230,6634,HEC
75,,SING,CMD,HMD3,no,N,75,,250230,6634,HEC
76,,SING,CAD,CBD,no,N,76,,250230,6634,HEC
77,,SING,CAD,HAD1,no,N,77,,250230,6634,HEC
78,,SING,CAD,HAD2,no,N,78,,250230,6634,HEC
79,,SING,CBD,CGD,no,N,79,,250230,6634,HEC
80,,SING,CBD,HBD1,no,N,80,,250230,6634,HEC
81,,SING,CBD,HBD2,no,N,81,,250230,6634,HEC
82,,DOUB,CGD,O1D,no,N,82,,250230,6634,HEC
83,,SING,CGD,O2D,no,N,83,,250230,6634,HEC
84,,SING,O2D,H2D,no,N,84,,250230,6634,HEC
1,,SING,N,CA,no,N,1,,250272,6636,HSL
2,,SING,N,H,no,N,2,,250272,6636,HSL
3,,SING,N,H2,no,N,3,,250272,6636,HSL
4,,SING,CA,C,no,N,4,,250272,6636,HSL
5,,SING,CA,CB,no,N,5,,250272,6636,HSL
6,,SING,CA,HA,no,N,6,,250272,6636,HSL
7,,DOUB,C,O,no,N,7,,250272,6636,HSL
8,,SING,C,OD,no,N,8,,250272,6636,HSL
9,,SING,CB,CG,no,N,9,,250272,6636,HSL
10,,SING,CB,HB2,no,N,10,,250272,6636,HSL
11,,SING,CB,HB3,no,N,11,,250272,6636,HSL
12,,SING,CG,OD,no,N,12,,250272,6636,HSL
13,,SING,CG,HG2,no,N,13,,250272,6636,HSL
14,,SING,CG,HG3,no,N,14,,250272,6636,HSL
1,,DOUB,C6,C5,yes,N,1,,250297,6637,NAL
2,,SING,C6,C7,yes,N,2,,250297,6637,NAL
3,,SING,C5,C4A,yes,N,3,,250297,6637,NAL
4,,DOUB,C7,C8,yes,N,4,,250297,6637,NAL
5,,DOUB,C4A,C4,yes,N,5,,250297,6637,NAL
6,,SING,C4A,C8A,yes,N,6,,250297,6637,NAL
7,,SING,C8,C8A,yes,N,7,,250297,6637,NAL
8,,SING,C4,C3,yes,N,8,,250297,6637,NAL
9,,DOUB,C8A,C1,yes,N,9,,250297,6637,NAL
10,,DOUB,C3,C2,yes,N,10,,250297,6637,NAL
11,,SING,C1,C2,yes,N,11,,250297,6637,NAL
12,,SING,C2,C9,no,N,12,,250297,6637,NAL
13,,SING,C9,CA,no,N,13,,250297,6637,NAL
14,,SING,CA,N,no,N,14,,250297,6637,NAL
15,,SING,CA,C,no,N,15,,250297,6637,NAL
16,,DOUB,C,O,no,N,16,,250297,6637,NAL
17,,SING,C,OXT,no,N,17,,250297,6637,NAL
18,,SING,C1,H1,no,N,18,,250297,6637,NAL
19,,SING,C3,H3,no,N,19,,250297,6637,NAL
20,,SING,C4,H4,no,N,20,,250297,6637,NAL
21,,SING,C5,H5,no,N,21,,250297,6637,NAL
22,,SING,C6,H6,no,N,22,,250297,6637,NAL
23,,SING,C7,H7,no,N,23,,250297,6637,NAL
24,,SING,C8,H8,no,N,24,,250297,6637,NAL
25,,SING,C9,H91,no,N,25,,250297,6637,NAL
26,,SING,C9,H92,no,N,26,,250297,6637,NAL
27,,SING,CA,HA,no,N,27,,250297,6637,NAL
28,,SING,N,H,no,N,28,,250297,6637,NAL
29,,SING,N,H2,no,N,29,,250297,6637,NAL
30,,SING,OXT,HXT,no,N,30,,250297,6637,NAL
1,,SING,C11,C21,no,N,1,,250298,6637,CTO
2,,SING,C11,O51,no,N,2,,250298,6637,CTO
3,,SING,C11,O42,no,N,3,,250298,6637,CTO
4,,SING,C11,H11,no,N,4,,250298,6637,CTO
5,,SING,C21,N21,no,N,5,,250298,6637,CTO
6,,SING,C21,C31,no,N,6,,250298,6637,CTO
7,,SING,C21,H21,no,N,7,,250298,6637,CTO
8,,SING,N21,C71,no,N,8,,250298,6637,CTO
9,,SING,N21,HNL,no,N,9,,250298,6637,CTO
10,,DOUB,C71,O71,no,N,10,,250298,6637,CTO
11,,SING,C71,C81,no,N,11,,250298,6637,CTO
12,,SING,C81,H811,no,N,12,,250298,6637,CTO
13,,SING,C81,H812,no,N,13,,250298,6637,CTO
14,,SING,C81,H813,no,N,14,,250298,6637,CTO
15,,SING,C31,O31,no,N,15,,250298,6637,CTO
16,,SING,C31,C41,no,N,16,,250298,6637,CTO
17,,SING,C31,H31,no,N,17,,250298,6637,CTO
18,,SING,O31,HOV,no,N,18,,250298,6637,CTO
19,,SING,C41,O41,no,N,19,,250298,6637,CTO
20,,SING,C41,C51,no,N,20,,250298,6637,CTO
21,,SING,C41,H41,no,N,21,,250298,6637,CTO
22,,SING,O41,HO4,no,N,22,,250298,6637,CTO
23,,SING,C51,O51,no,N,23,,250298,6637,CTO
24,,SING,C51,C61,no,N,24,,250298,6637,CTO
25,,SING,C51,H51,no,N,25,,250298,6637,CTO
26,,SING,C61,O61,no,N,26,,250298,6637,CTO
27,,SING,C61,H611,no,N,27,,250298,6637,CTO
28,,SING,C61,H612,no,N,28,,250298,6637,CTO
29,,SING,O61,HO6,no,N,29,,250298,6637,CTO
30,,SING,C12,C22,no,N,30,,250298,6637,CTO
31,,SING,C12,O52,no,N,31,,250298,6637,CTO
32,,SING,C12,O43,no,N,32,,250298,6637,CTO
33,,SING,C12,H12,no,N,33,,250298,6637,CTO
34,,SING,C22,N22,no,N,34,,250298,6637,CTO
35,,SING,C22,C32,no,N,35,,250298,6637,CTO
36,,SING,C22,H22,no,N,36,,250298,6637,CTO
37,,SING,N22,C72,no,N,37,,250298,6637,CTO
38,,SING,N22,HNM,no,N,38,,250298,6637,CTO
39,,DOUB,C72,O72,no,N,39,,250298,6637,CTO
40,,SING,C72,C82,no,N,40,,250298,6637,CTO
41,,SING,C82,H821,no,N,41,,250298,6637,CTO
42,,SING,C82,H822,no,N,42,,250298,6637,CTO
43,,SING,C82,H823,no,N,43,,250298,6637,CTO
44,,SING,C32,O32,no,N,44,,250298,6637,CTO
45,,SING,C32,C42,no,N,45,,250298,6637,CTO
46,,SING,C32,H32,no,N,46,,250298,6637,CTO
47,,SING,O32,HOW,no,N,47,,250298,6637,CTO
48,,SING,C42,O42,no,N,48,,250298,6637,CTO
49,,SING,C42,C52,no,N,49,,250298,6637,CTO
50,,SING,C42,H42,no,N,50,,250298,6637,CTO
51,,SING,C52,O52,no,N,51,,250298,6637,CTO
52,,SING,C52,C62,no,N,52,,250298,6637,CTO
53,,SING,C52,H52,no,N,53,,250298,6637,CTO
54,,SING,C62,O62,no,N,54,,250298,6637,CTO
55,,SING,C62,H621,no,N,55,,250298,6637,CTO
56,,SING,C62,H622,no,N,56,,250298,6637,CTO
57,,SING,O62,HO2,no,N,57,,250298,6637,CTO
58,,SING,C13,O13,no,N,58,,250298,6637,CTO
59,,SING,C13,C23,no,N,59,,250298,6637,CTO
60,,SING,C13,O53,no,N,60,,250298,6637,CTO
61,,SING,C13,H13,no,N,61,,250298,6637,CTO
62,,SING,O13,HOD,no,N,62,,250298,6637,CTO
63,,SING,C23,N23,no,N,63,,250298,6637,CTO
64,,SING,C23,C33,no,N,64,,250298,6637,CTO
65,,SING,C23,H23,no,N,65,,250298,6637,CTO
66,,SING,N23,C73,no,N,66,,250298,6637,CTO
67,,SING,N23,HNN,no,N,67,,250298,6637,CTO
68,,DOUB,C73,O73,no,N,68,,250298,6637,CTO
69,,SING,C73,C83,no,N,69,,250298,6637,CTO
70,,SING,C83,H831,no,N,70,,250298,6637,CTO
71,,SING,C83,H832,no,N,71,,250298,6637,CTO
72,,SING,C83,H833,no,N,72,,250298,6637,CTO
73,,SING,C33,O33,no,N,73,,250298,6637,CTO
74,,SING,C33,C43,no,N,74,,250298,6637,CTO
75,,SING,C33,H33,no,N,75,,250298,6637,CTO
76,,SING,O33,HOX,no,N,76,,250298,6637,CTO
77,,SING,C43,O43,no,N,77,,250298,6637,CTO
78,,SING,C43,C53,no,N,78,,250298,6637,CTO
79,,SING,C43,H43,no,N,79,,250298,6637,CTO
80,,SING,C53,O53,no,N,80,,250298,6637,CTO
81,,SING,C53,C63,no,N,81,,250298,6637,CTO
82,,SING,C53,H53,no,N,82,,250298,6637,CTO
83,,SING,C63,O63,no,N,83,,250298,6637,CTO
84,,SING,C63,H631,no,N,84,,250298,6637,CTO
85,,SING,C63,H632,no,N,85,,250298,6637,CTO
86,,SING,O63,HO3,no,N,86,,250298,6637,CTO
1,,SING,C11,C21,no,N,1,,250336,6639,CTO
2,,SING,C11,O51,no,N,2,,250336,6639,CTO
3,,SING,C11,O42,no,N,3,,250336,6639,CTO
4,,SING,C11,H11,no,N,4,,250336,6639,CTO
5,,SING,C21,N21,no,N,5,,250336,6639,CTO
6,,SING,C21,C31,no,N,6,,250336,6639,CTO
7,,SING,C21,H21,no,N,7,,250336,6639,CTO
8,,SING,N21,C71,no,N,8,,250336,6639,CTO
9,,SING,N21,HNL,no,N,9,,250336,6639,CTO
10,,DOUB,C71,O71,no,N,10,,250336,6639,CTO
11,,SING,C71,C81,no,N,11,,250336,6639,CTO
12,,SING,C81,H811,no,N,12,,250336,6639,CTO
13,,SING,C81,H812,no,N,13,,250336,6639,CTO
14,,SING,C81,H813,no,N,14,,250336,6639,CTO
15,,SING,C31,O31,no,N,15,,250336,6639,CTO
16,,SING,C31,C41,no,N,16,,250336,6639,CTO
17,,SING,C31,H31,no,N,17,,250336,6639,CTO
18,,SING,O31,HOV,no,N,18,,250336,6639,CTO
19,,SING,C41,O41,no,N,19,,250336,6639,CTO
20,,SING,C41,C51,no,N,20,,250336,6639,CTO
21,,SING,C41,H41,no,N,21,,250336,6639,CTO
22,,SING,O41,HO4,no,N,22,,250336,6639,CTO
23,,SING,C51,O51,no,N,23,,250336,6639,CTO
24,,SING,C51,C61,no,N,24,,250336,6639,CTO
25,,SING,C51,H51,no,N,25,,250336,6639,CTO
26,,SING,C61,O61,no,N,26,,250336,6639,CTO
27,,SING,C61,H611,no,N,27,,250336,6639,CTO
28,,SING,C61,H612,no,N,28,,250336,6639,CTO
29,,SING,O61,HO6,no,N,29,,250336,6639,CTO
30,,SING,C12,C22,no,N,30,,250336,6639,CTO
31,,SING,C12,O52,no,N,31,,250336,6639,CTO
32,,SING,C12,O43,no,N,32,,250336,6639,CTO
33,,SING,C12,H12,no,N,33,,250336,6639,CTO
34,,SING,C22,N22,no,N,34,,250336,6639,CTO
35,,SING,C22,C32,no,N,35,,250336,6639,CTO
36,,SING,C22,H22,no,N,36,,250336,6639,CTO
37,,SING,N22,C72,no,N,37,,250336,6639,CTO
38,,SING,N22,HNM,no,N,38,,250336,6639,CTO
39,,DOUB,C72,O72,no,N,39,,250336,6639,CTO
40,,SING,C72,C82,no,N,40,,250336,6639,CTO
41,,SING,C82,H821,no,N,41,,250336,6639,CTO
42,,SING,C82,H822,no,N,42,,250336,6639,CTO
43,,SING,C82,H823,no,N,43,,250336,6639,CTO
44,,SING,C32,O32,no,N,44,,250336,6639,CTO
45,,SING,C32,C42,no,N,45,,250336,6639,CTO
46,,SING,C32,H32,no,N,46,,250336,6639,CTO
47,,SING,O32,HOW,no,N,47,,250336,6639,CTO
48,,SING,C42,O42,no,N,48,,250336,6639,CTO
49,,SING,C42,C52,no,N,49,,250336,6639,CTO
50,,SING,C42,H42,no,N,50,,250336,6639,CTO
51,,SING,C52,O52,no,N,51,,250336,6639,CTO
52,,SING,C52,C62,no,N,52,,250336,6639,CTO
53,,SING,C52,H52,no,N,53,,250336,6639,CTO
54,,SING,C62,O62,no,N,54,,250336,6639,CTO
55,,SING,C62,H621,no,N,55,,250336,6639,CTO
56,,SING,C62,H622,no,N,56,,250336,6639,CTO
57,,SING,O62,HO2,no,N,57,,250336,6639,CTO
58,,SING,C13,O13,no,N,58,,250336,6639,CTO
59,,SING,C13,C23,no,N,59,,250336,6639,CTO
60,,SING,C13,O53,no,N,60,,250336,6639,CTO
61,,SING,C13,H13,no,N,61,,250336,6639,CTO
62,,SING,O13,HOD,no,N,62,,250336,6639,CTO
63,,SING,C23,N23,no,N,63,,250336,6639,CTO
64,,SING,C23,C33,no,N,64,,250336,6639,CTO
65,,SING,C23,H23,no,N,65,,250336,6639,CTO
66,,SING,N23,C73,no,N,66,,250336,6639,CTO
67,,SING,N23,HNN,no,N,67,,250336,6639,CTO
68,,DOUB,C73,O73,no,N,68,,250336,6639,CTO
69,,SING,C73,C83,no,N,69,,250336,6639,CTO
70,,SING,C83,H831,no,N,70,,250336,6639,CTO
71,,SING,C83,H832,no,N,71,,250336,6639,CTO
72,,SING,C83,H833,no,N,72,,250336,6639,CTO
73,,SING,C33,O33,no,N,73,,250336,6639,CTO
74,,SING,C33,C43,no,N,74,,250336,6639,CTO
75,,SING,C33,H33,no,N,75,,250336,6639,CTO
76,,SING,O33,HOX,no,N,76,,250336,6639,CTO
77,,SING,C43,O43,no,N,77,,250336,6639,CTO
78,,SING,C43,C53,no,N,78,,250336,6639,CTO
79,,SING,C43,H43,no,N,79,,250336,6639,CTO
80,,SING,C53,O53,no,N,80,,250336,6639,CTO
81,,SING,C53,C63,no,N,81,,250336,6639,CTO
82,,SING,C53,H53,no,N,82,,250336,6639,CTO
83,,SING,C63,O63,no,N,83,,250336,6639,CTO
84,,SING,C63,H631,no,N,84,,250336,6639,CTO
85,,SING,C63,H632,no,N,85,,250336,6639,CTO
86,,SING,O63,HO3,no,N,86,,250336,6639,CTO
1,,SING,C1,C2,no,N,1,,250356,664,AAC
2,,SING,C1,O1,no,N,2,,250356,664,AAC
3,,DOUB,C1,O2,no,N,3,,250356,664,AAC
4,,SING,C2,N1,no,N,4,,250356,664,AAC
5,,SING,C2,HC21,no,N,5,,250356,664,AAC
6,,SING,C2,HC22,no,N,6,,250356,664,AAC
7,,SING,C3,C4,no,N,7,,250356,664,AAC
8,,SING,C3,N1,no,N,8,,250356,664,AAC
9,,DOUB,C3,O3,no,N,9,,250356,664,AAC
10,,SING,C4,HC41,no,N,10,,250356,664,AAC
11,,SING,C4,HC42,no,N,11,,250356,664,AAC
12,,SING,C4,HC43,no,N,12,,250356,664,AAC
13,,SING,N1,HN1,no,N,13,,250356,664,AAC
14,,SING,O1,HO1,no,N,14,,250356,664,AAC
1,,SING,FE,NA,no,N,1,,250357,664,HEC
2,,SING,FE,NB,no,N,2,,250357,664,HEC
3,,SING,FE,NC,no,N,3,,250357,664,HEC
4,,SING,FE,ND,no,N,4,,250357,664,HEC
5,,DOUB,CHA,C1A,no,N,5,,250357,664,HEC
6,,SING,CHA,C4D,no,N,6,,250357,664,HEC
7,,SING,CHA,HHA,no,N,7,,250357,664,HEC
8,,DOUB,CHB,C4A,no,N,8,,250357,664,HEC
9,,SING,CHB,C1B,no,N,9,,250357,664,HEC
10,,SING,CHB,HHB,no,N,10,,250357,664,HEC
11,,DOUB,CHC,C4B,no,N,11,,250357,664,HEC
12,,SING,CHC,C1C,no,N,12,,250357,664,HEC
13,,SING,CHC,HHC,no,N,13,,250357,664,HEC
14,,DOUB,CHD,C4C,no,N,14,,250357,664,HEC
15,,SING,CHD,C1D,no,N,15,,250357,664,HEC
16,,SING,CHD,HHD,no,N,16,,250357,664,HEC
17,,SING,NA,C1A,yes,N,17,,250357,664,HEC
18,,SING,NA,C4A,yes,N,18,,250357,664,HEC
19,,SING,C1A,C2A,yes,N,19,,250357,664,HEC
20,,DOUB,C2A,C3A,yes,N,20,,250357,664,HEC
21,,SING,C2A,CAA,no,N,21,,250357,664,HEC
22,,SING,C3A,C4A,yes,N,22,,250357,664,HEC
23,,SING,C3A,CMA,no,N,23,,250357,664,HEC
24,,SING,CMA,HMA1,no,N,24,,250357,664,HEC
25,,SING,CMA,HMA2,no,N,25,,250357,664,HEC
26,,SING,CMA,HMA3,no,N,26,,250357,664,HEC
27,,SING,CAA,CBA,no,N,27,,250357,664,HEC
28,,SING,CAA,HAA1,no,N,28,,250357,664,HEC
29,,SING,CAA,HAA2,no,N,29,,250357,664,HEC
30,,SING,CBA,CGA,no,N,30,,250357,664,HEC
31,,SING,CBA,HBA1,no,N,31,,250357,664,HEC
32,,SING,CBA,HBA2,no,N,32,,250357,664,HEC
33,,DOUB,CGA,O1A,no,N,33,,250357,664,HEC
34,,SING,CGA,O2A,no,N,34,,250357,664,HEC
35,,SING,O2A,H2A,no,N,35,,250357,664,HEC
36,,SING,NB,C1B,yes,N,36,,250357,664,HEC
37,,SING,NB,C4B,yes,N,37,,250357,664,HEC
38,,DOUB,C1B,C2B,yes,N,38,,250357,664,HEC
39,,SING,C2B,C3B,yes,N,39,,250357,664,HEC
40,,SING,C2B,CMB,no,N,40,,250357,664,HEC
41,,SING,C3B,C4B,yes,N,41,,250357,664,HEC
42,,DOUB,C3B,CAB,no,E,42,,250357,664,HEC
43,,SING,CMB,HMB1,no,N,43,,250357,664,HEC
44,,SING,CMB,HMB2,no,N,44,,250357,664,HEC
45,,SING,CMB,HMB3,no,N,45,,250357,664,HEC
46,,SING,CAB,CBB,no,N,46,,250357,664,HEC
47,,SING,CAB,HAB,no,N,47,,250357,664,HEC
48,,SING,CBB,HBB1,no,N,48,,250357,664,HEC
49,,SING,CBB,HBB2,no,N,49,,250357,664,HEC
50,,SING,CBB,HBB3,no,N,50,,250357,664,HEC
51,,SING,NC,C1C,yes,N,51,,250357,664,HEC
52,,SING,NC,C4C,yes,N,52,,250357,664,HEC
53,,DOUB,C1C,C2C,yes,N,53,,250357,664,HEC
54,,SING,C2C,C3C,yes,N,54,,250357,664,HEC
55,,SING,C2C,CMC,no,N,55,,250357,664,HEC
56,,SING,C3C,C4C,yes,N,56,,250357,664,HEC
57,,DOUB,C3C,CAC,no,E,57,,250357,664,HEC
58,,SING,CMC,HMC1,no,N,58,,250357,664,HEC
59,,SING,CMC,HMC2,no,N,59,,250357,664,HEC
60,,SING,CMC,HMC3,no,N,60,,250357,664,HEC
61,,SING,CAC,CBC,no,N,61,,250357,664,HEC
62,,SING,CAC,HAC,no,N,62,,250357,664,HEC
63,,SING,CBC,HBC1,no,N,63,,250357,664,HEC
64,,SING,CBC,HBC2,no,N,64,,250357,664,HEC
65,,SING,CBC,HBC3,no,N,65,,250357,664,HEC
66,,SING,ND,C1D,yes,N,66,,250357,664,HEC
67,,SING,ND,C4D,yes,N,67,,250357,664,HEC
68,,DOUB,C1D,C2D,yes,N,68,,250357,664,HEC
69,,SING,C2D,C3D,yes,N,69,,250357,664,HEC
70,,SING,C2D,CMD,no,N,70,,250357,664,HEC
71,,DOUB,C3D,C4D,yes,N,71,,250357,664,HEC
72,,SING,C3D,CAD,no,N,72,,250357,664,HEC
73,,SING,CMD,HMD1,no,N,73,,250357,664,HEC
74,,SING,CMD,HMD2,no,N,74,,250357,664,HEC
75,,SING,CMD,HMD3,no,N,75,,250357,664,HEC
76,,SING,CAD,CBD,no,N,76,,250357,664,HEC
77,,SING,CAD,HAD1,no,N,77,,250357,664,HEC
78,,SING,CAD,HAD2,no,N,78,,250357,664,HEC
79,,SING,CBD,CGD,no,N,79,,250357,664,HEC
80,,SING,CBD,HBD1,no,N,80,,250357,664,HEC
81,,SING,CBD,HBD2,no,N,81,,250357,664,HEC
82,,DOUB,CGD,O1D,no,N,82,,250357,664,HEC
83,,SING,CGD,O2D,no,N,83,,250357,664,HEC
84,,SING,O2D,H2D,no,N,84,,250357,664,HEC
1,,SING,C11,C21,no,N,1,,250476,6647,CTO
2,,SING,C11,O51,no,N,2,,250476,6647,CTO
3,,SING,C11,O42,no,N,3,,250476,6647,CTO
4,,SING,C11,H11,no,N,4,,250476,6647,CTO
5,,SING,C21,N21,no,N,5,,250476,6647,CTO
6,,SING,C21,C31,no,N,6,,250476,6647,CTO
7,,SING,C21,H21,no,N,7,,250476,6647,CTO
8,,SING,N21,C71,no,N,8,,250476,6647,CTO
9,,SING,N21,HNL,no,N,9,,250476,6647,CTO
10,,DOUB,C71,O71,no,N,10,,250476,6647,CTO
11,,SING,C71,C81,no,N,11,,250476,6647,CTO
12,,SING,C81,H811,no,N,12,,250476,6647,CTO
13,,SING,C81,H812,no,N,13,,250476,6647,CTO
14,,SING,C81,H813,no,N,14,,250476,6647,CTO
15,,SING,C31,O31,no,N,15,,250476,6647,CTO
16,,SING,C31,C41,no,N,16,,250476,6647,CTO
17,,SING,C31,H31,no,N,17,,250476,6647,CTO
18,,SING,O31,HOV,no,N,18,,250476,6647,CTO
19,,SING,C41,O41,no,N,19,,250476,6647,CTO
20,,SING,C41,C51,no,N,20,,250476,6647,CTO
21,,SING,C41,H41,no,N,21,,250476,6647,CTO
22,,SING,O41,HO4,no,N,22,,250476,6647,CTO
23,,SING,C51,O51,no,N,23,,250476,6647,CTO
24,,SING,C51,C61,no,N,24,,250476,6647,CTO
25,,SING,C51,H51,no,N,25,,250476,6647,CTO
26,,SING,C61,O61,no,N,26,,250476,6647,CTO
27,,SING,C61,H611,no,N,27,,250476,6647,CTO
28,,SING,C61,H612,no,N,28,,250476,6647,CTO
29,,SING,O61,HO6,no,N,29,,250476,6647,CTO
30,,SING,C12,C22,no,N,30,,250476,6647,CTO
31,,SING,C12,O52,no,N,31,,250476,6647,CTO
32,,SING,C12,O43,no,N,32,,250476,6647,CTO
33,,SING,C12,H12,no,N,33,,250476,6647,CTO
34,,SING,C22,N22,no,N,34,,250476,6647,CTO
35,,SING,C22,C32,no,N,35,,250476,6647,CTO
36,,SING,C22,H22,no,N,36,,250476,6647,CTO
37,,SING,N22,C72,no,N,37,,250476,6647,CTO
38,,SING,N22,HNM,no,N,38,,250476,6647,CTO
39,,DOUB,C72,O72,no,N,39,,250476,6647,CTO
40,,SING,C72,C82,no,N,40,,250476,6647,CTO
41,,SING,C82,H821,no,N,41,,250476,6647,CTO
42,,SING,C82,H822,no,N,42,,250476,6647,CTO
43,,SING,C82,H823,no,N,43,,250476,6647,CTO
44,,SING,C32,O32,no,N,44,,250476,6647,CTO
45,,SING,C32,C42,no,N,45,,250476,6647,CTO
46,,SING,C32,H32,no,N,46,,250476,6647,CTO
47,,SING,O32,HOW,no,N,47,,250476,6647,CTO
48,,SING,C42,O42,no,N,48,,250476,6647,CTO
49,,SING,C42,C52,no,N,49,,250476,6647,CTO
50,,SING,C42,H42,no,N,50,,250476,6647,CTO
51,,SING,C52,O52,no,N,51,,250476,6647,CTO
52,,SING,C52,C62,no,N,52,,250476,6647,CTO
53,,SING,C52,H52,no,N,53,,250476,6647,CTO
54,,SING,C62,O62,no,N,54,,250476,6647,CTO
55,,SING,C62,H621,no,N,55,,250476,6647,CTO
56,,SING,C62,H622,no,N,56,,250476,6647,CTO
57,,SING,O62,HO2,no,N,57,,250476,6647,CTO
58,,SING,C13,O13,no,N,58,,250476,6647,CTO
59,,SING,C13,C23,no,N,59,,250476,6647,CTO
60,,SING,C13,O53,no,N,60,,250476,6647,CTO
61,,SING,C13,H13,no,N,61,,250476,6647,CTO
62,,SING,O13,HOD,no,N,62,,250476,6647,CTO
63,,SING,C23,N23,no,N,63,,250476,6647,CTO
64,,SING,C23,C33,no,N,64,,250476,6647,CTO
65,,SING,C23,H23,no,N,65,,250476,6647,CTO
66,,SING,N23,C73,no,N,66,,250476,6647,CTO
67,,SING,N23,HNN,no,N,67,,250476,6647,CTO
68,,DOUB,C73,O73,no,N,68,,250476,6647,CTO
69,,SING,C73,C83,no,N,69,,250476,6647,CTO
70,,SING,C83,H831,no,N,70,,250476,6647,CTO
71,,SING,C83,H832,no,N,71,,250476,6647,CTO
72,,SING,C83,H833,no,N,72,,250476,6647,CTO
73,,SING,C33,O33,no,N,73,,250476,6647,CTO
74,,SING,C33,C43,no,N,74,,250476,6647,CTO
75,,SING,C33,H33,no,N,75,,250476,6647,CTO
76,,SING,O33,HOX,no,N,76,,250476,6647,CTO
77,,SING,C43,O43,no,N,77,,250476,6647,CTO
78,,SING,C43,C53,no,N,78,,250476,6647,CTO
79,,SING,C43,H43,no,N,79,,250476,6647,CTO
80,,SING,C53,O53,no,N,80,,250476,6647,CTO
81,,SING,C53,C63,no,N,81,,250476,6647,CTO
82,,SING,C53,H53,no,N,82,,250476,6647,CTO
83,,SING,C63,O63,no,N,83,,250476,6647,CTO
84,,SING,C63,H631,no,N,84,,250476,6647,CTO
85,,SING,C63,H632,no,N,85,,250476,6647,CTO
86,,SING,O63,HO3,no,N,86,,250476,6647,CTO
1,,SING,C1,C2,no,N,1,,250548,665,AAC
2,,SING,C1,O1,no,N,2,,250548,665,AAC
3,,DOUB,C1,O2,no,N,3,,250548,665,AAC
4,,SING,C2,N1,no,N,4,,250548,665,AAC
5,,SING,C2,HC21,no,N,5,,250548,665,AAC
6,,SING,C2,HC22,no,N,6,,250548,665,AAC
7,,SING,C3,C4,no,N,7,,250548,665,AAC
8,,SING,C3,N1,no,N,8,,250548,665,AAC
9,,DOUB,C3,O3,no,N,9,,250548,665,AAC
10,,SING,C4,HC41,no,N,10,,250548,665,AAC
11,,SING,C4,HC42,no,N,11,,250548,665,AAC
12,,SING,C4,HC43,no,N,12,,250548,665,AAC
13,,SING,N1,HN1,no,N,13,,250548,665,AAC
14,,SING,O1,HO1,no,N,14,,250548,665,AAC
1,,SING,FE,NA,no,N,1,,250549,665,HEC
2,,SING,FE,NB,no,N,2,,250549,665,HEC
3,,SING,FE,NC,no,N,3,,250549,665,HEC
4,,SING,FE,ND,no,N,4,,250549,665,HEC
5,,DOUB,CHA,C1A,no,N,5,,250549,665,HEC
6,,SING,CHA,C4D,no,N,6,,250549,665,HEC
7,,SING,CHA,HHA,no,N,7,,250549,665,HEC
8,,DOUB,CHB,C4A,no,N,8,,250549,665,HEC
9,,SING,CHB,C1B,no,N,9,,250549,665,HEC
10,,SING,CHB,HHB,no,N,10,,250549,665,HEC
11,,DOUB,CHC,C4B,no,N,11,,250549,665,HEC
12,,SING,CHC,C1C,no,N,12,,250549,665,HEC
13,,SING,CHC,HHC,no,N,13,,250549,665,HEC
14,,DOUB,CHD,C4C,no,N,14,,250549,665,HEC
15,,SING,CHD,C1D,no,N,15,,250549,665,HEC
16,,SING,CHD,HHD,no,N,16,,250549,665,HEC
17,,SING,NA,C1A,yes,N,17,,250549,665,HEC
18,,SING,NA,C4A,yes,N,18,,250549,665,HEC
19,,SING,C1A,C2A,yes,N,19,,250549,665,HEC
20,,DOUB,C2A,C3A,yes,N,20,,250549,665,HEC
21,,SING,C2A,CAA,no,N,21,,250549,665,HEC
22,,SING,C3A,C4A,yes,N,22,,250549,665,HEC
23,,SING,C3A,CMA,no,N,23,,250549,665,HEC
24,,SING,CMA,HMA1,no,N,24,,250549,665,HEC
25,,SING,CMA,HMA2,no,N,25,,250549,665,HEC
26,,SING,CMA,HMA3,no,N,26,,250549,665,HEC
27,,SING,CAA,CBA,no,N,27,,250549,665,HEC
28,,SING,CAA,HAA1,no,N,28,,250549,665,HEC
29,,SING,CAA,HAA2,no,N,29,,250549,665,HEC
30,,SING,CBA,CGA,no,N,30,,250549,665,HEC
31,,SING,CBA,HBA1,no,N,31,,250549,665,HEC
32,,SING,CBA,HBA2,no,N,32,,250549,665,HEC
33,,DOUB,CGA,O1A,no,N,33,,250549,665,HEC
34,,SING,CGA,O2A,no,N,34,,250549,665,HEC
35,,SING,O2A,H2A,no,N,35,,250549,665,HEC
36,,SING,NB,C1B,yes,N,36,,250549,665,HEC
37,,SING,NB,C4B,yes,N,37,,250549,665,HEC
38,,DOUB,C1B,C2B,yes,N,38,,250549,665,HEC
39,,SING,C2B,C3B,yes,N,39,,250549,665,HEC
40,,SING,C2B,CMB,no,N,40,,250549,665,HEC
41,,SING,C3B,C4B,yes,N,41,,250549,665,HEC
42,,DOUB,C3B,CAB,no,E,42,,250549,665,HEC
43,,SING,CMB,HMB1,no,N,43,,250549,665,HEC
44,,SING,CMB,HMB2,no,N,44,,250549,665,HEC
45,,SING,CMB,HMB3,no,N,45,,250549,665,HEC
46,,SING,CAB,CBB,no,N,46,,250549,665,HEC
47,,SING,CAB,HAB,no,N,47,,250549,665,HEC
48,,SING,CBB,HBB1,no,N,48,,250549,665,HEC
49,,SING,CBB,HBB2,no,N,49,,250549,665,HEC
50,,SING,CBB,HBB3,no,N,50,,250549,665,HEC
51,,SING,NC,C1C,yes,N,51,,250549,665,HEC
52,,SING,NC,C4C,yes,N,52,,250549,665,HEC
53,,DOUB,C1C,C2C,yes,N,53,,250549,665,HEC
54,,SING,C2C,C3C,yes,N,54,,250549,665,HEC
55,,SING,C2C,CMC,no,N,55,,250549,665,HEC
56,,SING,C3C,C4C,yes,N,56,,250549,665,HEC
57,,DOUB,C3C,CAC,no,E,57,,250549,665,HEC
58,,SING,CMC,HMC1,no,N,58,,250549,665,HEC
59,,SING,CMC,HMC2,no,N,59,,250549,665,HEC
60,,SING,CMC,HMC3,no,N,60,,250549,665,HEC
61,,SING,CAC,CBC,no,N,61,,250549,665,HEC
62,,SING,CAC,HAC,no,N,62,,250549,665,HEC
63,,SING,CBC,HBC1,no,N,63,,250549,665,HEC
64,,SING,CBC,HBC2,no,N,64,,250549,665,HEC
65,,SING,CBC,HBC3,no,N,65,,250549,665,HEC
66,,SING,ND,C1D,yes,N,66,,250549,665,HEC
67,,SING,ND,C4D,yes,N,67,,250549,665,HEC
68,,DOUB,C1D,C2D,yes,N,68,,250549,665,HEC
69,,SING,C2D,C3D,yes,N,69,,250549,665,HEC
70,,SING,C2D,CMD,no,N,70,,250549,665,HEC
71,,DOUB,C3D,C4D,yes,N,71,,250549,665,HEC
72,,SING,C3D,CAD,no,N,72,,250549,665,HEC
73,,SING,CMD,HMD1,no,N,73,,250549,665,HEC
74,,SING,CMD,HMD2,no,N,74,,250549,665,HEC
75,,SING,CMD,HMD3,no,N,75,,250549,665,HEC
76,,SING,CAD,CBD,no,N,76,,250549,665,HEC
77,,SING,CAD,HAD1,no,N,77,,250549,665,HEC
78,,SING,CAD,HAD2,no,N,78,,250549,665,HEC
79,,SING,CBD,CGD,no,N,79,,250549,665,HEC
80,,SING,CBD,HBD1,no,N,80,,250549,665,HEC
81,,SING,CBD,HBD2,no,N,81,,250549,665,HEC
82,,DOUB,CGD,O1D,no,N,82,,250549,665,HEC
83,,SING,CGD,O2D,no,N,83,,250549,665,HEC
84,,SING,O2D,H2D,no,N,84,,250549,665,HEC
1,,SING,N,CA,no,N,1,,250713,6656,PFF
2,,SING,N,H,no,N,2,,250713,6656,PFF
3,,SING,N,H2,no,N,3,,250713,6656,PFF
4,,SING,CA,C,no,N,4,,250713,6656,PFF
5,,SING,CA,CB,no,N,5,,250713,6656,PFF
6,,SING,CA,HA,no,N,6,,250713,6656,PFF
7,,DOUB,C,O,no,N,7,,250713,6656,PFF
8,,SING,C,OXT,no,N,8,,250713,6656,PFF
9,,SING,OXT,HXT,no,N,9,,250713,6656,PFF
10,,SING,CB,CG,no,N,10,,250713,6656,PFF
11,,SING,CB,HB2,no,N,11,,250713,6656,PFF
12,,SING,CB,HB3,no,N,12,,250713,6656,PFF
13,,DOUB,CG,CD1,yes,N,13,,250713,6656,PFF
14,,SING,CG,CD2,yes,N,14,,250713,6656,PFF
15,,SING,CD1,CE1,yes,N,15,,250713,6656,PFF
16,,SING,CD1,HD1,no,N,16,,250713,6656,PFF
17,,DOUB,CD2,CE2,yes,N,17,,250713,6656,PFF
18,,SING,CD2,HD2,no,N,18,,250713,6656,PFF
19,,DOUB,CE1,CZ,yes,N,19,,250713,6656,PFF
20,,SING,CE1,HE1,no,N,20,,250713,6656,PFF
21,,SING,CE2,CZ,yes,N,21,,250713,6656,PFF
22,,SING,CE2,HE2,no,N,22,,250713,6656,PFF
23,,SING,CZ,F,no,N,23,,250713,6656,PFF
1,,DOUB,C6,C5,yes,N,1,,250739,6657,NAL
2,,SING,C6,C7,yes,N,2,,250739,6657,NAL
3,,SING,C5,C4A,yes,N,3,,250739,6657,NAL
4,,DOUB,C7,C8,yes,N,4,,250739,6657,NAL
5,,DOUB,C4A,C4,yes,N,5,,250739,6657,NAL
6,,SING,C4A,C8A,yes,N,6,,250739,6657,NAL
7,,SING,C8,C8A,yes,N,7,,250739,6657,NAL
8,,SING,C4,C3,yes,N,8,,250739,6657,NAL
9,,DOUB,C8A,C1,yes,N,9,,250739,6657,NAL
10,,DOUB,C3,C2,yes,N,10,,250739,6657,NAL
11,,SING,C1,C2,yes,N,11,,250739,6657,NAL
12,,SING,C2,C9,no,N,12,,250739,6657,NAL
13,,SING,C9,CA,no,N,13,,250739,6657,NAL
14,,SING,CA,N,no,N,14,,250739,6657,NAL
15,,SING,CA,C,no,N,15,,250739,6657,NAL
16,,DOUB,C,O,no,N,16,,250739,6657,NAL
17,,SING,C,OXT,no,N,17,,250739,6657,NAL
18,,SING,C1,H1,no,N,18,,250739,6657,NAL
19,,SING,C3,H3,no,N,19,,250739,6657,NAL
20,,SING,C4,H4,no,N,20,,250739,6657,NAL
21,,SING,C5,H5,no,N,21,,250739,6657,NAL
22,,SING,C6,H6,no,N,22,,250739,6657,NAL
23,,SING,C7,H7,no,N,23,,250739,6657,NAL
24,,SING,C8,H8,no,N,24,,250739,6657,NAL
25,,SING,C9,H91,no,N,25,,250739,6657,NAL
26,,SING,C9,H92,no,N,26,,250739,6657,NAL
27,,SING,CA,HA,no,N,27,,250739,6657,NAL
28,,SING,N,H,no,N,28,,250739,6657,NAL
29,,SING,N,H2,no,N,29,,250739,6657,NAL
30,,SING,OXT,HXT,no,N,30,,250739,6657,NAL
1,,SING,FE,NA,no,N,1,,250972,667,HEC
2,,SING,FE,NB,no,N,2,,250972,667,HEC
3,,SING,FE,NC,no,N,3,,250972,667,HEC
4,,SING,FE,ND,no,N,4,,250972,667,HEC
5,,DOUB,CHA,C1A,no,N,5,,250972,667,HEC
6,,SING,CHA,C4D,no,N,6,,250972,667,HEC
7,,SING,CHA,HHA,no,N,7,,250972,667,HEC
8,,DOUB,CHB,C4A,no,N,8,,250972,667,HEC
9,,SING,CHB,C1B,no,N,9,,250972,667,HEC
10,,SING,CHB,HHB,no,N,10,,250972,667,HEC
11,,DOUB,CHC,C4B,no,N,11,,250972,667,HEC
12,,SING,CHC,C1C,no,N,12,,250972,667,HEC
13,,SING,CHC,HHC,no,N,13,,250972,667,HEC
14,,DOUB,CHD,C4C,no,N,14,,250972,667,HEC
15,,SING,CHD,C1D,no,N,15,,250972,667,HEC
16,,SING,CHD,HHD,no,N,16,,250972,667,HEC
17,,SING,NA,C1A,yes,N,17,,250972,667,HEC
18,,SING,NA,C4A,yes,N,18,,250972,667,HEC
19,,SING,C1A,C2A,yes,N,19,,250972,667,HEC
20,,DOUB,C2A,C3A,yes,N,20,,250972,667,HEC
21,,SING,C2A,CAA,no,N,21,,250972,667,HEC
22,,SING,C3A,C4A,yes,N,22,,250972,667,HEC
23,,SING,C3A,CMA,no,N,23,,250972,667,HEC
24,,SING,CMA,HMA1,no,N,24,,250972,667,HEC
25,,SING,CMA,HMA2,no,N,25,,250972,667,HEC
26,,SING,CMA,HMA3,no,N,26,,250972,667,HEC
27,,SING,CAA,CBA,no,N,27,,250972,667,HEC
28,,SING,CAA,HAA1,no,N,28,,250972,667,HEC
29,,SING,CAA,HAA2,no,N,29,,250972,667,HEC
30,,SING,CBA,CGA,no,N,30,,250972,667,HEC
31,,SING,CBA,HBA1,no,N,31,,250972,667,HEC
32,,SING,CBA,HBA2,no,N,32,,250972,667,HEC
33,,DOUB,CGA,O1A,no,N,33,,250972,667,HEC
34,,SING,CGA,O2A,no,N,34,,250972,667,HEC
35,,SING,O2A,H2A,no,N,35,,250972,667,HEC
36,,SING,NB,C1B,yes,N,36,,250972,667,HEC
37,,SING,NB,C4B,yes,N,37,,250972,667,HEC
38,,DOUB,C1B,C2B,yes,N,38,,250972,667,HEC
39,,SING,C2B,C3B,yes,N,39,,250972,667,HEC
40,,SING,C2B,CMB,no,N,40,,250972,667,HEC
41,,SING,C3B,C4B,yes,N,41,,250972,667,HEC
42,,DOUB,C3B,CAB,no,E,42,,250972,667,HEC
43,,SING,CMB,HMB1,no,N,43,,250972,667,HEC
44,,SING,CMB,HMB2,no,N,44,,250972,667,HEC
45,,SING,CMB,HMB3,no,N,45,,250972,667,HEC
46,,SING,CAB,CBB,no,N,46,,250972,667,HEC
47,,SING,CAB,HAB,no,N,47,,250972,667,HEC
48,,SING,CBB,HBB1,no,N,48,,250972,667,HEC
49,,SING,CBB,HBB2,no,N,49,,250972,667,HEC
50,,SING,CBB,HBB3,no,N,50,,250972,667,HEC
51,,SING,NC,C1C,yes,N,51,,250972,667,HEC
52,,SING,NC,C4C,yes,N,52,,250972,667,HEC
53,,DOUB,C1C,C2C,yes,N,53,,250972,667,HEC
54,,SING,C2C,C3C,yes,N,54,,250972,667,HEC
55,,SING,C2C,CMC,no,N,55,,250972,667,HEC
56,,SING,C3C,C4C,yes,N,56,,250972,667,HEC
57,,DOUB,C3C,CAC,no,E,57,,250972,667,HEC
58,,SING,CMC,HMC1,no,N,58,,250972,667,HEC
59,,SING,CMC,HMC2,no,N,59,,250972,667,HEC
60,,SING,CMC,HMC3,no,N,60,,250972,667,HEC
61,,SING,CAC,CBC,no,N,61,,250972,667,HEC
62,,SING,CAC,HAC,no,N,62,,250972,667,HEC
63,,SING,CBC,HBC1,no,N,63,,250972,667,HEC
64,,SING,CBC,HBC2,no,N,64,,250972,667,HEC
65,,SING,CBC,HBC3,no,N,65,,250972,667,HEC
66,,SING,ND,C1D,yes,N,66,,250972,667,HEC
67,,SING,ND,C4D,yes,N,67,,250972,667,HEC
68,,DOUB,C1D,C2D,yes,N,68,,250972,667,HEC
69,,SING,C2D,C3D,yes,N,69,,250972,667,HEC
70,,SING,C2D,CMD,no,N,70,,250972,667,HEC
71,,DOUB,C3D,C4D,yes,N,71,,250972,667,HEC
72,,SING,C3D,CAD,no,N,72,,250972,667,HEC
73,,SING,CMD,HMD1,no,N,73,,250972,667,HEC
74,,SING,CMD,HMD2,no,N,74,,250972,667,HEC
75,,SING,CMD,HMD3,no,N,75,,250972,667,HEC
76,,SING,CAD,CBD,no,N,76,,250972,667,HEC
77,,SING,CAD,HAD1,no,N,77,,250972,667,HEC
78,,SING,CAD,HAD2,no,N,78,,250972,667,HEC
79,,SING,CBD,CGD,no,N,79,,250972,667,HEC
80,,SING,CBD,HBD1,no,N,80,,250972,667,HEC
81,,SING,CBD,HBD2,no,N,81,,250972,667,HEC
82,,DOUB,CGD,O1D,no,N,82,,250972,667,HEC
83,,SING,CGD,O2D,no,N,83,,250972,667,HEC
84,,SING,O2D,H2D,no,N,84,,250972,667,HEC
1,,SING,N,CA,no,N,1,,250973,667,M3L
2,,SING,N,H,no,N,2,,250973,667,M3L
3,,SING,N,H2,no,N,3,,250973,667,M3L
4,,SING,CA,CB,no,N,4,,250973,667,M3L
5,,SING,CA,C,no,N,5,,250973,667,M3L
6,,SING,CA,HA,no,N,6,,250973,667,M3L
7,,SING,CB,CG,no,N,7,,250973,667,M3L
8,,SING,CB,HB2,no,N,8,,250973,667,M3L
9,,SING,CB,HB3,no,N,9,,250973,667,M3L
10,,SING,CG,CD,no,N,10,,250973,667,M3L
11,,SING,CG,HG2,no,N,11,,250973,667,M3L
12,,SING,CG,HG3,no,N,12,,250973,667,M3L
13,,SING,CD,CE,no,N,13,,250973,667,M3L
14,,SING,CD,HD2,no,N,14,,250973,667,M3L
15,,SING,CD,HD3,no,N,15,,250973,667,M3L
16,,SING,CE,NZ,no,N,16,,250973,667,M3L
17,,SING,CE,HE2,no,N,17,,250973,667,M3L
18,,SING,CE,HE3,no,N,18,,250973,667,M3L
19,,SING,NZ,CM1,no,N,19,,250973,667,M3L
20,,SING,NZ,CM2,no,N,20,,250973,667,M3L
21,,SING,NZ,CM3,no,N,21,,250973,667,M3L
22,,DOUB,C,O,no,N,22,,250973,667,M3L
23,,SING,C,OXT,no,N,23,,250973,667,M3L
24,,SING,OXT,HXT,no,N,24,,250973,667,M3L
25,,SING,CM1,HM11,no,N,25,,250973,667,M3L
26,,SING,CM1,HM12,no,N,26,,250973,667,M3L
27,,SING,CM1,HM13,no,N,27,,250973,667,M3L
28,,SING,CM2,HM21,no,N,28,,250973,667,M3L
29,,SING,CM2,HM22,no,N,29,,250973,667,M3L
30,,SING,CM2,HM23,no,N,30,,250973,667,M3L
31,,SING,CM3,HM31,no,N,31,,250973,667,M3L
32,,SING,CM3,HM32,no,N,32,,250973,667,M3L
33,,SING,CM3,HM33,no,N,33,,250973,667,M3L
1,,SING,CHA,C1A,yes,N,1,,251231,6683,HEM
2,,DOUB,CHA,C4D,yes,N,2,,251231,6683,HEM
3,,SING,CHA,HHA,no,N,3,,251231,6683,HEM
4,,SING,CHB,C4A,yes,N,4,,251231,6683,HEM
5,,DOUB,CHB,C1B,yes,N,5,,251231,6683,HEM
6,,SING,CHB,HHB,no,N,6,,251231,6683,HEM
7,,SING,CHC,C4B,yes,N,7,,251231,6683,HEM
8,,DOUB,CHC,C1C,yes,N,8,,251231,6683,HEM
9,,SING,CHC,HHC,no,N,9,,251231,6683,HEM
10,,DOUB,CHD,C4C,yes,N,10,,251231,6683,HEM
11,,SING,CHD,C1D,yes,N,11,,251231,6683,HEM
12,,SING,CHD,HHD,no,N,12,,251231,6683,HEM
13,,DOUB,C1A,C2A,yes,N,13,,251231,6683,HEM
14,,SING,C1A,NA,yes,N,14,,251231,6683,HEM
15,,SING,C2A,C3A,yes,N,15,,251231,6683,HEM
16,,SING,C2A,CAA,no,N,16,,251231,6683,HEM
17,,DOUB,C3A,C4A,yes,N,17,,251231,6683,HEM
18,,SING,C3A,CMA,no,N,18,,251231,6683,HEM
19,,SING,C4A,NA,yes,N,19,,251231,6683,HEM
20,,SING,CMA,HMA,no,N,20,,251231,6683,HEM
21,,SING,CMA,HMAA,no,N,21,,251231,6683,HEM
22,,SING,CMA,HMAB,no,N,22,,251231,6683,HEM
23,,SING,CAA,CBA,no,N,23,,251231,6683,HEM
24,,SING,CAA,HAA,no,N,24,,251231,6683,HEM
25,,SING,CAA,HAAA,no,N,25,,251231,6683,HEM
26,,SING,CBA,CGA,no,N,26,,251231,6683,HEM
27,,SING,CBA,HBA,no,N,27,,251231,6683,HEM
28,,SING,CBA,HBAA,no,N,28,,251231,6683,HEM
29,,DOUB,CGA,O1A,no,N,29,,251231,6683,HEM
30,,SING,CGA,O2A,no,N,30,,251231,6683,HEM
31,,SING,C1B,C2B,no,N,31,,251231,6683,HEM
32,,SING,C1B,NB,yes,N,32,,251231,6683,HEM
33,,DOUB,C2B,C3B,yes,N,33,,251231,6683,HEM
34,,SING,C2B,CMB,yes,N,34,,251231,6683,HEM
35,,SING,C3B,C4B,no,N,35,,251231,6683,HEM
36,,SING,C3B,CAB,yes,N,36,,251231,6683,HEM
37,,DOUB,C4B,NB,no,N,37,,251231,6683,HEM
38,,SING,CMB,HMB,yes,N,38,,251231,6683,HEM
39,,SING,CMB,HMBA,no,N,39,,251231,6683,HEM
40,,SING,CMB,HMBB,no,N,40,,251231,6683,HEM
41,,DOUB,CAB,CBB,no,N,41,,251231,6683,HEM
42,,SING,CAB,HAB,no,N,42,,251231,6683,HEM
43,,SING,CBB,HBB,no,N,43,,251231,6683,HEM
44,,SING,CBB,HBBA,no,N,44,,251231,6683,HEM
45,,SING,C1C,C2C,no,N,45,,251231,6683,HEM
46,,SING,C1C,NC,yes,N,46,,251231,6683,HEM
47,,DOUB,C2C,C3C,yes,N,47,,251231,6683,HEM
48,,SING,C2C,CMC,yes,N,48,,251231,6683,HEM
49,,SING,C3C,C4C,no,N,49,,251231,6683,HEM
50,,SING,C3C,CAC,yes,N,50,,251231,6683,HEM
51,,SING,C4C,NC,no,N,51,,251231,6683,HEM
52,,SING,CMC,HMC,yes,N,52,,251231,6683,HEM
53,,SING,CMC,HMCA,no,N,53,,251231,6683,HEM
54,,SING,CMC,HMCB,no,N,54,,251231,6683,HEM
55,,DOUB,CAC,CBC,no,N,55,,251231,6683,HEM
56,,SING,CAC,HAC,no,N,56,,251231,6683,HEM
57,,SING,CBC,HBC,no,N,57,,251231,6683,HEM
58,,SING,CBC,HBCA,no,N,58,,251231,6683,HEM
59,,SING,C1D,C2D,no,N,59,,251231,6683,HEM
60,,DOUB,C1D,ND,yes,N,60,,251231,6683,HEM
61,,DOUB,C2D,C3D,yes,N,61,,251231,6683,HEM
62,,SING,C2D,CMD,yes,N,62,,251231,6683,HEM
63,,SING,C3D,C4D,no,N,63,,251231,6683,HEM
64,,SING,C3D,CAD,yes,N,64,,251231,6683,HEM
65,,SING,C4D,ND,no,N,65,,251231,6683,HEM
66,,SING,CMD,HMD,yes,N,66,,251231,6683,HEM
67,,SING,CMD,HMDA,no,N,67,,251231,6683,HEM
68,,SING,CMD,HMDB,no,N,68,,251231,6683,HEM
69,,SING,CAD,CBD,no,N,69,,251231,6683,HEM
70,,SING,CAD,HAD,no,N,70,,251231,6683,HEM
71,,SING,CAD,HADA,no,N,71,,251231,6683,HEM
72,,SING,CBD,CGD,no,N,72,,251231,6683,HEM
73,,SING,CBD,HBD,no,N,73,,251231,6683,HEM
74,,SING,CBD,HBDA,no,N,74,,251231,6683,HEM
75,,DOUB,CGD,O1D,no,N,75,,251231,6683,HEM
76,,SING,CGD,O2D,no,N,76,,251231,6683,HEM
77,,SING,O2A,H2A,no,N,77,,251231,6683,HEM
78,,SING,O2D,H2D,no,N,78,,251231,6683,HEM
79,,SING,FE,NA,no,N,79,,251231,6683,HEM
80,,SING,FE,NB,no,N,80,,251231,6683,HEM
81,,SING,FE,NC,no,N,81,,251231,6683,HEM
82,,SING,FE,ND,no,N,82,,251231,6683,HEM
1,,DOUB,C1,O1,no,N,1,,251251,6685,AKG
2,,SING,C1,O2,no,N,2,,251251,6685,AKG
3,,SING,C1,C2,no,N,3,,251251,6685,AKG
4,,SING,O2,HO2,no,N,4,,251251,6685,AKG
5,,DOUB,C2,O5,no,N,5,,251251,6685,AKG
6,,SING,C2,C3,no,N,6,,251251,6685,AKG
7,,SING,C3,C4,no,N,7,,251251,6685,AKG
8,,SING,C3,H31,no,N,8,,251251,6685,AKG
9,,SING,C3,H32,no,N,9,,251251,6685,AKG
10,,SING,C4,C5,no,N,10,,251251,6685,AKG
11,,SING,C4,H41,no,N,11,,251251,6685,AKG
12,,SING,C4,H42,no,N,12,,251251,6685,AKG
13,,DOUB,C5,O3,no,N,13,,251251,6685,AKG
14,,SING,C5,O4,no,N,14,,251251,6685,AKG
15,,SING,O4,HO4,no,N,15,,251251,6685,AKG
1,,DOUB,PA,O1A,no,N,1,,251421,6692,FAD
2,,SING,PA,O2A,no,N,2,,251421,6692,FAD
3,,SING,PA,O5B,no,N,3,,251421,6692,FAD
4,,SING,PA,O3P,no,N,4,,251421,6692,FAD
5,,SING,O2A,HOA2,no,N,5,,251421,6692,FAD
6,,SING,O5B,C5B,no,N,6,,251421,6692,FAD
7,,SING,C5B,C4B,no,N,7,,251421,6692,FAD
8,,SING,C5B,H51A,no,N,8,,251421,6692,FAD
9,,SING,C5B,H52A,no,N,9,,251421,6692,FAD
10,,SING,C4B,O4B,no,N,10,,251421,6692,FAD
11,,SING,C4B,C3B,no,N,11,,251421,6692,FAD
12,,SING,C4B,H4B,no,N,12,,251421,6692,FAD
13,,SING,O4B,C1B,no,N,13,,251421,6692,FAD
14,,SING,C3B,O3B,no,N,14,,251421,6692,FAD
15,,SING,C3B,C2B,no,N,15,,251421,6692,FAD
16,,SING,C3B,H3B,no,N,16,,251421,6692,FAD
17,,SING,O3B,HO3A,no,N,17,,251421,6692,FAD
18,,SING,C2B,O2B,no,N,18,,251421,6692,FAD
19,,SING,C2B,C1B,no,N,19,,251421,6692,FAD
20,,SING,C2B,H2B,no,N,20,,251421,6692,FAD
21,,SING,O2B,HO2A,no,N,21,,251421,6692,FAD
22,,SING,C1B,N9A,no,N,22,,251421,6692,FAD
23,,SING,C1B,H1B,no,N,23,,251421,6692,FAD
24,,SING,N9A,C8A,yes,N,24,,251421,6692,FAD
25,,SING,N9A,C4A,yes,N,25,,251421,6692,FAD
26,,DOUB,C8A,N7A,yes,N,26,,251421,6692,FAD
27,,SING,C8A,H8A,no,N,27,,251421,6692,FAD
28,,SING,N7A,C5A,yes,N,28,,251421,6692,FAD
29,,SING,C5A,C6A,yes,N,29,,251421,6692,FAD
30,,DOUB,C5A,C4A,yes,N,30,,251421,6692,FAD
31,,SING,C6A,N6A,no,N,31,,251421,6692,FAD
32,,DOUB,C6A,N1A,yes,N,32,,251421,6692,FAD
33,,SING,N6A,H61A,no,N,33,,251421,6692,FAD
34,,SING,N6A,H62A,no,N,34,,251421,6692,FAD
35,,SING,N1A,C2A,yes,N,35,,251421,6692,FAD
36,,DOUB,C2A,N3A,yes,N,36,,251421,6692,FAD
37,,SING,C2A,H2A,no,N,37,,251421,6692,FAD
38,,SING,N3A,C4A,yes,N,38,,251421,6692,FAD
39,,SING,N1,C2,no,N,39,,251421,6692,FAD
40,,DOUB,N1,C10,no,N,40,,251421,6692,FAD
41,,DOUB,C2,O2,no,N,41,,251421,6692,FAD
42,,SING,C2,N3,no,N,42,,251421,6692,FAD
43,,SING,N3,C4,no,N,43,,251421,6692,FAD
44,,SING,N3,HN3,no,N,44,,251421,6692,FAD
45,,DOUB,C4,O4,no,N,45,,251421,6692,FAD
46,,SING,C4,C4X,no,N,46,,251421,6692,FAD
47,,DOUB,C4X,N5,no,N,47,,251421,6692,FAD
48,,SING,C4X,C10,no,N,48,,251421,6692,FAD
49,,SING,N5,C5X,no,N,49,,251421,6692,FAD
50,,DOUB,C5X,C6,yes,N,50,,251421,6692,FAD
51,,SING,C5X,C9A,yes,N,51,,251421,6692,FAD
52,,SING,C6,C7,yes,N,52,,251421,6692,FAD
53,,SING,C6,H6,no,N,53,,251421,6692,FAD
54,,SING,C7,C7M,no,N,54,,251421,6692,FAD
55,,DOUB,C7,C8,yes,N,55,,251421,6692,FAD
56,,SING,C7M,HM71,no,N,56,,251421,6692,FAD
57,,SING,C7M,HM72,no,N,57,,251421,6692,FAD
58,,SING,C7M,HM73,no,N,58,,251421,6692,FAD
59,,SING,C8,C8M,no,N,59,,251421,6692,FAD
60,,SING,C8,C9,yes,N,60,,251421,6692,FAD
61,,SING,C8M,HM81,no,N,61,,251421,6692,FAD
62,,SING,C8M,HM82,no,N,62,,251421,6692,FAD
63,,SING,C8M,HM83,no,N,63,,251421,6692,FAD
64,,DOUB,C9,C9A,yes,N,64,,251421,6692,FAD
65,,SING,C9,H9,no,N,65,,251421,6692,FAD
66,,SING,C9A,N10,no,N,66,,251421,6692,FAD
67,,SING,N10,C10,no,N,67,,251421,6692,FAD
68,,SING,N10,C1',no,N,68,,251421,6692,FAD
69,,SING,C1',C2',no,N,69,,251421,6692,FAD
70,,SING,C1',H1'1,no,N,70,,251421,6692,FAD
71,,SING,C1',H1'2,no,N,71,,251421,6692,FAD
72,,SING,C2',O2',no,N,72,,251421,6692,FAD
73,,SING,C2',C3',no,N,73,,251421,6692,FAD
74,,SING,C2',H2',no,N,74,,251421,6692,FAD
75,,SING,O2',HO2',no,N,75,,251421,6692,FAD
76,,SING,C3',O3',no,N,76,,251421,6692,FAD
77,,SING,C3',C4',no,N,77,,251421,6692,FAD
78,,SING,C3',H3',no,N,78,,251421,6692,FAD
79,,SING,O3',HO3',no,N,79,,251421,6692,FAD
80,,SING,C4',O4',no,N,80,,251421,6692,FAD
81,,SING,C4',C5',no,N,81,,251421,6692,FAD
82,,SING,C4',H4',no,N,82,,251421,6692,FAD
83,,SING,O4',HO4',no,N,83,,251421,6692,FAD
84,,SING,C5',O5',no,N,84,,251421,6692,FAD
85,,SING,C5',H5'1,no,N,85,,251421,6692,FAD
86,,SING,C5',H5'2,no,N,86,,251421,6692,FAD
87,,SING,O5',P,no,N,87,,251421,6692,FAD
88,,DOUB,P,O1P,no,N,88,,251421,6692,FAD
89,,SING,P,O2P,no,N,89,,251421,6692,FAD
90,,SING,P,O3P,no,N,90,,251421,6692,FAD
91,,SING,O2P,HOP2,no,N,91,,251421,6692,FAD
1,,DOUB,PA,O1A,no,N,1,,251501,6695,FAD
2,,SING,PA,O2A,no,N,2,,251501,6695,FAD
3,,SING,PA,O5B,no,N,3,,251501,6695,FAD
4,,SING,PA,O3P,no,N,4,,251501,6695,FAD
5,,SING,O2A,HOA2,no,N,5,,251501,6695,FAD
6,,SING,O5B,C5B,no,N,6,,251501,6695,FAD
7,,SING,C5B,C4B,no,N,7,,251501,6695,FAD
8,,SING,C5B,H51A,no,N,8,,251501,6695,FAD
9,,SING,C5B,H52A,no,N,9,,251501,6695,FAD
10,,SING,C4B,O4B,no,N,10,,251501,6695,FAD
11,,SING,C4B,C3B,no,N,11,,251501,6695,FAD
12,,SING,C4B,H4B,no,N,12,,251501,6695,FAD
13,,SING,O4B,C1B,no,N,13,,251501,6695,FAD
14,,SING,C3B,O3B,no,N,14,,251501,6695,FAD
15,,SING,C3B,C2B,no,N,15,,251501,6695,FAD
16,,SING,C3B,H3B,no,N,16,,251501,6695,FAD
17,,SING,O3B,HO3A,no,N,17,,251501,6695,FAD
18,,SING,C2B,O2B,no,N,18,,251501,6695,FAD
19,,SING,C2B,C1B,no,N,19,,251501,6695,FAD
20,,SING,C2B,H2B,no,N,20,,251501,6695,FAD
21,,SING,O2B,HO2A,no,N,21,,251501,6695,FAD
22,,SING,C1B,N9A,no,N,22,,251501,6695,FAD
23,,SING,C1B,H1B,no,N,23,,251501,6695,FAD
24,,SING,N9A,C8A,yes,N,24,,251501,6695,FAD
25,,SING,N9A,C4A,yes,N,25,,251501,6695,FAD
26,,DOUB,C8A,N7A,yes,N,26,,251501,6695,FAD
27,,SING,C8A,H8A,no,N,27,,251501,6695,FAD
28,,SING,N7A,C5A,yes,N,28,,251501,6695,FAD
29,,SING,C5A,C6A,yes,N,29,,251501,6695,FAD
30,,DOUB,C5A,C4A,yes,N,30,,251501,6695,FAD
31,,SING,C6A,N6A,no,N,31,,251501,6695,FAD
32,,DOUB,C6A,N1A,yes,N,32,,251501,6695,FAD
33,,SING,N6A,H61A,no,N,33,,251501,6695,FAD
34,,SING,N6A,H62A,no,N,34,,251501,6695,FAD
35,,SING,N1A,C2A,yes,N,35,,251501,6695,FAD
36,,DOUB,C2A,N3A,yes,N,36,,251501,6695,FAD
37,,SING,C2A,H2A,no,N,37,,251501,6695,FAD
38,,SING,N3A,C4A,yes,N,38,,251501,6695,FAD
39,,SING,N1,C2,no,N,39,,251501,6695,FAD
40,,DOUB,N1,C10,no,N,40,,251501,6695,FAD
41,,DOUB,C2,O2,no,N,41,,251501,6695,FAD
42,,SING,C2,N3,no,N,42,,251501,6695,FAD
43,,SING,N3,C4,no,N,43,,251501,6695,FAD
44,,SING,N3,HN3,no,N,44,,251501,6695,FAD
45,,DOUB,C4,O4,no,N,45,,251501,6695,FAD
46,,SING,C4,C4X,no,N,46,,251501,6695,FAD
47,,DOUB,C4X,N5,no,N,47,,251501,6695,FAD
48,,SING,C4X,C10,no,N,48,,251501,6695,FAD
49,,SING,N5,C5X,no,N,49,,251501,6695,FAD
50,,DOUB,C5X,C6,yes,N,50,,251501,6695,FAD
51,,SING,C5X,C9A,yes,N,51,,251501,6695,FAD
52,,SING,C6,C7,yes,N,52,,251501,6695,FAD
53,,SING,C6,H6,no,N,53,,251501,6695,FAD
54,,SING,C7,C7M,no,N,54,,251501,6695,FAD
55,,DOUB,C7,C8,yes,N,55,,251501,6695,FAD
56,,SING,C7M,HM71,no,N,56,,251501,6695,FAD
57,,SING,C7M,HM72,no,N,57,,251501,6695,FAD
58,,SING,C7M,HM73,no,N,58,,251501,6695,FAD
59,,SING,C8,C8M,no,N,59,,251501,6695,FAD
60,,SING,C8,C9,yes,N,60,,251501,6695,FAD
61,,SING,C8M,HM81,no,N,61,,251501,6695,FAD
62,,SING,C8M,HM82,no,N,62,,251501,6695,FAD
63,,SING,C8M,HM83,no,N,63,,251501,6695,FAD
64,,DOUB,C9,C9A,yes,N,64,,251501,6695,FAD
65,,SING,C9,H9,no,N,65,,251501,6695,FAD
66,,SING,C9A,N10,no,N,66,,251501,6695,FAD
67,,SING,N10,C10,no,N,67,,251501,6695,FAD
68,,SING,N10,C1',no,N,68,,251501,6695,FAD
69,,SING,C1',C2',no,N,69,,251501,6695,FAD
70,,SING,C1',H1'1,no,N,70,,251501,6695,FAD
71,,SING,C1',H1'2,no,N,71,,251501,6695,FAD
72,,SING,C2',O2',no,N,72,,251501,6695,FAD
73,,SING,C2',C3',no,N,73,,251501,6695,FAD
74,,SING,C2',H2',no,N,74,,251501,6695,FAD
75,,SING,O2',HO2',no,N,75,,251501,6695,FAD
76,,SING,C3',O3',no,N,76,,251501,6695,FAD
77,,SING,C3',C4',no,N,77,,251501,6695,FAD
78,,SING,C3',H3',no,N,78,,251501,6695,FAD
79,,SING,O3',HO3',no,N,79,,251501,6695,FAD
80,,SING,C4',O4',no,N,80,,251501,6695,FAD
81,,SING,C4',C5',no,N,81,,251501,6695,FAD
82,,SING,C4',H4',no,N,82,,251501,6695,FAD
83,,SING,O4',HO4',no,N,83,,251501,6695,FAD
84,,SING,C5',O5',no,N,84,,251501,6695,FAD
85,,SING,C5',H5'1,no,N,85,,251501,6695,FAD
86,,SING,C5',H5'2,no,N,86,,251501,6695,FAD
87,,SING,O5',P,no,N,87,,251501,6695,FAD
88,,DOUB,P,O1P,no,N,88,,251501,6695,FAD
89,,SING,P,O2P,no,N,89,,251501,6695,FAD
90,,SING,P,O3P,no,N,90,,251501,6695,FAD
91,,SING,O2P,HOP2,no,N,91,,251501,6695,FAD
1,,DOUB,C,O,no,N,1,,251520,6696,ACE
2,,SING,C,CH3,no,N,2,,251520,6696,ACE
3,,SING,C,H,no,N,3,,251520,6696,ACE
4,,SING,CH3,H1,no,N,4,,251520,6696,ACE
5,,SING,CH3,H2,no,N,5,,251520,6696,ACE
6,,SING,CH3,H3,no,N,6,,251520,6696,ACE
1,,SING,C1,C2,no,N,1,,251875,672,AAC
2,,SING,C1,O1,no,N,2,,251875,672,AAC
3,,DOUB,C1,O2,no,N,3,,251875,672,AAC
4,,SING,C2,N1,no,N,4,,251875,672,AAC
5,,SING,C2,HC21,no,N,5,,251875,672,AAC
6,,SING,C2,HC22,no,N,6,,251875,672,AAC
7,,SING,C3,C4,no,N,7,,251875,672,AAC
8,,SING,C3,N1,no,N,8,,251875,672,AAC
9,,DOUB,C3,O3,no,N,9,,251875,672,AAC
10,,SING,C4,HC41,no,N,10,,251875,672,AAC
11,,SING,C4,HC42,no,N,11,,251875,672,AAC
12,,SING,C4,HC43,no,N,12,,251875,672,AAC
13,,SING,N1,HN1,no,N,13,,251875,672,AAC
14,,SING,O1,HO1,no,N,14,,251875,672,AAC
1,,SING,FE,NA,no,N,1,,251876,672,HEC
2,,SING,FE,NB,no,N,2,,251876,672,HEC
3,,SING,FE,NC,no,N,3,,251876,672,HEC
4,,SING,FE,ND,no,N,4,,251876,672,HEC
5,,DOUB,CHA,C1A,no,N,5,,251876,672,HEC
6,,SING,CHA,C4D,no,N,6,,251876,672,HEC
7,,SING,CHA,HHA,no,N,7,,251876,672,HEC
8,,DOUB,CHB,C4A,no,N,8,,251876,672,HEC
9,,SING,CHB,C1B,no,N,9,,251876,672,HEC
10,,SING,CHB,HHB,no,N,10,,251876,672,HEC
11,,DOUB,CHC,C4B,no,N,11,,251876,672,HEC
12,,SING,CHC,C1C,no,N,12,,251876,672,HEC
13,,SING,CHC,HHC,no,N,13,,251876,672,HEC
14,,DOUB,CHD,C4C,no,N,14,,251876,672,HEC
15,,SING,CHD,C1D,no,N,15,,251876,672,HEC
16,,SING,CHD,HHD,no,N,16,,251876,672,HEC
17,,SING,NA,C1A,yes,N,17,,251876,672,HEC
18,,SING,NA,C4A,yes,N,18,,251876,672,HEC
19,,SING,C1A,C2A,yes,N,19,,251876,672,HEC
20,,DOUB,C2A,C3A,yes,N,20,,251876,672,HEC
21,,SING,C2A,CAA,no,N,21,,251876,672,HEC
22,,SING,C3A,C4A,yes,N,22,,251876,672,HEC
23,,SING,C3A,CMA,no,N,23,,251876,672,HEC
24,,SING,CMA,HMA1,no,N,24,,251876,672,HEC
25,,SING,CMA,HMA2,no,N,25,,251876,672,HEC
26,,SING,CMA,HMA3,no,N,26,,251876,672,HEC
27,,SING,CAA,CBA,no,N,27,,251876,672,HEC
28,,SING,CAA,HAA1,no,N,28,,251876,672,HEC
29,,SING,CAA,HAA2,no,N,29,,251876,672,HEC
30,,SING,CBA,CGA,no,N,30,,251876,672,HEC
31,,SING,CBA,HBA1,no,N,31,,251876,672,HEC
32,,SING,CBA,HBA2,no,N,32,,251876,672,HEC
33,,DOUB,CGA,O1A,no,N,33,,251876,672,HEC
34,,SING,CGA,O2A,no,N,34,,251876,672,HEC
35,,SING,O2A,H2A,no,N,35,,251876,672,HEC
36,,SING,NB,C1B,yes,N,36,,251876,672,HEC
37,,SING,NB,C4B,yes,N,37,,251876,672,HEC
38,,DOUB,C1B,C2B,yes,N,38,,251876,672,HEC
39,,SING,C2B,C3B,yes,N,39,,251876,672,HEC
40,,SING,C2B,CMB,no,N,40,,251876,672,HEC
41,,SING,C3B,C4B,yes,N,41,,251876,672,HEC
42,,DOUB,C3B,CAB,no,E,42,,251876,672,HEC
43,,SING,CMB,HMB1,no,N,43,,251876,672,HEC
44,,SING,CMB,HMB2,no,N,44,,251876,672,HEC
45,,SING,CMB,HMB3,no,N,45,,251876,672,HEC
46,,SING,CAB,CBB,no,N,46,,251876,672,HEC
47,,SING,CAB,HAB,no,N,47,,251876,672,HEC
48,,SING,CBB,HBB1,no,N,48,,251876,672,HEC
49,,SING,CBB,HBB2,no,N,49,,251876,672,HEC
50,,SING,CBB,HBB3,no,N,50,,251876,672,HEC
51,,SING,NC,C1C,yes,N,51,,251876,672,HEC
52,,SING,NC,C4C,yes,N,52,,251876,672,HEC
53,,DOUB,C1C,C2C,yes,N,53,,251876,672,HEC
54,,SING,C2C,C3C,yes,N,54,,251876,672,HEC
55,,SING,C2C,CMC,no,N,55,,251876,672,HEC
56,,SING,C3C,C4C,yes,N,56,,251876,672,HEC
57,,DOUB,C3C,CAC,no,E,57,,251876,672,HEC
58,,SING,CMC,HMC1,no,N,58,,251876,672,HEC
59,,SING,CMC,HMC2,no,N,59,,251876,672,HEC
60,,SING,CMC,HMC3,no,N,60,,251876,672,HEC
61,,SING,CAC,CBC,no,N,61,,251876,672,HEC
62,,SING,CAC,HAC,no,N,62,,251876,672,HEC
63,,SING,CBC,HBC1,no,N,63,,251876,672,HEC
64,,SING,CBC,HBC2,no,N,64,,251876,672,HEC
65,,SING,CBC,HBC3,no,N,65,,251876,672,HEC
66,,SING,ND,C1D,yes,N,66,,251876,672,HEC
67,,SING,ND,C4D,yes,N,67,,251876,672,HEC
68,,DOUB,C1D,C2D,yes,N,68,,251876,672,HEC
69,,SING,C2D,C3D,yes,N,69,,251876,672,HEC
70,,SING,C2D,CMD,no,N,70,,251876,672,HEC
71,,DOUB,C3D,C4D,yes,N,71,,251876,672,HEC
72,,SING,C3D,CAD,no,N,72,,251876,672,HEC
73,,SING,CMD,HMD1,no,N,73,,251876,672,HEC
74,,SING,CMD,HMD2,no,N,74,,251876,672,HEC
75,,SING,CMD,HMD3,no,N,75,,251876,672,HEC
76,,SING,CAD,CBD,no,N,76,,251876,672,HEC
77,,SING,CAD,HAD1,no,N,77,,251876,672,HEC
78,,SING,CAD,HAD2,no,N,78,,251876,672,HEC
79,,SING,CBD,CGD,no,N,79,,251876,672,HEC
80,,SING,CBD,HBD1,no,N,80,,251876,672,HEC
81,,SING,CBD,HBD2,no,N,81,,251876,672,HEC
82,,DOUB,CGD,O1D,no,N,82,,251876,672,HEC
83,,SING,CGD,O2D,no,N,83,,251876,672,HEC
84,,SING,O2D,H2D,no,N,84,,251876,672,HEC
1,,SING,N,HN1,no,N,1,,251890,6720,NH2
2,,SING,N,HN2,no,N,2,,251890,6720,NH2
1,,SING,N,CA,no,N,1,,252041,6728,PCA
2,,SING,N,CD,no,N,2,,252041,6728,PCA
3,,SING,N,H,no,N,3,,252041,6728,PCA
4,,SING,CA,CB,no,N,4,,252041,6728,PCA
5,,SING,CA,C,no,N,5,,252041,6728,PCA
6,,SING,CA,HA,no,N,6,,252041,6728,PCA
7,,SING,CB,CG,no,N,7,,252041,6728,PCA
8,,SING,CB,HB2,no,N,8,,252041,6728,PCA
9,,SING,CB,HB3,no,N,9,,252041,6728,PCA
10,,SING,CG,CD,no,N,10,,252041,6728,PCA
11,,SING,CG,HG2,no,N,11,,252041,6728,PCA
12,,SING,CG,HG3,no,N,12,,252041,6728,PCA
13,,DOUB,CD,OE,no,N,13,,252041,6728,PCA
14,,DOUB,C,O,no,N,14,,252041,6728,PCA
15,,SING,C,OXT,no,N,15,,252041,6728,PCA
16,,SING,OXT,HXT,no,N,16,,252041,6728,PCA
1,,SING,C1,C2,no,N,1,,252073,673,AAC
2,,SING,C1,O1,no,N,2,,252073,673,AAC
3,,DOUB,C1,O2,no,N,3,,252073,673,AAC
4,,SING,C2,N1,no,N,4,,252073,673,AAC
5,,SING,C2,HC21,no,N,5,,252073,673,AAC
6,,SING,C2,HC22,no,N,6,,252073,673,AAC
7,,SING,C3,C4,no,N,7,,252073,673,AAC
8,,SING,C3,N1,no,N,8,,252073,673,AAC
9,,DOUB,C3,O3,no,N,9,,252073,673,AAC
10,,SING,C4,HC41,no,N,10,,252073,673,AAC
11,,SING,C4,HC42,no,N,11,,252073,673,AAC
12,,SING,C4,HC43,no,N,12,,252073,673,AAC
13,,SING,N1,HN1,no,N,13,,252073,673,AAC
14,,SING,O1,HO1,no,N,14,,252073,673,AAC
1,,SING,FE,NA,no,N,1,,252074,673,HEC
2,,SING,FE,NB,no,N,2,,252074,673,HEC
3,,SING,FE,NC,no,N,3,,252074,673,HEC
4,,SING,FE,ND,no,N,4,,252074,673,HEC
5,,DOUB,CHA,C1A,no,N,5,,252074,673,HEC
6,,SING,CHA,C4D,no,N,6,,252074,673,HEC
7,,SING,CHA,HHA,no,N,7,,252074,673,HEC
8,,DOUB,CHB,C4A,no,N,8,,252074,673,HEC
9,,SING,CHB,C1B,no,N,9,,252074,673,HEC
10,,SING,CHB,HHB,no,N,10,,252074,673,HEC
11,,DOUB,CHC,C4B,no,N,11,,252074,673,HEC
12,,SING,CHC,C1C,no,N,12,,252074,673,HEC
13,,SING,CHC,HHC,no,N,13,,252074,673,HEC
14,,DOUB,CHD,C4C,no,N,14,,252074,673,HEC
15,,SING,CHD,C1D,no,N,15,,252074,673,HEC
16,,SING,CHD,HHD,no,N,16,,252074,673,HEC
17,,SING,NA,C1A,yes,N,17,,252074,673,HEC
18,,SING,NA,C4A,yes,N,18,,252074,673,HEC
19,,SING,C1A,C2A,yes,N,19,,252074,673,HEC
20,,DOUB,C2A,C3A,yes,N,20,,252074,673,HEC
21,,SING,C2A,CAA,no,N,21,,252074,673,HEC
22,,SING,C3A,C4A,yes,N,22,,252074,673,HEC
23,,SING,C3A,CMA,no,N,23,,252074,673,HEC
24,,SING,CMA,HMA1,no,N,24,,252074,673,HEC
25,,SING,CMA,HMA2,no,N,25,,252074,673,HEC
26,,SING,CMA,HMA3,no,N,26,,252074,673,HEC
27,,SING,CAA,CBA,no,N,27,,252074,673,HEC
28,,SING,CAA,HAA1,no,N,28,,252074,673,HEC
29,,SING,CAA,HAA2,no,N,29,,252074,673,HEC
30,,SING,CBA,CGA,no,N,30,,252074,673,HEC
31,,SING,CBA,HBA1,no,N,31,,252074,673,HEC
32,,SING,CBA,HBA2,no,N,32,,252074,673,HEC
33,,DOUB,CGA,O1A,no,N,33,,252074,673,HEC
34,,SING,CGA,O2A,no,N,34,,252074,673,HEC
35,,SING,O2A,H2A,no,N,35,,252074,673,HEC
36,,SING,NB,C1B,yes,N,36,,252074,673,HEC
37,,SING,NB,C4B,yes,N,37,,252074,673,HEC
38,,DOUB,C1B,C2B,yes,N,38,,252074,673,HEC
39,,SING,C2B,C3B,yes,N,39,,252074,673,HEC
40,,SING,C2B,CMB,no,N,40,,252074,673,HEC
41,,SING,C3B,C4B,yes,N,41,,252074,673,HEC
42,,DOUB,C3B,CAB,no,E,42,,252074,673,HEC
43,,SING,CMB,HMB1,no,N,43,,252074,673,HEC
44,,SING,CMB,HMB2,no,N,44,,252074,673,HEC
45,,SING,CMB,HMB3,no,N,45,,252074,673,HEC
46,,SING,CAB,CBB,no,N,46,,252074,673,HEC
47,,SING,CAB,HAB,no,N,47,,252074,673,HEC
48,,SING,CBB,HBB1,no,N,48,,252074,673,HEC
49,,SING,CBB,HBB2,no,N,49,,252074,673,HEC
50,,SING,CBB,HBB3,no,N,50,,252074,673,HEC
51,,SING,NC,C1C,yes,N,51,,252074,673,HEC
52,,SING,NC,C4C,yes,N,52,,252074,673,HEC
53,,DOUB,C1C,C2C,yes,N,53,,252074,673,HEC
54,,SING,C2C,C3C,yes,N,54,,252074,673,HEC
55,,SING,C2C,CMC,no,N,55,,252074,673,HEC
56,,SING,C3C,C4C,yes,N,56,,252074,673,HEC
57,,DOUB,C3C,CAC,no,E,57,,252074,673,HEC
58,,SING,CMC,HMC1,no,N,58,,252074,673,HEC
59,,SING,CMC,HMC2,no,N,59,,252074,673,HEC
60,,SING,CMC,HMC3,no,N,60,,252074,673,HEC
61,,SING,CAC,CBC,no,N,61,,252074,673,HEC
62,,SING,CAC,HAC,no,N,62,,252074,673,HEC
63,,SING,CBC,HBC1,no,N,63,,252074,673,HEC
64,,SING,CBC,HBC2,no,N,64,,252074,673,HEC
65,,SING,CBC,HBC3,no,N,65,,252074,673,HEC
66,,SING,ND,C1D,yes,N,66,,252074,673,HEC
67,,SING,ND,C4D,yes,N,67,,252074,673,HEC
68,,DOUB,C1D,C2D,yes,N,68,,252074,673,HEC
69,,SING,C2D,C3D,yes,N,69,,252074,673,HEC
70,,SING,C2D,CMD,no,N,70,,252074,673,HEC
71,,DOUB,C3D,C4D,yes,N,71,,252074,673,HEC
72,,SING,C3D,CAD,no,N,72,,252074,673,HEC
73,,SING,CMD,HMD1,no,N,73,,252074,673,HEC
74,,SING,CMD,HMD2,no,N,74,,252074,673,HEC
75,,SING,CMD,HMD3,no,N,75,,252074,673,HEC
76,,SING,CAD,CBD,no,N,76,,252074,673,HEC
77,,SING,CAD,HAD1,no,N,77,,252074,673,HEC
78,,SING,CAD,HAD2,no,N,78,,252074,673,HEC
79,,SING,CBD,CGD,no,N,79,,252074,673,HEC
80,,SING,CBD,HBD1,no,N,80,,252074,673,HEC
81,,SING,CBD,HBD2,no,N,81,,252074,673,HEC
82,,DOUB,CGD,O1D,no,N,82,,252074,673,HEC
83,,SING,CGD,O2D,no,N,83,,252074,673,HEC
84,,SING,O2D,H2D,no,N,84,,252074,673,HEC
1,,SING,N,CA,no,N,1,,252828,6775,DIL
2,,SING,N,H,no,N,2,,252828,6775,DIL
3,,SING,N,H2,no,N,3,,252828,6775,DIL
4,,SING,CA,C,no,N,4,,252828,6775,DIL
5,,SING,CA,CB,no,N,5,,252828,6775,DIL
6,,SING,CA,HA,no,N,6,,252828,6775,DIL
7,,DOUB,C,O,no,N,7,,252828,6775,DIL
8,,SING,C,OXT,no,N,8,,252828,6775,DIL
9,,SING,CB,CG1,no,N,9,,252828,6775,DIL
10,,SING,CB,CG2,no,N,10,,252828,6775,DIL
11,,SING,CB,HB,no,N,11,,252828,6775,DIL
12,,SING,CG1,CD1,no,N,12,,252828,6775,DIL
13,,SING,CG1,HG12,no,N,13,,252828,6775,DIL
14,,SING,CG1,HG13,no,N,14,,252828,6775,DIL
15,,SING,CG2,HG21,no,N,15,,252828,6775,DIL
16,,SING,CG2,HG22,no,N,16,,252828,6775,DIL
17,,SING,CG2,HG23,no,N,17,,252828,6775,DIL
18,,SING,CD1,HD11,no,N,18,,252828,6775,DIL
19,,SING,CD1,HD12,no,N,19,,252828,6775,DIL
20,,SING,CD1,HD13,no,N,20,,252828,6775,DIL
21,,SING,OXT,HXT,no,N,21,,252828,6775,DIL
1,,SING,C1,C2,no,N,1,,253043,6785,TSA
2,,SING,C1,C6,no,N,2,,253043,6785,TSA
3,,SING,C1,C9,no,N,3,,253043,6785,TSA
4,,SING,C1,C10,no,N,4,,253043,6785,TSA
5,,DOUB,C2,C3,no,N,5,,253043,6785,TSA
6,,SING,C2,H2,no,N,6,,253043,6785,TSA
7,,SING,C3,C4,no,N,7,,253043,6785,TSA
8,,SING,C3,H3,no,N,8,,253043,6785,TSA
9,,SING,C4,O5,no,N,9,,253043,6785,TSA
10,,SING,C4,C5,no,N,10,,253043,6785,TSA
11,,SING,C4,H4,no,N,11,,253043,6785,TSA
12,,SING,O5,HO5,no,N,12,,253043,6785,TSA
13,,SING,C5,C6,no,N,13,,253043,6785,TSA
14,,SING,C5,O7,no,N,14,,253043,6785,TSA
15,,SING,C5,H5,no,N,15,,253043,6785,TSA
16,,SING,C6,H61,no,N,16,,253043,6785,TSA
17,,SING,C6,H62,no,N,17,,253043,6785,TSA
18,,SING,O7,C8,no,N,18,,253043,6785,TSA
19,,SING,C8,C9,no,N,19,,253043,6785,TSA
20,,SING,C8,C11,no,N,20,,253043,6785,TSA
21,,SING,C8,H8,no,N,21,,253043,6785,TSA
22,,SING,C9,H91,no,N,22,,253043,6785,TSA
23,,SING,C9,H92,no,N,23,,253043,6785,TSA
24,,DOUB,C10,O1,no,N,24,,253043,6785,TSA
25,,SING,C10,O2,no,N,25,,253043,6785,TSA
26,,SING,O2,HO2,no,N,26,,253043,6785,TSA
27,,DOUB,C11,O3,no,N,27,,253043,6785,TSA
28,,SING,C11,O4,no,N,28,,253043,6785,TSA
29,,SING,O4,HO4,no,N,29,,253043,6785,TSA
1,,SING,N,CA,no,N,1,,253110,6788,SEP
2,,SING,N,H,no,N,2,,253110,6788,SEP
3,,SING,N,H2,no,N,3,,253110,6788,SEP
4,,SING,CA,CB,no,N,4,,253110,6788,SEP
5,,SING,CA,C,no,N,5,,253110,6788,SEP
6,,SING,CA,HA,no,N,6,,253110,6788,SEP
7,,SING,CB,OG,no,N,7,,253110,6788,SEP
8,,SING,CB,HB2,no,N,8,,253110,6788,SEP
9,,SING,CB,HB3,no,N,9,,253110,6788,SEP
10,,SING,OG,P,no,N,10,,253110,6788,SEP
11,,DOUB,C,O,no,N,11,,253110,6788,SEP
12,,SING,C,OXT,no,N,12,,253110,6788,SEP
13,,SING,OXT,HXT,no,N,13,,253110,6788,SEP
14,,DOUB,P,O1P,no,N,14,,253110,6788,SEP
15,,SING,P,O2P,no,N,15,,253110,6788,SEP
16,,SING,P,O3P,no,N,16,,253110,6788,SEP
17,,SING,O2P,HOP2,no,N,17,,253110,6788,SEP
18,,SING,O3P,HOP3,no,N,18,,253110,6788,SEP
1,,SING,O23,P24,no,N,1,,253154,6790,PNS
2,,SING,O23,HOP1,no,N,2,,253154,6790,PNS
3,,SING,P24,O25,no,N,3,,253154,6790,PNS
4,,DOUB,P24,O26,no,N,4,,253154,6790,PNS
5,,SING,P24,O27,no,N,5,,253154,6790,PNS
6,,SING,O25,HOP2,no,N,6,,253154,6790,PNS
7,,SING,O27,C28,no,N,7,,253154,6790,PNS
8,,SING,C28,C29,no,N,8,,253154,6790,PNS
9,,SING,C28,H282,no,N,9,,253154,6790,PNS
10,,SING,C28,H281,no,N,10,,253154,6790,PNS
11,,SING,C29,C30,no,N,11,,253154,6790,PNS
12,,SING,C29,C31,no,N,12,,253154,6790,PNS
13,,SING,C29,C32,no,N,13,,253154,6790,PNS
14,,SING,C30,H303,no,N,14,,253154,6790,PNS
15,,SING,C30,H302,no,N,15,,253154,6790,PNS
16,,SING,C30,H301,no,N,16,,253154,6790,PNS
17,,SING,C31,H313,no,N,17,,253154,6790,PNS
18,,SING,C31,H312,no,N,18,,253154,6790,PNS
19,,SING,C31,H311,no,N,19,,253154,6790,PNS
20,,SING,C32,O33,no,N,20,,253154,6790,PNS
21,,SING,C32,C34,no,N,21,,253154,6790,PNS
22,,SING,C32,H32,no,N,22,,253154,6790,PNS
23,,SING,O33,H33,no,N,23,,253154,6790,PNS
24,,DOUB,C34,O35,no,N,24,,253154,6790,PNS
25,,SING,C34,N36,no,N,25,,253154,6790,PNS
26,,SING,N36,C37,no,N,26,,253154,6790,PNS
27,,SING,N36,H36,no,N,27,,253154,6790,PNS
28,,SING,C37,C38,no,N,28,,253154,6790,PNS
29,,SING,C37,H372,no,N,29,,253154,6790,PNS
30,,SING,C37,H371,no,N,30,,253154,6790,PNS
31,,SING,C38,C39,no,N,31,,253154,6790,PNS
32,,SING,C38,H382,no,N,32,,253154,6790,PNS
33,,SING,C38,H381,no,N,33,,253154,6790,PNS
34,,DOUB,C39,O40,no,N,34,,253154,6790,PNS
35,,SING,C39,N41,no,N,35,,253154,6790,PNS
36,,SING,N41,C42,no,N,36,,253154,6790,PNS
37,,SING,N41,H41,no,N,37,,253154,6790,PNS
38,,SING,C42,C43,no,N,38,,253154,6790,PNS
39,,SING,C42,H422,no,N,39,,253154,6790,PNS
40,,SING,C42,H421,no,N,40,,253154,6790,PNS
41,,SING,C43,S44,no,N,41,,253154,6790,PNS
42,,SING,C43,H431,no,N,42,,253154,6790,PNS
43,,SING,C43,H432,no,N,43,,253154,6790,PNS
44,,SING,S44,H44,no,N,44,,253154,6790,PNS
1,,DOUB,C1,O1,no,N,1,,253155,6790,STE
2,,SING,C1,O2,no,N,2,,253155,6790,STE
3,,SING,C1,C2,no,N,3,,253155,6790,STE
4,,SING,O2,HO2,no,N,4,,253155,6790,STE
5,,SING,C2,C3,no,N,5,,253155,6790,STE
6,,SING,C2,H21,no,N,6,,253155,6790,STE
7,,SING,C2,H22,no,N,7,,253155,6790,STE
8,,SING,C3,C4,no,N,8,,253155,6790,STE
9,,SING,C3,H31,no,N,9,,253155,6790,STE
10,,SING,C3,H32,no,N,10,,253155,6790,STE
11,,SING,C4,C5,no,N,11,,253155,6790,STE
12,,SING,C4,H41,no,N,12,,253155,6790,STE
13,,SING,C4,H42,no,N,13,,253155,6790,STE
14,,SING,C5,C6,no,N,14,,253155,6790,STE
15,,SING,C5,H51,no,N,15,,253155,6790,STE
16,,SING,C5,H52,no,N,16,,253155,6790,STE
17,,SING,C6,C7,no,N,17,,253155,6790,STE
18,,SING,C6,H61,no,N,18,,253155,6790,STE
19,,SING,C6,H62,no,N,19,,253155,6790,STE
20,,SING,C7,C8,no,N,20,,253155,6790,STE
21,,SING,C7,H71,no,N,21,,253155,6790,STE
22,,SING,C7,H72,no,N,22,,253155,6790,STE
23,,SING,C8,C9,no,N,23,,253155,6790,STE
24,,SING,C8,H81,no,N,24,,253155,6790,STE
25,,SING,C8,H82,no,N,25,,253155,6790,STE
26,,SING,C9,C10,no,N,26,,253155,6790,STE
27,,SING,C9,H91,no,N,27,,253155,6790,STE
28,,SING,C9,H92,no,N,28,,253155,6790,STE
29,,SING,C10,C11,no,N,29,,253155,6790,STE
30,,SING,C10,H101,no,N,30,,253155,6790,STE
31,,SING,C10,H102,no,N,31,,253155,6790,STE
32,,SING,C11,C12,no,N,32,,253155,6790,STE
33,,SING,C11,H111,no,N,33,,253155,6790,STE
34,,SING,C11,H112,no,N,34,,253155,6790,STE
35,,SING,C12,C13,no,N,35,,253155,6790,STE
36,,SING,C12,H121,no,N,36,,253155,6790,STE
37,,SING,C12,H122,no,N,37,,253155,6790,STE
38,,SING,C13,C14,no,N,38,,253155,6790,STE
39,,SING,C13,H131,no,N,39,,253155,6790,STE
40,,SING,C13,H132,no,N,40,,253155,6790,STE
41,,SING,C14,C15,no,N,41,,253155,6790,STE
42,,SING,C14,H141,no,N,42,,253155,6790,STE
43,,SING,C14,H142,no,N,43,,253155,6790,STE
44,,SING,C15,C16,no,N,44,,253155,6790,STE
45,,SING,C15,H151,no,N,45,,253155,6790,STE
46,,SING,C15,H152,no,N,46,,253155,6790,STE
47,,SING,C16,C17,no,N,47,,253155,6790,STE
48,,SING,C16,H161,no,N,48,,253155,6790,STE
49,,SING,C16,H162,no,N,49,,253155,6790,STE
50,,SING,C17,C18,no,N,50,,253155,6790,STE
51,,SING,C17,H171,no,N,51,,253155,6790,STE
52,,SING,C17,H172,no,N,52,,253155,6790,STE
53,,SING,C18,H181,no,N,53,,253155,6790,STE
54,,SING,C18,H182,no,N,54,,253155,6790,STE
55,,SING,C18,H183,no,N,55,,253155,6790,STE
1,,SING,N,HN1,no,N,1,,253193,6791,NH2
2,,SING,N,HN2,no,N,2,,253193,6791,NH2
1,,SING,N,HN1,no,N,1,,253210,6792,NH2
2,,SING,N,HN2,no,N,2,,253210,6792,NH2
1,,SING,C11,C21,no,N,1,,253462,6807,BCD
2,,SING,C11,O51,no,N,2,,253462,6807,BCD
3,,SING,C11,O47,no,N,3,,253462,6807,BCD
4,,SING,C11,H11,no,N,4,,253462,6807,BCD
5,,SING,C21,O21,no,N,5,,253462,6807,BCD
6,,SING,C21,C31,no,N,6,,253462,6807,BCD
7,,SING,C21,H21,no,N,7,,253462,6807,BCD
8,,SING,O21,HO21,no,N,8,,253462,6807,BCD
9,,SING,C31,O31,no,N,9,,253462,6807,BCD
10,,SING,C31,C41,no,N,10,,253462,6807,BCD
11,,SING,C31,H31,no,N,11,,253462,6807,BCD
12,,SING,O31,HO31,no,N,12,,253462,6807,BCD
13,,SING,C41,O41,no,N,13,,253462,6807,BCD
14,,SING,C41,C51,no,N,14,,253462,6807,BCD
15,,SING,C41,H41,no,N,15,,253462,6807,BCD
16,,SING,O41,C12,no,N,16,,253462,6807,BCD
17,,SING,C51,O51,no,N,17,,253462,6807,BCD
18,,SING,C51,C61,no,N,18,,253462,6807,BCD
19,,SING,C51,H51,no,N,19,,253462,6807,BCD
20,,SING,C61,O61,no,N,20,,253462,6807,BCD
21,,SING,C61,H611,no,N,21,,253462,6807,BCD
22,,SING,C61,H612,no,N,22,,253462,6807,BCD
23,,SING,O61,HO61,no,N,23,,253462,6807,BCD
24,,SING,C12,C22,no,N,24,,253462,6807,BCD
25,,SING,C12,O52,no,N,25,,253462,6807,BCD
26,,SING,C12,H12,no,N,26,,253462,6807,BCD
27,,SING,C22,O22,no,N,27,,253462,6807,BCD
28,,SING,C22,C32,no,N,28,,253462,6807,BCD
29,,SING,C22,H22,no,N,29,,253462,6807,BCD
30,,SING,O22,HO22,no,N,30,,253462,6807,BCD
31,,SING,C32,O32,no,N,31,,253462,6807,BCD
32,,SING,C32,C42,no,N,32,,253462,6807,BCD
33,,SING,C32,H32,no,N,33,,253462,6807,BCD
34,,SING,O32,HO32,no,N,34,,253462,6807,BCD
35,,SING,C42,O42,no,N,35,,253462,6807,BCD
36,,SING,C42,C52,no,N,36,,253462,6807,BCD
37,,SING,C42,H42,no,N,37,,253462,6807,BCD
38,,SING,O42,C13,no,N,38,,253462,6807,BCD
39,,SING,C52,O52,no,N,39,,253462,6807,BCD
40,,SING,C52,C62,no,N,40,,253462,6807,BCD
41,,SING,C52,H52,no,N,41,,253462,6807,BCD
42,,SING,C62,O62,no,N,42,,253462,6807,BCD
43,,SING,C62,H621,no,N,43,,253462,6807,BCD
44,,SING,C62,H622,no,N,44,,253462,6807,BCD
45,,SING,O62,HO62,no,N,45,,253462,6807,BCD
46,,SING,C13,C23,no,N,46,,253462,6807,BCD
47,,SING,C13,O53,no,N,47,,253462,6807,BCD
48,,SING,C13,H13,no,N,48,,253462,6807,BCD
49,,SING,C23,O23,no,N,49,,253462,6807,BCD
50,,SING,C23,C33,no,N,50,,253462,6807,BCD
51,,SING,C23,H23,no,N,51,,253462,6807,BCD
52,,SING,O23,HO23,no,N,52,,253462,6807,BCD
53,,SING,C33,O33,no,N,53,,253462,6807,BCD
54,,SING,C33,C43,no,N,54,,253462,6807,BCD
55,,SING,C33,H33,no,N,55,,253462,6807,BCD
56,,SING,O33,HO33,no,N,56,,253462,6807,BCD
57,,SING,C43,O43,no,N,57,,253462,6807,BCD
58,,SING,C43,C53,no,N,58,,253462,6807,BCD
59,,SING,C43,H43,no,N,59,,253462,6807,BCD
60,,SING,O43,C14,no,N,60,,253462,6807,BCD
61,,SING,C53,O53,no,N,61,,253462,6807,BCD
62,,SING,C53,C63,no,N,62,,253462,6807,BCD
63,,SING,C53,H53,no,N,63,,253462,6807,BCD
64,,SING,C63,O63,no,N,64,,253462,6807,BCD
65,,SING,C63,H631,no,N,65,,253462,6807,BCD
66,,SING,C63,H632,no,N,66,,253462,6807,BCD
67,,SING,O63,HO63,no,N,67,,253462,6807,BCD
68,,SING,C14,C24,no,N,68,,253462,6807,BCD
69,,SING,C14,O54,no,N,69,,253462,6807,BCD
70,,SING,C14,H14,no,N,70,,253462,6807,BCD
71,,SING,C24,O24,no,N,71,,253462,6807,BCD
72,,SING,C24,C34,no,N,72,,253462,6807,BCD
73,,SING,C24,H24,no,N,73,,253462,6807,BCD
74,,SING,O24,HO24,no,N,74,,253462,6807,BCD
75,,SING,C34,O34,no,N,75,,253462,6807,BCD
76,,SING,C34,C44,no,N,76,,253462,6807,BCD
77,,SING,C34,H34,no,N,77,,253462,6807,BCD
78,,SING,O34,HO34,no,N,78,,253462,6807,BCD
79,,SING,C44,O44,no,N,79,,253462,6807,BCD
80,,SING,C44,C54,no,N,80,,253462,6807,BCD
81,,SING,C44,H44,no,N,81,,253462,6807,BCD
82,,SING,O44,C15,no,N,82,,253462,6807,BCD
83,,SING,C54,O54,no,N,83,,253462,6807,BCD
84,,SING,C54,C64,no,N,84,,253462,6807,BCD
85,,SING,C54,H54,no,N,85,,253462,6807,BCD
86,,SING,C64,O64,no,N,86,,253462,6807,BCD
87,,SING,C64,H641,no,N,87,,253462,6807,BCD
88,,SING,C64,H642,no,N,88,,253462,6807,BCD
89,,SING,O64,HO64,no,N,89,,253462,6807,BCD
90,,SING,C15,C25,no,N,90,,253462,6807,BCD
91,,SING,C15,O55,no,N,91,,253462,6807,BCD
92,,SING,C15,H15,no,N,92,,253462,6807,BCD
93,,SING,C25,O25,no,N,93,,253462,6807,BCD
94,,SING,C25,C35,no,N,94,,253462,6807,BCD
95,,SING,C25,H25,no,N,95,,253462,6807,BCD
96,,SING,O25,HO25,no,N,96,,253462,6807,BCD
97,,SING,C35,O35,no,N,97,,253462,6807,BCD
98,,SING,C35,C45,no,N,98,,253462,6807,BCD
99,,SING,C35,H35,no,N,99,,253462,6807,BCD
100,,SING,O35,HO35,no,N,100,,253462,6807,BCD
101,,SING,C45,O45,no,N,101,,253462,6807,BCD
102,,SING,C45,C55,no,N,102,,253462,6807,BCD
103,,SING,C45,H45,no,N,103,,253462,6807,BCD
104,,SING,O45,C16,no,N,104,,253462,6807,BCD
105,,SING,C55,O55,no,N,105,,253462,6807,BCD
106,,SING,C55,C65,no,N,106,,253462,6807,BCD
107,,SING,C55,H55,no,N,107,,253462,6807,BCD
108,,SING,C65,O65,no,N,108,,253462,6807,BCD
109,,SING,C65,H651,no,N,109,,253462,6807,BCD
110,,SING,C65,H652,no,N,110,,253462,6807,BCD
111,,SING,O65,HO65,no,N,111,,253462,6807,BCD
112,,SING,C16,C26,no,N,112,,253462,6807,BCD
113,,SING,C16,O56,no,N,113,,253462,6807,BCD
114,,SING,C16,H16,no,N,114,,253462,6807,BCD
115,,SING,C26,O26,no,N,115,,253462,6807,BCD
116,,SING,C26,C36,no,N,116,,253462,6807,BCD
117,,SING,C26,H26,no,N,117,,253462,6807,BCD
118,,SING,O26,HO26,no,N,118,,253462,6807,BCD
119,,SING,C36,O36,no,N,119,,253462,6807,BCD
120,,SING,C36,C46,no,N,120,,253462,6807,BCD
121,,SING,C36,H36,no,N,121,,253462,6807,BCD
122,,SING,O36,HO36,no,N,122,,253462,6807,BCD
123,,SING,C46,O46,no,N,123,,253462,6807,BCD
124,,SING,C46,C56,no,N,124,,253462,6807,BCD
125,,SING,C46,H46,no,N,125,,253462,6807,BCD
126,,SING,O46,C17,no,N,126,,253462,6807,BCD
127,,SING,C56,O56,no,N,127,,253462,6807,BCD
128,,SING,C56,C66,no,N,128,,253462,6807,BCD
129,,SING,C56,H56,no,N,129,,253462,6807,BCD
130,,SING,C66,O66,no,N,130,,253462,6807,BCD
131,,SING,C66,H661,no,N,131,,253462,6807,BCD
132,,SING,C66,H662,no,N,132,,253462,6807,BCD
133,,SING,O66,HO66,no,N,133,,253462,6807,BCD
134,,SING,C17,C27,no,N,134,,253462,6807,BCD
135,,SING,C17,O57,no,N,135,,253462,6807,BCD
136,,SING,C17,H17,no,N,136,,253462,6807,BCD
137,,SING,C27,O27,no,N,137,,253462,6807,BCD
138,,SING,C27,C37,no,N,138,,253462,6807,BCD
139,,SING,C27,H27,no,N,139,,253462,6807,BCD
140,,SING,O27,HO27,no,N,140,,253462,6807,BCD
141,,SING,C37,O37,no,N,141,,253462,6807,BCD
142,,SING,C37,C47,no,N,142,,253462,6807,BCD
143,,SING,C37,H37,no,N,143,,253462,6807,BCD
144,,SING,O37,HO37,no,N,144,,253462,6807,BCD
145,,SING,C47,O47,no,N,145,,253462,6807,BCD
146,,SING,C47,C57,no,N,146,,253462,6807,BCD
147,,SING,C47,H47,no,N,147,,253462,6807,BCD
148,,SING,C57,O57,no,N,148,,253462,6807,BCD
149,,SING,C57,C67,no,N,149,,253462,6807,BCD
150,,SING,C57,H57,no,N,150,,253462,6807,BCD
151,,SING,C67,O67,no,N,151,,253462,6807,BCD
152,,SING,C67,H671,no,N,152,,253462,6807,BCD
153,,SING,C67,H672,no,N,153,,253462,6807,BCD
154,,SING,O67,HO67,no,N,154,,253462,6807,BCD
1,,DOUB,PG,O1G,no,N,1,,253575,6814,GTP
2,,SING,PG,O2G,no,N,2,,253575,6814,GTP
3,,SING,PG,O3G,no,N,3,,253575,6814,GTP
4,,SING,PG,O3B,no,N,4,,253575,6814,GTP
5,,SING,O2G,HOG2,no,N,5,,253575,6814,GTP
6,,SING,O3G,HOG3,no,N,6,,253575,6814,GTP
7,,SING,O3B,PB,no,N,7,,253575,6814,GTP
8,,DOUB,PB,O1B,no,N,8,,253575,6814,GTP
9,,SING,PB,O2B,no,N,9,,253575,6814,GTP
10,,SING,PB,O3A,no,N,10,,253575,6814,GTP
11,,SING,O2B,HOB2,no,N,11,,253575,6814,GTP
12,,SING,O3A,PA,no,N,12,,253575,6814,GTP
13,,DOUB,PA,O1A,no,N,13,,253575,6814,GTP
14,,SING,PA,O2A,no,N,14,,253575,6814,GTP
15,,SING,PA,O5',no,N,15,,253575,6814,GTP
16,,SING,O2A,HOA2,no,N,16,,253575,6814,GTP
17,,SING,O5',C5',no,N,17,,253575,6814,GTP
18,,SING,C5',C4',no,N,18,,253575,6814,GTP
19,,SING,C5',H5',no,N,19,,253575,6814,GTP
20,,SING,C5',H5'',no,N,20,,253575,6814,GTP
21,,SING,C4',O4',no,N,21,,253575,6814,GTP
22,,SING,C4',C3',no,N,22,,253575,6814,GTP
23,,SING,C4',H4',no,N,23,,253575,6814,GTP
24,,SING,O4',C1',no,N,24,,253575,6814,GTP
25,,SING,C3',O3',no,N,25,,253575,6814,GTP
26,,SING,C3',C2',no,N,26,,253575,6814,GTP
27,,SING,C3',H3',no,N,27,,253575,6814,GTP
28,,SING,O3',HO3',no,N,28,,253575,6814,GTP
29,,SING,C2',O2',no,N,29,,253575,6814,GTP
30,,SING,C2',C1',no,N,30,,253575,6814,GTP
31,,SING,C2',H2',no,N,31,,253575,6814,GTP
32,,SING,O2',HO2',no,N,32,,253575,6814,GTP
33,,SING,C1',N9,no,N,33,,253575,6814,GTP
34,,SING,C1',H1',no,N,34,,253575,6814,GTP
35,,SING,N9,C8,yes,N,35,,253575,6814,GTP
36,,SING,N9,C4,yes,N,36,,253575,6814,GTP
37,,DOUB,C8,N7,yes,N,37,,253575,6814,GTP
38,,SING,C8,H8,no,N,38,,253575,6814,GTP
39,,SING,N7,C5,yes,N,39,,253575,6814,GTP
40,,SING,C5,C6,no,N,40,,253575,6814,GTP
41,,DOUB,C5,C4,yes,N,41,,253575,6814,GTP
42,,DOUB,C6,O6,no,N,42,,253575,6814,GTP
43,,SING,C6,N1,no,N,43,,253575,6814,GTP
44,,SING,N1,C2,no,N,44,,253575,6814,GTP
45,,SING,N1,HN1,no,N,45,,253575,6814,GTP
46,,SING,C2,N2,no,N,46,,253575,6814,GTP
47,,DOUB,C2,N3,no,N,47,,253575,6814,GTP
48,,SING,N2,HN21,no,N,48,,253575,6814,GTP
49,,SING,N2,HN22,no,N,49,,253575,6814,GTP
50,,SING,N3,C4,no,N,50,,253575,6814,GTP
1,,DOUB,C,O,no,N,1,,253782,6823,ACE
2,,SING,C,CH3,no,N,2,,253782,6823,ACE
3,,SING,C,H,no,N,3,,253782,6823,ACE
4,,SING,CH3,H1,no,N,4,,253782,6823,ACE
5,,SING,CH3,H2,no,N,5,,253782,6823,ACE
6,,SING,CH3,H3,no,N,6,,253782,6823,ACE
1,,SING,CX5,CX6,no,N,1,,253783,6823,CA1
2,,SING,CX5,H1,no,N,2,,253783,6823,CA1
3,,SING,CX5,HX51,no,N,3,,253783,6823,CA1
4,,SING,CX5,HX52,no,N,4,,253783,6823,CA1
5,,SING,CX6,CX7,no,N,5,,253783,6823,CA1
6,,SING,CX6,H2,no,N,6,,253783,6823,CA1
7,,SING,CX6,H3,no,N,7,,253783,6823,CA1
8,,DOUB,CX7,OX8,no,N,8,,253783,6823,CA1
9,,SING,CX7,OX9,no,N,9,,253783,6823,CA1
10,,SING,OX9,CJ1,no,N,10,,253783,6823,CA1
11,,SING,CJ1,CJ2,no,N,11,,253783,6823,CA1
12,,SING,CJ1,H4,no,N,12,,253783,6823,CA1
13,,SING,CJ1,H5,no,N,13,,253783,6823,CA1
14,,SING,CJ2,H6,no,N,14,,253783,6823,CA1
15,,SING,CJ2,H7,no,N,15,,253783,6823,CA1
16,,SING,CJ2,H8,no,N,16,,253783,6823,CA1
1,,SING,N,HN1,no,N,1,,253877,6827,NH2
2,,SING,N,HN2,no,N,2,,253877,6827,NH2
1,,SING,P,O1,no,N,1,,253970,6832,EPP
2,,SING,P,O2,no,N,2,,253970,6832,EPP
3,,SING,P,O3,no,N,3,,253970,6832,EPP
4,,DOUB,P,O4,no,N,4,,253970,6832,EPP
5,,SING,O1,C11,no,N,5,,253970,6832,EPP
6,,SING,O2,C21,no,N,6,,253970,6832,EPP
7,,SING,O3,C1,no,N,7,,253970,6832,EPP
8,,SING,C11,C12,no,N,8,,253970,6832,EPP
9,,SING,C11,H111,no,N,9,,253970,6832,EPP
10,,SING,C11,H112,no,N,10,,253970,6832,EPP
11,,SING,C12,H121,no,N,11,,253970,6832,EPP
12,,SING,C12,H122,no,N,12,,253970,6832,EPP
13,,SING,C12,H123,no,N,13,,253970,6832,EPP
14,,SING,C21,C22,no,N,14,,253970,6832,EPP
15,,SING,C21,H211,no,N,15,,253970,6832,EPP
16,,SING,C21,H212,no,N,16,,253970,6832,EPP
17,,SING,C22,H221,no,N,17,,253970,6832,EPP
18,,SING,C22,H222,no,N,18,,253970,6832,EPP
19,,SING,C22,H223,no,N,19,,253970,6832,EPP
20,,DOUB,C1,C2,yes,N,20,,253970,6832,EPP
21,,SING,C1,C6,yes,N,21,,253970,6832,EPP
22,,SING,C2,C3,yes,N,22,,253970,6832,EPP
23,,SING,C2,H2,no,N,23,,253970,6832,EPP
24,,DOUB,C3,C4,yes,N,24,,253970,6832,EPP
25,,SING,C3,H3,no,N,25,,253970,6832,EPP
26,,SING,C4,C5,yes,N,26,,253970,6832,EPP
27,,SING,C4,N4,no,N,27,,253970,6832,EPP
28,,DOUB,C5,C6,yes,N,28,,253970,6832,EPP
29,,SING,C5,H5,no,N,29,,253970,6832,EPP
30,,SING,C6,H6,no,N,30,,253970,6832,EPP
31,,SING,N4,O5,no,N,31,,253970,6832,EPP
32,,DOUB,N4,O6,no,N,32,,253970,6832,EPP
1,,SING,FE1,S1,no,N,1,,254065,6836,FES
2,,SING,FE1,S2,no,N,2,,254065,6836,FES
3,,SING,FE2,S1,no,N,3,,254065,6836,FES
4,,SING,FE2,S2,no,N,4,,254065,6836,FES
1,,SING,N,CA,no,N,1,,254166,6839,AAR
2,,SING,N,H,no,N,2,,254166,6839,AAR
3,,SING,N,H2,no,N,3,,254166,6839,AAR
4,,SING,CA,CB,no,N,4,,254166,6839,AAR
5,,SING,CA,C,no,N,5,,254166,6839,AAR
6,,SING,CA,HA,no,N,6,,254166,6839,AAR
7,,SING,CB,CG,no,N,7,,254166,6839,AAR
8,,SING,CB,HB2,no,N,8,,254166,6839,AAR
9,,SING,CB,HB3,no,N,9,,254166,6839,AAR
10,,SING,CG,CD,no,N,10,,254166,6839,AAR
11,,SING,CG,HG2,no,N,11,,254166,6839,AAR
12,,SING,CG,HG3,no,N,12,,254166,6839,AAR
13,,SING,CD,NE,no,N,13,,254166,6839,AAR
14,,SING,CD,HD2,no,N,14,,254166,6839,AAR
15,,SING,CD,HD3,no,N,15,,254166,6839,AAR
16,,SING,NE,CZ,no,N,16,,254166,6839,AAR
17,,SING,NE,HE,no,N,17,,254166,6839,AAR
18,,SING,CZ,NH1,no,N,18,,254166,6839,AAR
19,,DOUB,CZ,NH2,no,N,19,,254166,6839,AAR
20,,SING,NH1,HH11,no,N,20,,254166,6839,AAR
21,,SING,NH1,HH12,no,N,21,,254166,6839,AAR
22,,SING,NH2,HH21,no,N,22,,254166,6839,AAR
23,,SING,NH2,HH22,no,N,23,,254166,6839,AAR
24,,DOUB,C,O,no,N,24,,254166,6839,AAR
25,,SING,C,NT,no,N,25,,254166,6839,AAR
26,,SING,NT,HNT1,no,N,26,,254166,6839,AAR
27,,SING,NT,HNT2,no,N,27,,254166,6839,AAR
1,,SING,N1,C2,no,N,1,,254435,6856,URI
2,,SING,N1,C6,no,N,2,,254435,6856,URI
3,,SING,N1,C1',no,N,3,,254435,6856,URI
4,,SING,C2,N3,no,N,4,,254435,6856,URI
5,,DOUB,C2,O2,no,N,5,,254435,6856,URI
6,,SING,N3,C4,no,N,6,,254435,6856,URI
7,,SING,N3,H3,no,N,7,,254435,6856,URI
8,,SING,C4,C5,no,N,8,,254435,6856,URI
9,,DOUB,C4,O4,no,N,9,,254435,6856,URI
10,,DOUB,C5,C6,no,N,10,,254435,6856,URI
11,,SING,C5,H5,no,N,11,,254435,6856,URI
12,,SING,C6,H6,no,N,12,,254435,6856,URI
13,,SING,C1',C2',no,N,13,,254435,6856,URI
14,,SING,C1',O4',no,N,14,,254435,6856,URI
15,,SING,C1',H1',no,N,15,,254435,6856,URI
16,,SING,C2',C3',no,N,16,,254435,6856,URI
17,,SING,C2',O2',no,N,17,,254435,6856,URI
18,,SING,C2',H2',no,N,18,,254435,6856,URI
19,,SING,C3',C4',no,N,19,,254435,6856,URI
20,,SING,C3',O3',no,N,20,,254435,6856,URI
21,,SING,C3',H3',no,N,21,,254435,6856,URI
22,,SING,C4',O4',no,N,22,,254435,6856,URI
23,,SING,C4',C5',no,N,23,,254435,6856,URI
24,,SING,C4',H4',no,N,24,,254435,6856,URI
25,,SING,O2',HO2',no,N,25,,254435,6856,URI
26,,SING,O3',HO3',no,N,26,,254435,6856,URI
27,,SING,C5',O5',no,N,27,,254435,6856,URI
28,,SING,C5',H5'1,no,N,28,,254435,6856,URI
29,,SING,C5',H5'2,no,N,29,,254435,6856,URI
30,,SING,O5',HO5',no,N,30,,254435,6856,URI
1,,SING,C1,C2,no,N,1,,254436,6856,AMU
2,,SING,C1,O1,no,N,2,,254436,6856,AMU
3,,SING,C1,O5,no,N,3,,254436,6856,AMU
4,,SING,C1,H1,no,N,4,,254436,6856,AMU
5,,SING,C2,C3,no,N,5,,254436,6856,AMU
6,,SING,C2,N2,no,N,6,,254436,6856,AMU
7,,SING,C2,H2,no,N,7,,254436,6856,AMU
8,,SING,C3,C4,no,N,8,,254436,6856,AMU
9,,SING,C3,O3,no,N,9,,254436,6856,AMU
10,,SING,C3,H3,no,N,10,,254436,6856,AMU
11,,SING,C4,C5,no,N,11,,254436,6856,AMU
12,,SING,C4,O4,no,N,12,,254436,6856,AMU
13,,SING,C4,H4,no,N,13,,254436,6856,AMU
14,,SING,C5,C6,no,N,14,,254436,6856,AMU
15,,SING,C5,O5,no,N,15,,254436,6856,AMU
16,,SING,C5,H5,no,N,16,,254436,6856,AMU
17,,SING,C6,O6,no,N,17,,254436,6856,AMU
18,,SING,C6,H61,no,N,18,,254436,6856,AMU
19,,SING,C6,H62,no,N,19,,254436,6856,AMU
20,,SING,C7,C8,no,N,20,,254436,6856,AMU
21,,DOUB,C7,O7,no,N,21,,254436,6856,AMU
22,,SING,C7,N2,no,N,22,,254436,6856,AMU
23,,SING,C8,H81,no,N,23,,254436,6856,AMU
24,,SING,C8,H82,no,N,24,,254436,6856,AMU
25,,SING,C8,H83,no,N,25,,254436,6856,AMU
26,,SING,C9,C10,no,N,26,,254436,6856,AMU
27,,SING,C9,C11,no,N,27,,254436,6856,AMU
28,,SING,C9,O3,no,N,28,,254436,6856,AMU
29,,SING,C9,H9,no,N,29,,254436,6856,AMU
30,,DOUB,C10,O10,no,N,30,,254436,6856,AMU
31,,SING,C10,O11,no,N,31,,254436,6856,AMU
32,,SING,C11,H111,no,N,32,,254436,6856,AMU
33,,SING,C11,H112,no,N,33,,254436,6856,AMU
34,,SING,C11,H113,no,N,34,,254436,6856,AMU
35,,SING,O1,HO1,no,N,35,,254436,6856,AMU
36,,SING,O4,HO4,no,N,36,,254436,6856,AMU
37,,SING,O6,HO6,no,N,37,,254436,6856,AMU
38,,SING,O11,HO11,no,N,38,,254436,6856,AMU
39,,SING,N2,HN2,no,N,39,,254436,6856,AMU
1,,SING,N,CA,no,N,1,,254437,6856,DGN
2,,SING,N,H,no,N,2,,254437,6856,DGN
3,,SING,N,H2,no,N,3,,254437,6856,DGN
4,,SING,CA,C,no,N,4,,254437,6856,DGN
5,,SING,CA,CB,no,N,5,,254437,6856,DGN
6,,SING,CA,HA,no,N,6,,254437,6856,DGN
7,,DOUB,C,O,no,N,7,,254437,6856,DGN
8,,SING,C,OXT,no,N,8,,254437,6856,DGN
9,,SING,OXT,HXT,no,N,9,,254437,6856,DGN
10,,SING,CB,CG,no,N,10,,254437,6856,DGN
11,,SING,CB,HB2,no,N,11,,254437,6856,DGN
12,,SING,CB,HB3,no,N,12,,254437,6856,DGN
13,,SING,CG,CD,no,N,13,,254437,6856,DGN
14,,SING,CG,HG2,no,N,14,,254437,6856,DGN
15,,SING,CG,HG3,no,N,15,,254437,6856,DGN
16,,DOUB,CD,OE1,no,N,16,,254437,6856,DGN
17,,SING,CD,NE2,no,N,17,,254437,6856,DGN
18,,SING,NE2,HE21,no,N,18,,254437,6856,DGN
19,,SING,NE2,HE22,no,N,19,,254437,6856,DGN
1,,SING,N,CA,no,N,1,,254438,6856,KCX
2,,SING,N,H,no,N,2,,254438,6856,KCX
3,,SING,N,HN2,no,N,3,,254438,6856,KCX
4,,SING,CA,CB,no,N,4,,254438,6856,KCX
5,,SING,CA,C,no,N,5,,254438,6856,KCX
6,,SING,CA,HA,no,N,6,,254438,6856,KCX
7,,SING,CB,CG,no,N,7,,254438,6856,KCX
8,,SING,CB,HB2,no,N,8,,254438,6856,KCX
9,,SING,CB,HB3,no,N,9,,254438,6856,KCX
10,,SING,CG,CD,no,N,10,,254438,6856,KCX
11,,SING,CG,HG2,no,N,11,,254438,6856,KCX
12,,SING,CG,HG3,no,N,12,,254438,6856,KCX
13,,SING,CD,CE,no,N,13,,254438,6856,KCX
14,,SING,CD,HD2,no,N,14,,254438,6856,KCX
15,,SING,CD,HD3,no,N,15,,254438,6856,KCX
16,,SING,CE,NZ,no,N,16,,254438,6856,KCX
17,,SING,CE,HE2,no,N,17,,254438,6856,KCX
18,,SING,CE,HE3,no,N,18,,254438,6856,KCX
19,,SING,NZ,CX,no,N,19,,254438,6856,KCX
20,,SING,NZ,HZ,no,N,20,,254438,6856,KCX
21,,DOUB,C,O,no,N,21,,254438,6856,KCX
22,,SING,C,OXT,no,N,22,,254438,6856,KCX
23,,DOUB,CX,OQ1,no,N,23,,254438,6856,KCX
24,,SING,CX,OQ2,no,N,24,,254438,6856,KCX
25,,SING,OXT,HXT,no,N,25,,254438,6856,KCX
26,,SING,OQ2,HQ2,no,N,26,,254438,6856,KCX
1,,SING,N,CA,no,N,1,,254439,6856,DAL
2,,SING,N,H,no,N,2,,254439,6856,DAL
3,,SING,N,H2,no,N,3,,254439,6856,DAL
4,,SING,CA,CB,no,N,4,,254439,6856,DAL
5,,SING,CA,C,no,N,5,,254439,6856,DAL
6,,SING,CA,HA,no,N,6,,254439,6856,DAL
7,,SING,CB,HB1,no,N,7,,254439,6856,DAL
8,,SING,CB,HB2,no,N,8,,254439,6856,DAL
9,,SING,CB,HB3,no,N,9,,254439,6856,DAL
10,,DOUB,C,O,no,N,10,,254439,6856,DAL
11,,SING,C,OXT,no,N,11,,254439,6856,DAL
12,,SING,OXT,HXT,no,N,12,,254439,6856,DAL
1,,SING,N1,C2,no,N,1,,254479,6858,UDP
2,,SING,N1,C6,no,N,2,,254479,6858,UDP
3,,SING,N1,C1',no,N,3,,254479,6858,UDP
4,,SING,C2,N3,no,N,4,,254479,6858,UDP
5,,DOUB,C2,O2,no,N,5,,254479,6858,UDP
6,,SING,N3,C4,no,N,6,,254479,6858,UDP
7,,SING,N3,HN3,no,N,7,,254479,6858,UDP
8,,SING,C4,C5,no,N,8,,254479,6858,UDP
9,,DOUB,C4,O4,no,N,9,,254479,6858,UDP
10,,DOUB,C5,C6,no,N,10,,254479,6858,UDP
11,,SING,C5,H5,no,N,11,,254479,6858,UDP
12,,SING,C6,H6,no,N,12,,254479,6858,UDP
13,,SING,C1',C2',no,N,13,,254479,6858,UDP
14,,SING,C1',O4',no,N,14,,254479,6858,UDP
15,,SING,C1',H1',no,N,15,,254479,6858,UDP
16,,SING,C2',O2',no,N,16,,254479,6858,UDP
17,,SING,C2',C3',no,N,17,,254479,6858,UDP
18,,SING,C2',H2',no,N,18,,254479,6858,UDP
19,,SING,O2',HO2',no,N,19,,254479,6858,UDP
20,,SING,C3',C4',no,N,20,,254479,6858,UDP
21,,SING,C3',O3',no,N,21,,254479,6858,UDP
22,,SING,C3',H3',no,N,22,,254479,6858,UDP
23,,SING,C4',O4',no,N,23,,254479,6858,UDP
24,,SING,C4',C5',no,N,24,,254479,6858,UDP
25,,SING,C4',H4',no,N,25,,254479,6858,UDP
26,,SING,O3',HO3',no,N,26,,254479,6858,UDP
27,,SING,C5',O5',no,N,27,,254479,6858,UDP
28,,SING,C5',H5'1,no,N,28,,254479,6858,UDP
29,,SING,C5',H5'2,no,N,29,,254479,6858,UDP
30,,SING,O5',PA,no,N,30,,254479,6858,UDP
31,,DOUB,PA,O1A,no,N,31,,254479,6858,UDP
32,,SING,PA,O2A,no,N,32,,254479,6858,UDP
33,,SING,PA,O3A,no,N,33,,254479,6858,UDP
34,,SING,O2A,HOA2,no,N,34,,254479,6858,UDP
35,,SING,O3A,PB,no,N,35,,254479,6858,UDP
36,,DOUB,PB,O1B,no,N,36,,254479,6858,UDP
37,,SING,PB,O2B,no,N,37,,254479,6858,UDP
38,,SING,PB,O3B,no,N,38,,254479,6858,UDP
39,,SING,O2B,HOB2,no,N,39,,254479,6858,UDP
40,,SING,O3B,HOB3,no,N,40,,254479,6858,UDP
1,,SING,C1,C2,no,N,1,,254480,6858,AMU
2,,SING,C1,O1,no,N,2,,254480,6858,AMU
3,,SING,C1,O5,no,N,3,,254480,6858,AMU
4,,SING,C1,H1,no,N,4,,254480,6858,AMU
5,,SING,C2,C3,no,N,5,,254480,6858,AMU
6,,SING,C2,N2,no,N,6,,254480,6858,AMU
7,,SING,C2,H2,no,N,7,,254480,6858,AMU
8,,SING,C3,C4,no,N,8,,254480,6858,AMU
9,,SING,C3,O3,no,N,9,,254480,6858,AMU
10,,SING,C3,H3,no,N,10,,254480,6858,AMU
11,,SING,C4,C5,no,N,11,,254480,6858,AMU
12,,SING,C4,O4,no,N,12,,254480,6858,AMU
13,,SING,C4,H4,no,N,13,,254480,6858,AMU
14,,SING,C5,C6,no,N,14,,254480,6858,AMU
15,,SING,C5,O5,no,N,15,,254480,6858,AMU
16,,SING,C5,H5,no,N,16,,254480,6858,AMU
17,,SING,C6,O6,no,N,17,,254480,6858,AMU
18,,SING,C6,H61,no,N,18,,254480,6858,AMU
19,,SING,C6,H62,no,N,19,,254480,6858,AMU
20,,SING,C7,C8,no,N,20,,254480,6858,AMU
21,,DOUB,C7,O7,no,N,21,,254480,6858,AMU
22,,SING,C7,N2,no,N,22,,254480,6858,AMU
23,,SING,C8,H81,no,N,23,,254480,6858,AMU
24,,SING,C8,H82,no,N,24,,254480,6858,AMU
25,,SING,C8,H83,no,N,25,,254480,6858,AMU
26,,SING,C9,C10,no,N,26,,254480,6858,AMU
27,,SING,C9,C11,no,N,27,,254480,6858,AMU
28,,SING,C9,O3,no,N,28,,254480,6858,AMU
29,,SING,C9,H9,no,N,29,,254480,6858,AMU
30,,DOUB,C10,O10,no,N,30,,254480,6858,AMU
31,,SING,C10,O11,no,N,31,,254480,6858,AMU
32,,SING,C11,H111,no,N,32,,254480,6858,AMU
33,,SING,C11,H112,no,N,33,,254480,6858,AMU
34,,SING,C11,H113,no,N,34,,254480,6858,AMU
35,,SING,O1,HO1,no,N,35,,254480,6858,AMU
36,,SING,O4,HO4,no,N,36,,254480,6858,AMU
37,,SING,O6,HO6,no,N,37,,254480,6858,AMU
38,,SING,O11,HO11,no,N,38,,254480,6858,AMU
39,,SING,N2,HN2,no,N,39,,254480,6858,AMU
1,,SING,N,CA,no,N,1,,254481,6858,DGN
2,,SING,N,H,no,N,2,,254481,6858,DGN
3,,SING,N,H2,no,N,3,,254481,6858,DGN
4,,SING,CA,C,no,N,4,,254481,6858,DGN
5,,SING,CA,CB,no,N,5,,254481,6858,DGN
6,,SING,CA,HA,no,N,6,,254481,6858,DGN
7,,DOUB,C,O,no,N,7,,254481,6858,DGN
8,,SING,C,OXT,no,N,8,,254481,6858,DGN
9,,SING,OXT,HXT,no,N,9,,254481,6858,DGN
10,,SING,CB,CG,no,N,10,,254481,6858,DGN
11,,SING,CB,HB2,no,N,11,,254481,6858,DGN
12,,SING,CB,HB3,no,N,12,,254481,6858,DGN
13,,SING,CG,CD,no,N,13,,254481,6858,DGN
14,,SING,CG,HG2,no,N,14,,254481,6858,DGN
15,,SING,CG,HG3,no,N,15,,254481,6858,DGN
16,,DOUB,CD,OE1,no,N,16,,254481,6858,DGN
17,,SING,CD,NE2,no,N,17,,254481,6858,DGN
18,,SING,NE2,HE21,no,N,18,,254481,6858,DGN
19,,SING,NE2,HE22,no,N,19,,254481,6858,DGN
1,,SING,N,CA,no,N,1,,254482,6858,KCX
2,,SING,N,H,no,N,2,,254482,6858,KCX
3,,SING,N,HN2,no,N,3,,254482,6858,KCX
4,,SING,CA,CB,no,N,4,,254482,6858,KCX
5,,SING,CA,C,no,N,5,,254482,6858,KCX
6,,SING,CA,HA,no,N,6,,254482,6858,KCX
7,,SING,CB,CG,no,N,7,,254482,6858,KCX
8,,SING,CB,HB2,no,N,8,,254482,6858,KCX
9,,SING,CB,HB3,no,N,9,,254482,6858,KCX
10,,SING,CG,CD,no,N,10,,254482,6858,KCX
11,,SING,CG,HG2,no,N,11,,254482,6858,KCX
12,,SING,CG,HG3,no,N,12,,254482,6858,KCX
13,,SING,CD,CE,no,N,13,,254482,6858,KCX
14,,SING,CD,HD2,no,N,14,,254482,6858,KCX
15,,SING,CD,HD3,no,N,15,,254482,6858,KCX
16,,SING,CE,NZ,no,N,16,,254482,6858,KCX
17,,SING,CE,HE2,no,N,17,,254482,6858,KCX
18,,SING,CE,HE3,no,N,18,,254482,6858,KCX
19,,SING,NZ,CX,no,N,19,,254482,6858,KCX
20,,SING,NZ,HZ,no,N,20,,254482,6858,KCX
21,,DOUB,C,O,no,N,21,,254482,6858,KCX
22,,SING,C,OXT,no,N,22,,254482,6858,KCX
23,,DOUB,CX,OQ1,no,N,23,,254482,6858,KCX
24,,SING,CX,OQ2,no,N,24,,254482,6858,KCX
25,,SING,OXT,HXT,no,N,25,,254482,6858,KCX
26,,SING,OQ2,HQ2,no,N,26,,254482,6858,KCX
1,,SING,N,CA,no,N,1,,254483,6858,DAL
2,,SING,N,H,no,N,2,,254483,6858,DAL
3,,SING,N,H2,no,N,3,,254483,6858,DAL
4,,SING,CA,CB,no,N,4,,254483,6858,DAL
5,,SING,CA,C,no,N,5,,254483,6858,DAL
6,,SING,CA,HA,no,N,6,,254483,6858,DAL
7,,SING,CB,HB1,no,N,7,,254483,6858,DAL
8,,SING,CB,HB2,no,N,8,,254483,6858,DAL
9,,SING,CB,HB3,no,N,9,,254483,6858,DAL
10,,DOUB,C,O,no,N,10,,254483,6858,DAL
11,,SING,C,OXT,no,N,11,,254483,6858,DAL
12,,SING,OXT,HXT,no,N,12,,254483,6858,DAL
1,,SING,N,HN1,no,N,1,,254730,6870,NH2
2,,SING,N,HN2,no,N,2,,254730,6870,NH2
1,,SING,C1,C2,no,N,1,,254811,6875,IDS
2,,SING,C1,O1,no,N,2,,254811,6875,IDS
3,,SING,C1,O5,no,N,3,,254811,6875,IDS
4,,SING,C1,H1,no,N,4,,254811,6875,IDS
5,,SING,C2,C3,no,N,5,,254811,6875,IDS
6,,SING,C2,O2,no,N,6,,254811,6875,IDS
7,,SING,C2,H2,no,N,7,,254811,6875,IDS
8,,SING,C3,C4,no,N,8,,254811,6875,IDS
9,,SING,C3,O3,no,N,9,,254811,6875,IDS
10,,SING,C3,H3,no,N,10,,254811,6875,IDS
11,,SING,C4,C5,no,N,11,,254811,6875,IDS
12,,SING,C4,O4,no,N,12,,254811,6875,IDS
13,,SING,C4,H4,no,N,13,,254811,6875,IDS
14,,SING,C5,C6,no,N,14,,254811,6875,IDS
15,,SING,C5,O5,no,N,15,,254811,6875,IDS
16,,SING,C5,H5,no,N,16,,254811,6875,IDS
17,,DOUB,C6,O61,no,N,17,,254811,6875,IDS
18,,SING,C6,O62,no,N,18,,254811,6875,IDS
19,,SING,O1,HO1,no,N,19,,254811,6875,IDS
20,,SING,O2,S,no,N,20,,254811,6875,IDS
21,,SING,O3,HO3,no,N,21,,254811,6875,IDS
22,,SING,O4,HO4,no,N,22,,254811,6875,IDS
23,,SING,O62,HO6,no,N,23,,254811,6875,IDS
24,,DOUB,S,O1S,no,N,24,,254811,6875,IDS
25,,DOUB,S,O2S,no,N,25,,254811,6875,IDS
26,,SING,S,O3S,no,N,26,,254811,6875,IDS
27,,SING,O3S,HOS3,no,N,27,,254811,6875,IDS
1,,SING,C1,C2,no,N,1,,254812,6875,GNS
2,,SING,C1,O5,no,N,2,,254812,6875,GNS
3,,SING,C1,O1,no,N,3,,254812,6875,GNS
4,,SING,C1,H1,no,N,4,,254812,6875,GNS
5,,SING,C2,N,no,N,5,,254812,6875,GNS
6,,SING,C2,C3,no,N,6,,254812,6875,GNS
7,,SING,C2,H2,no,N,7,,254812,6875,GNS
8,,SING,N,S1,no,N,8,,254812,6875,GNS
9,,SING,N,HN,no,N,9,,254812,6875,GNS
10,,SING,S1,O1S,no,N,10,,254812,6875,GNS
11,,DOUB,S1,O2S,no,N,11,,254812,6875,GNS
12,,DOUB,S1,O3S,no,N,12,,254812,6875,GNS
13,,SING,O1S,H1S,no,N,13,,254812,6875,GNS
14,,SING,C3,O3,no,N,14,,254812,6875,GNS
15,,SING,C3,C4,no,N,15,,254812,6875,GNS
16,,SING,C3,H3,no,N,16,,254812,6875,GNS
17,,SING,O3,HO3,no,N,17,,254812,6875,GNS
18,,SING,C4,C5,no,N,18,,254812,6875,GNS
19,,SING,C4,O4,no,N,19,,254812,6875,GNS
20,,SING,C4,H4,no,N,20,,254812,6875,GNS
21,,SING,C5,O5,no,N,21,,254812,6875,GNS
22,,SING,C5,C6,no,N,22,,254812,6875,GNS
23,,SING,C5,H5,no,N,23,,254812,6875,GNS
24,,SING,C6,O6,no,N,24,,254812,6875,GNS
25,,SING,C6,H61,no,N,25,,254812,6875,GNS
26,,SING,C6,H62,no,N,26,,254812,6875,GNS
27,,SING,O6,H6O,no,N,27,,254812,6875,GNS
28,,SING,O4,HO4,no,N,28,,254812,6875,GNS
29,,SING,O1,HO1,no,N,29,,254812,6875,GNS
1,,SING,C1,C2,no,N,1,,254813,6875,IDR
2,,SING,C1,O1,no,N,2,,254813,6875,IDR
3,,SING,C1,O5,no,N,3,,254813,6875,IDR
4,,SING,C1,H1,no,N,4,,254813,6875,IDR
5,,SING,C2,C3,no,N,5,,254813,6875,IDR
6,,SING,C2,O2,no,N,6,,254813,6875,IDR
7,,SING,C2,H2,no,N,7,,254813,6875,IDR
8,,SING,C3,C4,no,N,8,,254813,6875,IDR
9,,SING,C3,O3,no,N,9,,254813,6875,IDR
10,,SING,C3,H3,no,N,10,,254813,6875,IDR
11,,SING,C4,C5,no,N,11,,254813,6875,IDR
12,,SING,C4,O4,no,N,12,,254813,6875,IDR
13,,SING,C4,H4,no,N,13,,254813,6875,IDR
14,,SING,C5,C6,no,N,14,,254813,6875,IDR
15,,SING,C5,O5,no,N,15,,254813,6875,IDR
16,,SING,C5,H5,no,N,16,,254813,6875,IDR
17,,DOUB,C6,O6A,no,N,17,,254813,6875,IDR
18,,SING,C6,O6B,no,N,18,,254813,6875,IDR
19,,SING,O1,HO1,no,N,19,,254813,6875,IDR
20,,SING,O2,HO2,no,N,20,,254813,6875,IDR
21,,SING,O3,HO3,no,N,21,,254813,6875,IDR
22,,SING,O4,HO4,no,N,22,,254813,6875,IDR
23,,SING,O6B,HOB,no,N,23,,254813,6875,IDR
1,,SING,O1,C1,no,N,1,,254814,6875,NGY
2,,SING,C1,C2,no,N,2,,254814,6875,NGY
3,,SING,C1,O5,no,N,3,,254814,6875,NGY
4,,SING,C1,H1,no,N,4,,254814,6875,NGY
5,,SING,C2,C3,no,N,5,,254814,6875,NGY
6,,SING,C2,N,no,N,6,,254814,6875,NGY
7,,SING,C2,H2,no,N,7,,254814,6875,NGY
8,,SING,C3,C4,no,N,8,,254814,6875,NGY
9,,SING,C3,O3,no,N,9,,254814,6875,NGY
10,,SING,C3,H3,no,N,10,,254814,6875,NGY
11,,SING,C4,C5,no,N,11,,254814,6875,NGY
12,,SING,C4,O4,no,N,12,,254814,6875,NGY
13,,SING,C4,H4,no,N,13,,254814,6875,NGY
14,,SING,C5,C6,no,N,14,,254814,6875,NGY
15,,SING,C5,O5,no,N,15,,254814,6875,NGY
16,,SING,C5,H5,no,N,16,,254814,6875,NGY
17,,SING,C6,O6,no,N,17,,254814,6875,NGY
18,,SING,C6,H6,no,N,18,,254814,6875,NGY
19,,SING,C6,H6A,no,N,19,,254814,6875,NGY
20,,SING,O3,HO3,no,N,20,,254814,6875,NGY
21,,SING,O4,H13,no,N,21,,254814,6875,NGY
22,,SING,O6,S,no,N,22,,254814,6875,NGY
23,,SING,N,C,no,N,23,,254814,6875,NGY
24,,SING,N,HN,no,N,24,,254814,6875,NGY
25,,DOUB,C,O,no,N,25,,254814,6875,NGY
26,,SING,C,CH3,no,N,26,,254814,6875,NGY
27,,SING,CH3,HH3,no,N,27,,254814,6875,NGY
28,,SING,CH3,HH3A,no,N,28,,254814,6875,NGY
29,,SING,CH3,HH3B,no,N,29,,254814,6875,NGY
30,,DOUB,S,O7,no,N,30,,254814,6875,NGY
31,,DOUB,S,O8,no,N,31,,254814,6875,NGY
32,,SING,S,O9,no,N,32,,254814,6875,NGY
33,,SING,O9,H14,no,N,33,,254814,6875,NGY
34,,SING,O1,H15,no,N,34,,254814,6875,NGY
1,,SING,C1,C2,no,N,1,,254815,6875,IPA
2,,SING,C1,H11,no,N,2,,254815,6875,IPA
3,,SING,C1,H12,no,N,3,,254815,6875,IPA
4,,SING,C1,H13,no,N,4,,254815,6875,IPA
5,,SING,C2,C3,no,N,5,,254815,6875,IPA
6,,SING,C2,O2,no,N,6,,254815,6875,IPA
7,,SING,C2,H2,no,N,7,,254815,6875,IPA
8,,SING,C3,H31,no,N,8,,254815,6875,IPA
9,,SING,C3,H32,no,N,9,,254815,6875,IPA
10,,SING,C3,H33,no,N,10,,254815,6875,IPA
11,,SING,O2,HO2,no,N,11,,254815,6875,IPA
1,,SING,O1,C8A,yes,N,1,,255038,6888,FLN
2,,SING,O1,C2,yes,N,2,,255038,6888,FLN
3,,SING,C8A,C4A,yes,N,3,,255038,6888,FLN
4,,DOUB,C8A,C8,yes,N,4,,255038,6888,FLN
5,,SING,C4A,C4,yes,N,5,,255038,6888,FLN
6,,DOUB,C4A,C5,yes,N,6,,255038,6888,FLN
7,,SING,C4,C3,yes,N,7,,255038,6888,FLN
8,,DOUB,C4,O4,no,N,8,,255038,6888,FLN
9,,DOUB,C3,C2,yes,N,9,,255038,6888,FLN
10,,SING,C3,H3,no,N,10,,255038,6888,FLN
11,,SING,C2,C1',yes,N,11,,255038,6888,FLN
12,,DOUB,C1',C2',yes,N,12,,255038,6888,FLN
13,,SING,C1',C6',yes,N,13,,255038,6888,FLN
14,,SING,C2',C3',yes,N,14,,255038,6888,FLN
15,,SING,C2',H2',no,N,15,,255038,6888,FLN
16,,DOUB,C3',C4',yes,N,16,,255038,6888,FLN
17,,SING,C3',H3',no,N,17,,255038,6888,FLN
18,,SING,C4',C5',yes,N,18,,255038,6888,FLN
19,,SING,C4',H4',no,N,19,,255038,6888,FLN
20,,DOUB,C5',C6',yes,N,20,,255038,6888,FLN
21,,SING,C5',H5',no,N,21,,255038,6888,FLN
22,,SING,C6',H6',no,N,22,,255038,6888,FLN
23,,SING,C5,C6,yes,N,23,,255038,6888,FLN
24,,SING,C5,H5,no,N,24,,255038,6888,FLN
25,,DOUB,C6,C7,yes,N,25,,255038,6888,FLN
26,,SING,C6,H6,no,N,26,,255038,6888,FLN
27,,SING,C7,C8,yes,N,27,,255038,6888,FLN
28,,SING,C7,H7,no,N,28,,255038,6888,FLN
29,,SING,C8,H8,no,N,29,,255038,6888,FLN
1,,SING,N,CA,no,N,1,,255093,6891,HYP
2,,SING,N,CD,no,N,2,,255093,6891,HYP
3,,SING,N,H,no,N,3,,255093,6891,HYP
4,,SING,CA,C,no,N,4,,255093,6891,HYP
5,,SING,CA,CB,no,N,5,,255093,6891,HYP
6,,SING,CA,HA,no,N,6,,255093,6891,HYP
7,,DOUB,C,O,no,N,7,,255093,6891,HYP
8,,SING,C,OXT,no,N,8,,255093,6891,HYP
9,,SING,CB,CG,no,N,9,,255093,6891,HYP
10,,SING,CB,HB2,no,N,10,,255093,6891,HYP
11,,SING,CB,HB3,no,N,11,,255093,6891,HYP
12,,SING,CG,CD,no,N,12,,255093,6891,HYP
13,,SING,CG,OD1,no,N,13,,255093,6891,HYP
14,,SING,CG,HG,no,N,14,,255093,6891,HYP
15,,SING,CD,HD22,no,N,15,,255093,6891,HYP
16,,SING,CD,HD23,no,N,16,,255093,6891,HYP
17,,SING,OD1,HD1,no,N,17,,255093,6891,HYP
18,,SING,OXT,HXT,no,N,18,,255093,6891,HYP
1,,SING,N,HN1,no,N,1,,255094,6891,NH2
2,,SING,N,HN2,no,N,2,,255094,6891,NH2
1,,SING,CD1,CG,no,N,1,,255112,6892,NLW
2,,SING,CG,CD2,no,N,2,,255112,6892,NLW
3,,SING,CG,CB,no,N,3,,255112,6892,NLW
4,,SING,CB,CA,no,N,4,,255112,6892,NLW
5,,SING,N,CA,no,N,5,,255112,6892,NLW
6,,SING,CA,C,no,N,6,,255112,6892,NLW
7,,SING,C,NH2,no,N,7,,255112,6892,NLW
8,,DOUB,C,O,no,N,8,,255112,6892,NLW
9,,SING,CD2,H1,no,N,9,,255112,6892,NLW
10,,SING,CD2,H2,no,N,10,,255112,6892,NLW
11,,SING,CD2,H3,no,N,11,,255112,6892,NLW
12,,SING,CG,H4,no,N,12,,255112,6892,NLW
13,,SING,CD1,H5,no,N,13,,255112,6892,NLW
14,,SING,CD1,H6,no,N,14,,255112,6892,NLW
15,,SING,CD1,H7,no,N,15,,255112,6892,NLW
16,,SING,CB,H8,no,N,16,,255112,6892,NLW
17,,SING,CB,H9,no,N,17,,255112,6892,NLW
18,,SING,CA,H10,no,N,18,,255112,6892,NLW
19,,SING,N,H11,no,N,19,,255112,6892,NLW
20,,SING,N,H12,no,N,20,,255112,6892,NLW
21,,SING,NH2,H14,no,N,21,,255112,6892,NLW
22,,SING,NH2,H15,no,N,22,,255112,6892,NLW
1,,SING,N,CA,no,N,1,,255198,6896,SEC
2,,SING,N,H,no,N,2,,255198,6896,SEC
3,,SING,N,H2,no,N,3,,255198,6896,SEC
4,,SING,CA,C,no,N,4,,255198,6896,SEC
5,,SING,CA,CB,no,N,5,,255198,6896,SEC
6,,SING,CA,HA,no,N,6,,255198,6896,SEC
7,,DOUB,C,O,no,N,7,,255198,6896,SEC
8,,SING,C,OXT,no,N,8,,255198,6896,SEC
9,,SING,CB,SEG,no,N,9,,255198,6896,SEC
10,,SING,CB,HB2,no,N,10,,255198,6896,SEC
11,,SING,CB,HB3,no,N,11,,255198,6896,SEC
12,,DOUB,SEG,OD1,no,N,12,,255198,6896,SEC
13,,SING,SEG,OD2,no,N,13,,255198,6896,SEC
14,,SING,OD2,HD2,no,N,14,,255198,6896,SEC
15,,SING,OXT,HXT,no,N,15,,255198,6896,SEC
1,,SING,N,CA,no,N,1,,255217,6897,SEC
2,,SING,N,H,no,N,2,,255217,6897,SEC
3,,SING,N,H2,no,N,3,,255217,6897,SEC
4,,SING,CA,C,no,N,4,,255217,6897,SEC
5,,SING,CA,CB,no,N,5,,255217,6897,SEC
6,,SING,CA,HA,no,N,6,,255217,6897,SEC
7,,DOUB,C,O,no,N,7,,255217,6897,SEC
8,,SING,C,OXT,no,N,8,,255217,6897,SEC
9,,SING,CB,SEG,no,N,9,,255217,6897,SEC
10,,SING,CB,HB2,no,N,10,,255217,6897,SEC
11,,SING,CB,HB3,no,N,11,,255217,6897,SEC
12,,DOUB,SEG,OD1,no,N,12,,255217,6897,SEC
13,,SING,SEG,OD2,no,N,13,,255217,6897,SEC
14,,SING,OD2,HD2,no,N,14,,255217,6897,SEC
15,,SING,OXT,HXT,no,N,15,,255217,6897,SEC
1,,SING,CHA,C1A,yes,N,1,,255616,6921,HEM
2,,DOUB,CHA,C4D,yes,N,2,,255616,6921,HEM
3,,SING,CHA,HHA,no,N,3,,255616,6921,HEM
4,,SING,CHB,C4A,yes,N,4,,255616,6921,HEM
5,,DOUB,CHB,C1B,yes,N,5,,255616,6921,HEM
6,,SING,CHB,HHB,no,N,6,,255616,6921,HEM
7,,SING,CHC,C4B,yes,N,7,,255616,6921,HEM
8,,DOUB,CHC,C1C,yes,N,8,,255616,6921,HEM
9,,SING,CHC,HHC,no,N,9,,255616,6921,HEM
10,,DOUB,CHD,C4C,yes,N,10,,255616,6921,HEM
11,,SING,CHD,C1D,yes,N,11,,255616,6921,HEM
12,,SING,CHD,HHD,no,N,12,,255616,6921,HEM
13,,DOUB,C1A,C2A,yes,N,13,,255616,6921,HEM
14,,SING,C1A,NA,yes,N,14,,255616,6921,HEM
15,,SING,C2A,C3A,yes,N,15,,255616,6921,HEM
16,,SING,C2A,CAA,no,N,16,,255616,6921,HEM
17,,DOUB,C3A,C4A,yes,N,17,,255616,6921,HEM
18,,SING,C3A,CMA,no,N,18,,255616,6921,HEM
19,,SING,C4A,NA,yes,N,19,,255616,6921,HEM
20,,SING,CMA,HMA,no,N,20,,255616,6921,HEM
21,,SING,CMA,HMAA,no,N,21,,255616,6921,HEM
22,,SING,CMA,HMAB,no,N,22,,255616,6921,HEM
23,,SING,CAA,CBA,no,N,23,,255616,6921,HEM
24,,SING,CAA,HAA,no,N,24,,255616,6921,HEM
25,,SING,CAA,HAAA,no,N,25,,255616,6921,HEM
26,,SING,CBA,CGA,no,N,26,,255616,6921,HEM
27,,SING,CBA,HBA,no,N,27,,255616,6921,HEM
28,,SING,CBA,HBAA,no,N,28,,255616,6921,HEM
29,,DOUB,CGA,O1A,no,N,29,,255616,6921,HEM
30,,SING,CGA,O2A,no,N,30,,255616,6921,HEM
31,,SING,C1B,C2B,no,N,31,,255616,6921,HEM
32,,SING,C1B,NB,yes,N,32,,255616,6921,HEM
33,,DOUB,C2B,C3B,yes,N,33,,255616,6921,HEM
34,,SING,C2B,CMB,yes,N,34,,255616,6921,HEM
35,,SING,C3B,C4B,no,N,35,,255616,6921,HEM
36,,SING,C3B,CAB,yes,N,36,,255616,6921,HEM
37,,DOUB,C4B,NB,no,N,37,,255616,6921,HEM
38,,SING,CMB,HMB,yes,N,38,,255616,6921,HEM
39,,SING,CMB,HMBA,no,N,39,,255616,6921,HEM
40,,SING,CMB,HMBB,no,N,40,,255616,6921,HEM
41,,DOUB,CAB,CBB,no,N,41,,255616,6921,HEM
42,,SING,CAB,HAB,no,N,42,,255616,6921,HEM
43,,SING,CBB,HBB,no,N,43,,255616,6921,HEM
44,,SING,CBB,HBBA,no,N,44,,255616,6921,HEM
45,,SING,C1C,C2C,no,N,45,,255616,6921,HEM
46,,SING,C1C,NC,yes,N,46,,255616,6921,HEM
47,,DOUB,C2C,C3C,yes,N,47,,255616,6921,HEM
48,,SING,C2C,CMC,yes,N,48,,255616,6921,HEM
49,,SING,C3C,C4C,no,N,49,,255616,6921,HEM
50,,SING,C3C,CAC,yes,N,50,,255616,6921,HEM
51,,SING,C4C,NC,no,N,51,,255616,6921,HEM
52,,SING,CMC,HMC,yes,N,52,,255616,6921,HEM
53,,SING,CMC,HMCA,no,N,53,,255616,6921,HEM
54,,SING,CMC,HMCB,no,N,54,,255616,6921,HEM
55,,DOUB,CAC,CBC,no,N,55,,255616,6921,HEM
56,,SING,CAC,HAC,no,N,56,,255616,6921,HEM
57,,SING,CBC,HBC,no,N,57,,255616,6921,HEM
58,,SING,CBC,HBCA,no,N,58,,255616,6921,HEM
59,,SING,C1D,C2D,no,N,59,,255616,6921,HEM
60,,DOUB,C1D,ND,yes,N,60,,255616,6921,HEM
61,,DOUB,C2D,C3D,yes,N,61,,255616,6921,HEM
62,,SING,C2D,CMD,yes,N,62,,255616,6921,HEM
63,,SING,C3D,C4D,no,N,63,,255616,6921,HEM
64,,SING,C3D,CAD,yes,N,64,,255616,6921,HEM
65,,SING,C4D,ND,no,N,65,,255616,6921,HEM
66,,SING,CMD,HMD,yes,N,66,,255616,6921,HEM
67,,SING,CMD,HMDA,no,N,67,,255616,6921,HEM
68,,SING,CMD,HMDB,no,N,68,,255616,6921,HEM
69,,SING,CAD,CBD,no,N,69,,255616,6921,HEM
70,,SING,CAD,HAD,no,N,70,,255616,6921,HEM
71,,SING,CAD,HADA,no,N,71,,255616,6921,HEM
72,,SING,CBD,CGD,no,N,72,,255616,6921,HEM
73,,SING,CBD,HBD,no,N,73,,255616,6921,HEM
74,,SING,CBD,HBDA,no,N,74,,255616,6921,HEM
75,,DOUB,CGD,O1D,no,N,75,,255616,6921,HEM
76,,SING,CGD,O2D,no,N,76,,255616,6921,HEM
77,,SING,O2A,H2A,no,N,77,,255616,6921,HEM
78,,SING,O2D,H2D,no,N,78,,255616,6921,HEM
79,,SING,FE,NA,no,N,79,,255616,6921,HEM
80,,SING,FE,NB,no,N,80,,255616,6921,HEM
81,,SING,FE,NC,no,N,81,,255616,6921,HEM
82,,SING,FE,ND,no,N,82,,255616,6921,HEM
1,,SING,N,CA,no,N,1,,255660,6924,PCA
2,,SING,N,CD,no,N,2,,255660,6924,PCA
3,,SING,N,H,no,N,3,,255660,6924,PCA
4,,SING,CA,CB,no,N,4,,255660,6924,PCA
5,,SING,CA,C,no,N,5,,255660,6924,PCA
6,,SING,CA,HA,no,N,6,,255660,6924,PCA
7,,SING,CB,CG,no,N,7,,255660,6924,PCA
8,,SING,CB,HB2,no,N,8,,255660,6924,PCA
9,,SING,CB,HB3,no,N,9,,255660,6924,PCA
10,,SING,CG,CD,no,N,10,,255660,6924,PCA
11,,SING,CG,HG2,no,N,11,,255660,6924,PCA
12,,SING,CG,HG3,no,N,12,,255660,6924,PCA
13,,DOUB,CD,OE,no,N,13,,255660,6924,PCA
14,,DOUB,C,O,no,N,14,,255660,6924,PCA
15,,SING,C,OXT,no,N,15,,255660,6924,PCA
16,,SING,OXT,HXT,no,N,16,,255660,6924,PCA
1,,SING,P,O1,no,N,1,,255813,6935,EPP
2,,SING,P,O2,no,N,2,,255813,6935,EPP
3,,SING,P,O3,no,N,3,,255813,6935,EPP
4,,DOUB,P,O4,no,N,4,,255813,6935,EPP
5,,SING,O1,C11,no,N,5,,255813,6935,EPP
6,,SING,O2,C21,no,N,6,,255813,6935,EPP
7,,SING,O3,C1,no,N,7,,255813,6935,EPP
8,,SING,C11,C12,no,N,8,,255813,6935,EPP
9,,SING,C11,H111,no,N,9,,255813,6935,EPP
10,,SING,C11,H112,no,N,10,,255813,6935,EPP
11,,SING,C12,H121,no,N,11,,255813,6935,EPP
12,,SING,C12,H122,no,N,12,,255813,6935,EPP
13,,SING,C12,H123,no,N,13,,255813,6935,EPP
14,,SING,C21,C22,no,N,14,,255813,6935,EPP
15,,SING,C21,H211,no,N,15,,255813,6935,EPP
16,,SING,C21,H212,no,N,16,,255813,6935,EPP
17,,SING,C22,H221,no,N,17,,255813,6935,EPP
18,,SING,C22,H222,no,N,18,,255813,6935,EPP
19,,SING,C22,H223,no,N,19,,255813,6935,EPP
20,,DOUB,C1,C2,yes,N,20,,255813,6935,EPP
21,,SING,C1,C6,yes,N,21,,255813,6935,EPP
22,,SING,C2,C3,yes,N,22,,255813,6935,EPP
23,,SING,C2,H2,no,N,23,,255813,6935,EPP
24,,DOUB,C3,C4,yes,N,24,,255813,6935,EPP
25,,SING,C3,H3,no,N,25,,255813,6935,EPP
26,,SING,C4,C5,yes,N,26,,255813,6935,EPP
27,,SING,C4,N4,no,N,27,,255813,6935,EPP
28,,DOUB,C5,C6,yes,N,28,,255813,6935,EPP
29,,SING,C5,H5,no,N,29,,255813,6935,EPP
30,,SING,C6,H6,no,N,30,,255813,6935,EPP
31,,SING,N4,O5,no,N,31,,255813,6935,EPP
32,,DOUB,N4,O6,no,N,32,,255813,6935,EPP
1,,SING,N,CA,no,N,1,,255892,6941,DAB
2,,SING,N,H,no,N,2,,255892,6941,DAB
3,,SING,N,H2,no,N,3,,255892,6941,DAB
4,,SING,CA,C,no,N,4,,255892,6941,DAB
5,,SING,CA,CB,no,N,5,,255892,6941,DAB
6,,SING,CA,HA,no,N,6,,255892,6941,DAB
7,,DOUB,C,O,no,N,7,,255892,6941,DAB
8,,SING,C,OXT,no,N,8,,255892,6941,DAB
9,,SING,CB,CG,no,N,9,,255892,6941,DAB
10,,SING,CB,HB2,no,N,10,,255892,6941,DAB
11,,SING,CB,HB3,no,N,11,,255892,6941,DAB
12,,SING,CG,ND,no,N,12,,255892,6941,DAB
13,,SING,CG,HG2,no,N,13,,255892,6941,DAB
14,,SING,CG,HG3,no,N,14,,255892,6941,DAB
15,,SING,ND,HD1,no,N,15,,255892,6941,DAB
16,,SING,ND,HD2,no,N,16,,255892,6941,DAB
17,,SING,OXT,HXT,no,N,17,,255892,6941,DAB
1,,SING,N,CA,no,N,1,,255893,6941,ORN
2,,SING,N,H,no,N,2,,255893,6941,ORN
3,,SING,N,H2,no,N,3,,255893,6941,ORN
4,,SING,CA,CB,no,N,4,,255893,6941,ORN
5,,SING,CA,C,no,N,5,,255893,6941,ORN
6,,SING,CA,HA,no,N,6,,255893,6941,ORN
7,,SING,CB,CG,no,N,7,,255893,6941,ORN
8,,SING,CB,HB2,no,N,8,,255893,6941,ORN
9,,SING,CB,HB3,no,N,9,,255893,6941,ORN
10,,SING,CG,CD,no,N,10,,255893,6941,ORN
11,,SING,CG,HG2,no,N,11,,255893,6941,ORN
12,,SING,CG,HG3,no,N,12,,255893,6941,ORN
13,,SING,CD,NE,no,N,13,,255893,6941,ORN
14,,SING,CD,HD2,no,N,14,,255893,6941,ORN
15,,SING,CD,HD3,no,N,15,,255893,6941,ORN
16,,SING,NE,HE1,no,N,16,,255893,6941,ORN
17,,SING,NE,HE2,no,N,17,,255893,6941,ORN
18,,DOUB,C,O,no,N,18,,255893,6941,ORN
19,,SING,C,OXT,no,N,19,,255893,6941,ORN
20,,SING,OXT,HXT,no,N,20,,255893,6941,ORN
1,,SING,N,HN1,no,N,1,,256054,6951,NH2
2,,SING,N,HN2,no,N,2,,256054,6951,NH2
1,,SING,O23,P24,no,N,1,,256196,6962,PNS
2,,SING,O23,HOP1,no,N,2,,256196,6962,PNS
3,,SING,P24,O25,no,N,3,,256196,6962,PNS
4,,DOUB,P24,O26,no,N,4,,256196,6962,PNS
5,,SING,P24,O27,no,N,5,,256196,6962,PNS
6,,SING,O25,HOP2,no,N,6,,256196,6962,PNS
7,,SING,O27,C28,no,N,7,,256196,6962,PNS
8,,SING,C28,C29,no,N,8,,256196,6962,PNS
9,,SING,C28,H282,no,N,9,,256196,6962,PNS
10,,SING,C28,H281,no,N,10,,256196,6962,PNS
11,,SING,C29,C30,no,N,11,,256196,6962,PNS
12,,SING,C29,C31,no,N,12,,256196,6962,PNS
13,,SING,C29,C32,no,N,13,,256196,6962,PNS
14,,SING,C30,H303,no,N,14,,256196,6962,PNS
15,,SING,C30,H302,no,N,15,,256196,6962,PNS
16,,SING,C30,H301,no,N,16,,256196,6962,PNS
17,,SING,C31,H313,no,N,17,,256196,6962,PNS
18,,SING,C31,H312,no,N,18,,256196,6962,PNS
19,,SING,C31,H311,no,N,19,,256196,6962,PNS
20,,SING,C32,O33,no,N,20,,256196,6962,PNS
21,,SING,C32,C34,no,N,21,,256196,6962,PNS
22,,SING,C32,H32,no,N,22,,256196,6962,PNS
23,,SING,O33,H33,no,N,23,,256196,6962,PNS
24,,DOUB,C34,O35,no,N,24,,256196,6962,PNS
25,,SING,C34,N36,no,N,25,,256196,6962,PNS
26,,SING,N36,C37,no,N,26,,256196,6962,PNS
27,,SING,N36,H36,no,N,27,,256196,6962,PNS
28,,SING,C37,C38,no,N,28,,256196,6962,PNS
29,,SING,C37,H372,no,N,29,,256196,6962,PNS
30,,SING,C37,H371,no,N,30,,256196,6962,PNS
31,,SING,C38,C39,no,N,31,,256196,6962,PNS
32,,SING,C38,H382,no,N,32,,256196,6962,PNS
33,,SING,C38,H381,no,N,33,,256196,6962,PNS
34,,DOUB,C39,O40,no,N,34,,256196,6962,PNS
35,,SING,C39,N41,no,N,35,,256196,6962,PNS
36,,SING,N41,C42,no,N,36,,256196,6962,PNS
37,,SING,N41,H41,no,N,37,,256196,6962,PNS
38,,SING,C42,C43,no,N,38,,256196,6962,PNS
39,,SING,C42,H422,no,N,39,,256196,6962,PNS
40,,SING,C42,H421,no,N,40,,256196,6962,PNS
41,,SING,C43,S44,no,N,41,,256196,6962,PNS
42,,SING,C43,H431,no,N,42,,256196,6962,PNS
43,,SING,C43,H432,no,N,43,,256196,6962,PNS
44,,SING,S44,H44,no,N,44,,256196,6962,PNS
1,,DOUB,C1,O1,no,N,1,,256197,6962,DKA
2,,SING,C1,C2,no,N,2,,256197,6962,DKA
3,,SING,C1,O2,no,N,3,,256197,6962,DKA
4,,SING,C2,C3,no,N,4,,256197,6962,DKA
5,,SING,C2,H21,no,N,5,,256197,6962,DKA
6,,SING,C2,H22,no,N,6,,256197,6962,DKA
7,,SING,C3,C4,no,N,7,,256197,6962,DKA
8,,SING,C3,H31,no,N,8,,256197,6962,DKA
9,,SING,C3,H32,no,N,9,,256197,6962,DKA
10,,SING,C4,C5,no,N,10,,256197,6962,DKA
11,,SING,C4,H41,no,N,11,,256197,6962,DKA
12,,SING,C4,H42,no,N,12,,256197,6962,DKA
13,,SING,C5,C6,no,N,13,,256197,6962,DKA
14,,SING,C5,H51,no,N,14,,256197,6962,DKA
15,,SING,C5,H52,no,N,15,,256197,6962,DKA
16,,SING,C6,C7,no,N,16,,256197,6962,DKA
17,,SING,C6,H61,no,N,17,,256197,6962,DKA
18,,SING,C6,H62,no,N,18,,256197,6962,DKA
19,,SING,C7,C8,no,N,19,,256197,6962,DKA
20,,SING,C7,H71,no,N,20,,256197,6962,DKA
21,,SING,C7,H72,no,N,21,,256197,6962,DKA
22,,SING,C8,C9,no,N,22,,256197,6962,DKA
23,,SING,C8,H81,no,N,23,,256197,6962,DKA
24,,SING,C8,H82,no,N,24,,256197,6962,DKA
25,,SING,C9,C10,no,N,25,,256197,6962,DKA
26,,SING,C9,H91,no,N,26,,256197,6962,DKA
27,,SING,C9,H92,no,N,27,,256197,6962,DKA
28,,SING,C10,H101,no,N,28,,256197,6962,DKA
29,,SING,C10,H102,no,N,29,,256197,6962,DKA
30,,SING,C10,H103,no,N,30,,256197,6962,DKA
31,,SING,O2,HO2,no,N,31,,256197,6962,DKA
1,,SING,CHA,C1A,yes,N,1,,256268,6966,HEM
2,,DOUB,CHA,C4D,yes,N,2,,256268,6966,HEM
3,,SING,CHA,HHA,no,N,3,,256268,6966,HEM
4,,SING,CHB,C4A,yes,N,4,,256268,6966,HEM
5,,DOUB,CHB,C1B,yes,N,5,,256268,6966,HEM
6,,SING,CHB,HHB,no,N,6,,256268,6966,HEM
7,,SING,CHC,C4B,yes,N,7,,256268,6966,HEM
8,,DOUB,CHC,C1C,yes,N,8,,256268,6966,HEM
9,,SING,CHC,HHC,no,N,9,,256268,6966,HEM
10,,DOUB,CHD,C4C,yes,N,10,,256268,6966,HEM
11,,SING,CHD,C1D,yes,N,11,,256268,6966,HEM
12,,SING,CHD,HHD,no,N,12,,256268,6966,HEM
13,,DOUB,C1A,C2A,yes,N,13,,256268,6966,HEM
14,,SING,C1A,NA,yes,N,14,,256268,6966,HEM
15,,SING,C2A,C3A,yes,N,15,,256268,6966,HEM
16,,SING,C2A,CAA,no,N,16,,256268,6966,HEM
17,,DOUB,C3A,C4A,yes,N,17,,256268,6966,HEM
18,,SING,C3A,CMA,no,N,18,,256268,6966,HEM
19,,SING,C4A,NA,yes,N,19,,256268,6966,HEM
20,,SING,CMA,HMA,no,N,20,,256268,6966,HEM
21,,SING,CMA,HMAA,no,N,21,,256268,6966,HEM
22,,SING,CMA,HMAB,no,N,22,,256268,6966,HEM
23,,SING,CAA,CBA,no,N,23,,256268,6966,HEM
24,,SING,CAA,HAA,no,N,24,,256268,6966,HEM
25,,SING,CAA,HAAA,no,N,25,,256268,6966,HEM
26,,SING,CBA,CGA,no,N,26,,256268,6966,HEM
27,,SING,CBA,HBA,no,N,27,,256268,6966,HEM
28,,SING,CBA,HBAA,no,N,28,,256268,6966,HEM
29,,DOUB,CGA,O1A,no,N,29,,256268,6966,HEM
30,,SING,CGA,O2A,no,N,30,,256268,6966,HEM
31,,SING,C1B,C2B,no,N,31,,256268,6966,HEM
32,,SING,C1B,NB,yes,N,32,,256268,6966,HEM
33,,DOUB,C2B,C3B,yes,N,33,,256268,6966,HEM
34,,SING,C2B,CMB,yes,N,34,,256268,6966,HEM
35,,SING,C3B,C4B,no,N,35,,256268,6966,HEM
36,,SING,C3B,CAB,yes,N,36,,256268,6966,HEM
37,,DOUB,C4B,NB,no,N,37,,256268,6966,HEM
38,,SING,CMB,HMB,yes,N,38,,256268,6966,HEM
39,,SING,CMB,HMBA,no,N,39,,256268,6966,HEM
40,,SING,CMB,HMBB,no,N,40,,256268,6966,HEM
41,,DOUB,CAB,CBB,no,N,41,,256268,6966,HEM
42,,SING,CAB,HAB,no,N,42,,256268,6966,HEM
43,,SING,CBB,HBB,no,N,43,,256268,6966,HEM
44,,SING,CBB,HBBA,no,N,44,,256268,6966,HEM
45,,SING,C1C,C2C,no,N,45,,256268,6966,HEM
46,,SING,C1C,NC,yes,N,46,,256268,6966,HEM
47,,DOUB,C2C,C3C,yes,N,47,,256268,6966,HEM
48,,SING,C2C,CMC,yes,N,48,,256268,6966,HEM
49,,SING,C3C,C4C,no,N,49,,256268,6966,HEM
50,,SING,C3C,CAC,yes,N,50,,256268,6966,HEM
51,,SING,C4C,NC,no,N,51,,256268,6966,HEM
52,,SING,CMC,HMC,yes,N,52,,256268,6966,HEM
53,,SING,CMC,HMCA,no,N,53,,256268,6966,HEM
54,,SING,CMC,HMCB,no,N,54,,256268,6966,HEM
55,,DOUB,CAC,CBC,no,N,55,,256268,6966,HEM
56,,SING,CAC,HAC,no,N,56,,256268,6966,HEM
57,,SING,CBC,HBC,no,N,57,,256268,6966,HEM
58,,SING,CBC,HBCA,no,N,58,,256268,6966,HEM
59,,SING,C1D,C2D,no,N,59,,256268,6966,HEM
60,,DOUB,C1D,ND,yes,N,60,,256268,6966,HEM
61,,DOUB,C2D,C3D,yes,N,61,,256268,6966,HEM
62,,SING,C2D,CMD,yes,N,62,,256268,6966,HEM
63,,SING,C3D,C4D,no,N,63,,256268,6966,HEM
64,,SING,C3D,CAD,yes,N,64,,256268,6966,HEM
65,,SING,C4D,ND,no,N,65,,256268,6966,HEM
66,,SING,CMD,HMD,yes,N,66,,256268,6966,HEM
67,,SING,CMD,HMDA,no,N,67,,256268,6966,HEM
68,,SING,CMD,HMDB,no,N,68,,256268,6966,HEM
69,,SING,CAD,CBD,no,N,69,,256268,6966,HEM
70,,SING,CAD,HAD,no,N,70,,256268,6966,HEM
71,,SING,CAD,HADA,no,N,71,,256268,6966,HEM
72,,SING,CBD,CGD,no,N,72,,256268,6966,HEM
73,,SING,CBD,HBD,no,N,73,,256268,6966,HEM
74,,SING,CBD,HBDA,no,N,74,,256268,6966,HEM
75,,DOUB,CGD,O1D,no,N,75,,256268,6966,HEM
76,,SING,CGD,O2D,no,N,76,,256268,6966,HEM
77,,SING,O2A,H2A,no,N,77,,256268,6966,HEM
78,,SING,O2D,H2D,no,N,78,,256268,6966,HEM
79,,SING,FE,NA,no,N,79,,256268,6966,HEM
80,,SING,FE,NB,no,N,80,,256268,6966,HEM
81,,SING,FE,NC,no,N,81,,256268,6966,HEM
82,,SING,FE,ND,no,N,82,,256268,6966,HEM
1,,SING,CHA,C1A,yes,N,1,,256285,6967,HEM
2,,DOUB,CHA,C4D,yes,N,2,,256285,6967,HEM
3,,SING,CHA,HHA,no,N,3,,256285,6967,HEM
4,,SING,CHB,C4A,yes,N,4,,256285,6967,HEM
5,,DOUB,CHB,C1B,yes,N,5,,256285,6967,HEM
6,,SING,CHB,HHB,no,N,6,,256285,6967,HEM
7,,SING,CHC,C4B,yes,N,7,,256285,6967,HEM
8,,DOUB,CHC,C1C,yes,N,8,,256285,6967,HEM
9,,SING,CHC,HHC,no,N,9,,256285,6967,HEM
10,,DOUB,CHD,C4C,yes,N,10,,256285,6967,HEM
11,,SING,CHD,C1D,yes,N,11,,256285,6967,HEM
12,,SING,CHD,HHD,no,N,12,,256285,6967,HEM
13,,DOUB,C1A,C2A,yes,N,13,,256285,6967,HEM
14,,SING,C1A,NA,yes,N,14,,256285,6967,HEM
15,,SING,C2A,C3A,yes,N,15,,256285,6967,HEM
16,,SING,C2A,CAA,no,N,16,,256285,6967,HEM
17,,DOUB,C3A,C4A,yes,N,17,,256285,6967,HEM
18,,SING,C3A,CMA,no,N,18,,256285,6967,HEM
19,,SING,C4A,NA,yes,N,19,,256285,6967,HEM
20,,SING,CMA,HMA,no,N,20,,256285,6967,HEM
21,,SING,CMA,HMAA,no,N,21,,256285,6967,HEM
22,,SING,CMA,HMAB,no,N,22,,256285,6967,HEM
23,,SING,CAA,CBA,no,N,23,,256285,6967,HEM
24,,SING,CAA,HAA,no,N,24,,256285,6967,HEM
25,,SING,CAA,HAAA,no,N,25,,256285,6967,HEM
26,,SING,CBA,CGA,no,N,26,,256285,6967,HEM
27,,SING,CBA,HBA,no,N,27,,256285,6967,HEM
28,,SING,CBA,HBAA,no,N,28,,256285,6967,HEM
29,,DOUB,CGA,O1A,no,N,29,,256285,6967,HEM
30,,SING,CGA,O2A,no,N,30,,256285,6967,HEM
31,,SING,C1B,C2B,no,N,31,,256285,6967,HEM
32,,SING,C1B,NB,yes,N,32,,256285,6967,HEM
33,,DOUB,C2B,C3B,yes,N,33,,256285,6967,HEM
34,,SING,C2B,CMB,yes,N,34,,256285,6967,HEM
35,,SING,C3B,C4B,no,N,35,,256285,6967,HEM
36,,SING,C3B,CAB,yes,N,36,,256285,6967,HEM
37,,DOUB,C4B,NB,no,N,37,,256285,6967,HEM
38,,SING,CMB,HMB,yes,N,38,,256285,6967,HEM
39,,SING,CMB,HMBA,no,N,39,,256285,6967,HEM
40,,SING,CMB,HMBB,no,N,40,,256285,6967,HEM
41,,DOUB,CAB,CBB,no,N,41,,256285,6967,HEM
42,,SING,CAB,HAB,no,N,42,,256285,6967,HEM
43,,SING,CBB,HBB,no,N,43,,256285,6967,HEM
44,,SING,CBB,HBBA,no,N,44,,256285,6967,HEM
45,,SING,C1C,C2C,no,N,45,,256285,6967,HEM
46,,SING,C1C,NC,yes,N,46,,256285,6967,HEM
47,,DOUB,C2C,C3C,yes,N,47,,256285,6967,HEM
48,,SING,C2C,CMC,yes,N,48,,256285,6967,HEM
49,,SING,C3C,C4C,no,N,49,,256285,6967,HEM
50,,SING,C3C,CAC,yes,N,50,,256285,6967,HEM
51,,SING,C4C,NC,no,N,51,,256285,6967,HEM
52,,SING,CMC,HMC,yes,N,52,,256285,6967,HEM
53,,SING,CMC,HMCA,no,N,53,,256285,6967,HEM
54,,SING,CMC,HMCB,no,N,54,,256285,6967,HEM
55,,DOUB,CAC,CBC,no,N,55,,256285,6967,HEM
56,,SING,CAC,HAC,no,N,56,,256285,6967,HEM
57,,SING,CBC,HBC,no,N,57,,256285,6967,HEM
58,,SING,CBC,HBCA,no,N,58,,256285,6967,HEM
59,,SING,C1D,C2D,no,N,59,,256285,6967,HEM
60,,DOUB,C1D,ND,yes,N,60,,256285,6967,HEM
61,,DOUB,C2D,C3D,yes,N,61,,256285,6967,HEM
62,,SING,C2D,CMD,yes,N,62,,256285,6967,HEM
63,,SING,C3D,C4D,no,N,63,,256285,6967,HEM
64,,SING,C3D,CAD,yes,N,64,,256285,6967,HEM
65,,SING,C4D,ND,no,N,65,,256285,6967,HEM
66,,SING,CMD,HMD,yes,N,66,,256285,6967,HEM
67,,SING,CMD,HMDA,no,N,67,,256285,6967,HEM
68,,SING,CMD,HMDB,no,N,68,,256285,6967,HEM
69,,SING,CAD,CBD,no,N,69,,256285,6967,HEM
70,,SING,CAD,HAD,no,N,70,,256285,6967,HEM
71,,SING,CAD,HADA,no,N,71,,256285,6967,HEM
72,,SING,CBD,CGD,no,N,72,,256285,6967,HEM
73,,SING,CBD,HBD,no,N,73,,256285,6967,HEM
74,,SING,CBD,HBDA,no,N,74,,256285,6967,HEM
75,,DOUB,CGD,O1D,no,N,75,,256285,6967,HEM
76,,SING,CGD,O2D,no,N,76,,256285,6967,HEM
77,,SING,O2A,H2A,no,N,77,,256285,6967,HEM
78,,SING,O2D,H2D,no,N,78,,256285,6967,HEM
79,,SING,FE,NA,no,N,79,,256285,6967,HEM
80,,SING,FE,NB,no,N,80,,256285,6967,HEM
81,,SING,FE,NC,no,N,81,,256285,6967,HEM
82,,SING,FE,ND,no,N,82,,256285,6967,HEM
1,,DOUB,PG,O1G,no,N,1,,256332,6970,GTP
2,,SING,PG,O2G,no,N,2,,256332,6970,GTP
3,,SING,PG,O3G,no,N,3,,256332,6970,GTP
4,,SING,PG,O3B,no,N,4,,256332,6970,GTP
5,,SING,O2G,HOG2,no,N,5,,256332,6970,GTP
6,,SING,O3G,HOG3,no,N,6,,256332,6970,GTP
7,,SING,O3B,PB,no,N,7,,256332,6970,GTP
8,,DOUB,PB,O1B,no,N,8,,256332,6970,GTP
9,,SING,PB,O2B,no,N,9,,256332,6970,GTP
10,,SING,PB,O3A,no,N,10,,256332,6970,GTP
11,,SING,O2B,HOB2,no,N,11,,256332,6970,GTP
12,,SING,O3A,PA,no,N,12,,256332,6970,GTP
13,,DOUB,PA,O1A,no,N,13,,256332,6970,GTP
14,,SING,PA,O2A,no,N,14,,256332,6970,GTP
15,,SING,PA,O5',no,N,15,,256332,6970,GTP
16,,SING,O2A,HOA2,no,N,16,,256332,6970,GTP
17,,SING,O5',C5',no,N,17,,256332,6970,GTP
18,,SING,C5',C4',no,N,18,,256332,6970,GTP
19,,SING,C5',H5',no,N,19,,256332,6970,GTP
20,,SING,C5',H5'',no,N,20,,256332,6970,GTP
21,,SING,C4',O4',no,N,21,,256332,6970,GTP
22,,SING,C4',C3',no,N,22,,256332,6970,GTP
23,,SING,C4',H4',no,N,23,,256332,6970,GTP
24,,SING,O4',C1',no,N,24,,256332,6970,GTP
25,,SING,C3',O3',no,N,25,,256332,6970,GTP
26,,SING,C3',C2',no,N,26,,256332,6970,GTP
27,,SING,C3',H3',no,N,27,,256332,6970,GTP
28,,SING,O3',HO3',no,N,28,,256332,6970,GTP
29,,SING,C2',O2',no,N,29,,256332,6970,GTP
30,,SING,C2',C1',no,N,30,,256332,6970,GTP
31,,SING,C2',H2',no,N,31,,256332,6970,GTP
32,,SING,O2',HO2',no,N,32,,256332,6970,GTP
33,,SING,C1',N9,no,N,33,,256332,6970,GTP
34,,SING,C1',H1',no,N,34,,256332,6970,GTP
35,,SING,N9,C8,yes,N,35,,256332,6970,GTP
36,,SING,N9,C4,yes,N,36,,256332,6970,GTP
37,,DOUB,C8,N7,yes,N,37,,256332,6970,GTP
38,,SING,C8,H8,no,N,38,,256332,6970,GTP
39,,SING,N7,C5,yes,N,39,,256332,6970,GTP
40,,SING,C5,C6,no,N,40,,256332,6970,GTP
41,,DOUB,C5,C4,yes,N,41,,256332,6970,GTP
42,,DOUB,C6,O6,no,N,42,,256332,6970,GTP
43,,SING,C6,N1,no,N,43,,256332,6970,GTP
44,,SING,N1,C2,no,N,44,,256332,6970,GTP
45,,SING,N1,HN1,no,N,45,,256332,6970,GTP
46,,SING,C2,N2,no,N,46,,256332,6970,GTP
47,,DOUB,C2,N3,no,N,47,,256332,6970,GTP
48,,SING,N2,HN21,no,N,48,,256332,6970,GTP
49,,SING,N2,HN22,no,N,49,,256332,6970,GTP
50,,SING,N3,C4,no,N,50,,256332,6970,GTP
1,,SING,N1,C2,yes,N,1,,256436,6979,P5P
2,,DOUB,N1,C6,yes,N,2,,256436,6979,P5P
3,,DOUB,C2,N3,yes,N,3,,256436,6979,P5P
4,,SING,C2,H2,no,N,4,,256436,6979,P5P
5,,SING,N3,C4,yes,N,5,,256436,6979,P5P
6,,DOUB,C4,C5,yes,N,6,,256436,6979,P5P
7,,SING,C4,N9,yes,N,7,,256436,6979,P5P
8,,SING,C5,C6,yes,N,8,,256436,6979,P5P
9,,SING,C5,N7,yes,N,9,,256436,6979,P5P
10,,SING,C6,H6,no,N,10,,256436,6979,P5P
11,,DOUB,N7,C8,yes,N,11,,256436,6979,P5P
12,,SING,C8,N9,yes,N,12,,256436,6979,P5P
13,,SING,C8,H8,no,N,13,,256436,6979,P5P
14,,SING,N9,C1',no,N,14,,256436,6979,P5P
15,,SING,C1',C2',no,N,15,,256436,6979,P5P
16,,SING,C1',O4',no,N,16,,256436,6979,P5P
17,,SING,C1',H1',no,N,17,,256436,6979,P5P
18,,SING,C2',O2',no,N,18,,256436,6979,P5P
19,,SING,C2',C3',no,N,19,,256436,6979,P5P
20,,SING,C2',H2',no,N,20,,256436,6979,P5P
21,,SING,O2',HO2',no,N,21,,256436,6979,P5P
22,,SING,C3',O3',no,N,22,,256436,6979,P5P
23,,SING,C3',C4',no,N,23,,256436,6979,P5P
24,,SING,C3',H3',no,N,24,,256436,6979,P5P
25,,SING,O3',HO3',no,N,25,,256436,6979,P5P
26,,SING,C4',O4',no,N,26,,256436,6979,P5P
27,,SING,C4',C5',no,N,27,,256436,6979,P5P
28,,SING,C4',H4',no,N,28,,256436,6979,P5P
29,,SING,C5',O5',no,N,29,,256436,6979,P5P
30,,SING,C5',H5'1,no,N,30,,256436,6979,P5P
31,,SING,C5',H5'2,no,N,31,,256436,6979,P5P
32,,SING,O5',P,no,N,32,,256436,6979,P5P
33,,DOUB,P,OP1,no,N,33,,256436,6979,P5P
34,,SING,P,OP2,no,N,34,,256436,6979,P5P
35,,SING,P,OP3,no,N,35,,256436,6979,P5P
36,,SING,OP2,HOP2,no,N,36,,256436,6979,P5P
37,,SING,OP3,HOP3,no,N,37,,256436,6979,P5P
1,,SING,CHA,C1A,yes,N,1,,256504,6983,HEM
2,,DOUB,CHA,C4D,yes,N,2,,256504,6983,HEM
3,,SING,CHA,HHA,no,N,3,,256504,6983,HEM
4,,SING,CHB,C4A,yes,N,4,,256504,6983,HEM
5,,DOUB,CHB,C1B,yes,N,5,,256504,6983,HEM
6,,SING,CHB,HHB,no,N,6,,256504,6983,HEM
7,,SING,CHC,C4B,yes,N,7,,256504,6983,HEM
8,,DOUB,CHC,C1C,yes,N,8,,256504,6983,HEM
9,,SING,CHC,HHC,no,N,9,,256504,6983,HEM
10,,DOUB,CHD,C4C,yes,N,10,,256504,6983,HEM
11,,SING,CHD,C1D,yes,N,11,,256504,6983,HEM
12,,SING,CHD,HHD,no,N,12,,256504,6983,HEM
13,,DOUB,C1A,C2A,yes,N,13,,256504,6983,HEM
14,,SING,C1A,NA,yes,N,14,,256504,6983,HEM
15,,SING,C2A,C3A,yes,N,15,,256504,6983,HEM
16,,SING,C2A,CAA,no,N,16,,256504,6983,HEM
17,,DOUB,C3A,C4A,yes,N,17,,256504,6983,HEM
18,,SING,C3A,CMA,no,N,18,,256504,6983,HEM
19,,SING,C4A,NA,yes,N,19,,256504,6983,HEM
20,,SING,CMA,HMA,no,N,20,,256504,6983,HEM
21,,SING,CMA,HMAA,no,N,21,,256504,6983,HEM
22,,SING,CMA,HMAB,no,N,22,,256504,6983,HEM
23,,SING,CAA,CBA,no,N,23,,256504,6983,HEM
24,,SING,CAA,HAA,no,N,24,,256504,6983,HEM
25,,SING,CAA,HAAA,no,N,25,,256504,6983,HEM
26,,SING,CBA,CGA,no,N,26,,256504,6983,HEM
27,,SING,CBA,HBA,no,N,27,,256504,6983,HEM
28,,SING,CBA,HBAA,no,N,28,,256504,6983,HEM
29,,DOUB,CGA,O1A,no,N,29,,256504,6983,HEM
30,,SING,CGA,O2A,no,N,30,,256504,6983,HEM
31,,SING,C1B,C2B,no,N,31,,256504,6983,HEM
32,,SING,C1B,NB,yes,N,32,,256504,6983,HEM
33,,DOUB,C2B,C3B,yes,N,33,,256504,6983,HEM
34,,SING,C2B,CMB,yes,N,34,,256504,6983,HEM
35,,SING,C3B,C4B,no,N,35,,256504,6983,HEM
36,,SING,C3B,CAB,yes,N,36,,256504,6983,HEM
37,,DOUB,C4B,NB,no,N,37,,256504,6983,HEM
38,,SING,CMB,HMB,yes,N,38,,256504,6983,HEM
39,,SING,CMB,HMBA,no,N,39,,256504,6983,HEM
40,,SING,CMB,HMBB,no,N,40,,256504,6983,HEM
41,,DOUB,CAB,CBB,no,N,41,,256504,6983,HEM
42,,SING,CAB,HAB,no,N,42,,256504,6983,HEM
43,,SING,CBB,HBB,no,N,43,,256504,6983,HEM
44,,SING,CBB,HBBA,no,N,44,,256504,6983,HEM
45,,SING,C1C,C2C,no,N,45,,256504,6983,HEM
46,,SING,C1C,NC,yes,N,46,,256504,6983,HEM
47,,DOUB,C2C,C3C,yes,N,47,,256504,6983,HEM
48,,SING,C2C,CMC,yes,N,48,,256504,6983,HEM
49,,SING,C3C,C4C,no,N,49,,256504,6983,HEM
50,,SING,C3C,CAC,yes,N,50,,256504,6983,HEM
51,,SING,C4C,NC,no,N,51,,256504,6983,HEM
52,,SING,CMC,HMC,yes,N,52,,256504,6983,HEM
53,,SING,CMC,HMCA,no,N,53,,256504,6983,HEM
54,,SING,CMC,HMCB,no,N,54,,256504,6983,HEM
55,,DOUB,CAC,CBC,no,N,55,,256504,6983,HEM
56,,SING,CAC,HAC,no,N,56,,256504,6983,HEM
57,,SING,CBC,HBC,no,N,57,,256504,6983,HEM
58,,SING,CBC,HBCA,no,N,58,,256504,6983,HEM
59,,SING,C1D,C2D,no,N,59,,256504,6983,HEM
60,,DOUB,C1D,ND,yes,N,60,,256504,6983,HEM
61,,DOUB,C2D,C3D,yes,N,61,,256504,6983,HEM
62,,SING,C2D,CMD,yes,N,62,,256504,6983,HEM
63,,SING,C3D,C4D,no,N,63,,256504,6983,HEM
64,,SING,C3D,CAD,yes,N,64,,256504,6983,HEM
65,,SING,C4D,ND,no,N,65,,256504,6983,HEM
66,,SING,CMD,HMD,yes,N,66,,256504,6983,HEM
67,,SING,CMD,HMDA,no,N,67,,256504,6983,HEM
68,,SING,CMD,HMDB,no,N,68,,256504,6983,HEM
69,,SING,CAD,CBD,no,N,69,,256504,6983,HEM
70,,SING,CAD,HAD,no,N,70,,256504,6983,HEM
71,,SING,CAD,HADA,no,N,71,,256504,6983,HEM
72,,SING,CBD,CGD,no,N,72,,256504,6983,HEM
73,,SING,CBD,HBD,no,N,73,,256504,6983,HEM
74,,SING,CBD,HBDA,no,N,74,,256504,6983,HEM
75,,DOUB,CGD,O1D,no,N,75,,256504,6983,HEM
76,,SING,CGD,O2D,no,N,76,,256504,6983,HEM
77,,SING,O2A,H2A,no,N,77,,256504,6983,HEM
78,,SING,O2D,H2D,no,N,78,,256504,6983,HEM
79,,SING,FE,NA,no,N,79,,256504,6983,HEM
80,,SING,FE,NB,no,N,80,,256504,6983,HEM
81,,SING,FE,NC,no,N,81,,256504,6983,HEM
82,,SING,FE,ND,no,N,82,,256504,6983,HEM
1,,DOUB,N1,N2,no,N,1,,256505,6983,AZI
2,,DOUB,N2,N3,no,N,2,,256505,6983,AZI
1,,DOUB,P,O1P,no,N,1,,256520,6984,CMP
2,,SING,P,O2P,no,N,2,,256520,6984,CMP
3,,SING,P,O5',no,N,3,,256520,6984,CMP
4,,SING,P,O3',no,N,4,,256520,6984,CMP
5,,SING,O2P,HOP2,no,N,5,,256520,6984,CMP
6,,SING,O5',C5',no,N,6,,256520,6984,CMP
7,,SING,C5',C4',no,N,7,,256520,6984,CMP
8,,SING,C5',H5'1,no,N,8,,256520,6984,CMP
9,,SING,C5',H5'2,no,N,9,,256520,6984,CMP
10,,SING,C4',O4',no,N,10,,256520,6984,CMP
11,,SING,C4',C3',no,N,11,,256520,6984,CMP
12,,SING,C4',H4',no,N,12,,256520,6984,CMP
13,,SING,O4',C1',no,N,13,,256520,6984,CMP
14,,SING,C3',O3',no,N,14,,256520,6984,CMP
15,,SING,C3',C2',no,N,15,,256520,6984,CMP
16,,SING,C3',H3',no,N,16,,256520,6984,CMP
17,,SING,C2',O2',no,N,17,,256520,6984,CMP
18,,SING,C2',C1',no,N,18,,256520,6984,CMP
19,,SING,C2',H2',no,N,19,,256520,6984,CMP
20,,SING,O2',HO2',no,N,20,,256520,6984,CMP
21,,SING,C1',N9,no,N,21,,256520,6984,CMP
22,,SING,C1',H1',no,N,22,,256520,6984,CMP
23,,SING,N9,C8,yes,N,23,,256520,6984,CMP
24,,SING,N9,C4,yes,N,24,,256520,6984,CMP
25,,DOUB,C8,N7,yes,N,25,,256520,6984,CMP
26,,SING,C8,H8,no,N,26,,256520,6984,CMP
27,,SING,N7,C5,yes,N,27,,256520,6984,CMP
28,,SING,C5,C6,yes,N,28,,256520,6984,CMP
29,,DOUB,C5,C4,yes,N,29,,256520,6984,CMP
30,,SING,C6,N6,no,N,30,,256520,6984,CMP
31,,DOUB,C6,N1,yes,N,31,,256520,6984,CMP
32,,SING,N6,HN61,no,N,32,,256520,6984,CMP
33,,SING,N6,HN62,no,N,33,,256520,6984,CMP
34,,SING,N1,C2,yes,N,34,,256520,6984,CMP
35,,DOUB,C2,N3,yes,N,35,,256520,6984,CMP
36,,SING,C2,H2,no,N,36,,256520,6984,CMP
37,,SING,N3,C4,yes,N,37,,256520,6984,CMP
1,,SING,CHA,C1A,yes,N,1,,256573,6987,HEM
2,,DOUB,CHA,C4D,yes,N,2,,256573,6987,HEM
3,,SING,CHA,HHA,no,N,3,,256573,6987,HEM
4,,SING,CHB,C4A,yes,N,4,,256573,6987,HEM
5,,DOUB,CHB,C1B,yes,N,5,,256573,6987,HEM
6,,SING,CHB,HHB,no,N,6,,256573,6987,HEM
7,,SING,CHC,C4B,yes,N,7,,256573,6987,HEM
8,,DOUB,CHC,C1C,yes,N,8,,256573,6987,HEM
9,,SING,CHC,HHC,no,N,9,,256573,6987,HEM
10,,DOUB,CHD,C4C,yes,N,10,,256573,6987,HEM
11,,SING,CHD,C1D,yes,N,11,,256573,6987,HEM
12,,SING,CHD,HHD,no,N,12,,256573,6987,HEM
13,,DOUB,C1A,C2A,yes,N,13,,256573,6987,HEM
14,,SING,C1A,NA,yes,N,14,,256573,6987,HEM
15,,SING,C2A,C3A,yes,N,15,,256573,6987,HEM
16,,SING,C2A,CAA,no,N,16,,256573,6987,HEM
17,,DOUB,C3A,C4A,yes,N,17,,256573,6987,HEM
18,,SING,C3A,CMA,no,N,18,,256573,6987,HEM
19,,SING,C4A,NA,yes,N,19,,256573,6987,HEM
20,,SING,CMA,HMA,no,N,20,,256573,6987,HEM
21,,SING,CMA,HMAA,no,N,21,,256573,6987,HEM
22,,SING,CMA,HMAB,no,N,22,,256573,6987,HEM
23,,SING,CAA,CBA,no,N,23,,256573,6987,HEM
24,,SING,CAA,HAA,no,N,24,,256573,6987,HEM
25,,SING,CAA,HAAA,no,N,25,,256573,6987,HEM
26,,SING,CBA,CGA,no,N,26,,256573,6987,HEM
27,,SING,CBA,HBA,no,N,27,,256573,6987,HEM
28,,SING,CBA,HBAA,no,N,28,,256573,6987,HEM
29,,DOUB,CGA,O1A,no,N,29,,256573,6987,HEM
30,,SING,CGA,O2A,no,N,30,,256573,6987,HEM
31,,SING,C1B,C2B,no,N,31,,256573,6987,HEM
32,,SING,C1B,NB,yes,N,32,,256573,6987,HEM
33,,DOUB,C2B,C3B,yes,N,33,,256573,6987,HEM
34,,SING,C2B,CMB,yes,N,34,,256573,6987,HEM
35,,SING,C3B,C4B,no,N,35,,256573,6987,HEM
36,,SING,C3B,CAB,yes,N,36,,256573,6987,HEM
37,,DOUB,C4B,NB,no,N,37,,256573,6987,HEM
38,,SING,CMB,HMB,yes,N,38,,256573,6987,HEM
39,,SING,CMB,HMBA,no,N,39,,256573,6987,HEM
40,,SING,CMB,HMBB,no,N,40,,256573,6987,HEM
41,,DOUB,CAB,CBB,no,N,41,,256573,6987,HEM
42,,SING,CAB,HAB,no,N,42,,256573,6987,HEM
43,,SING,CBB,HBB,no,N,43,,256573,6987,HEM
44,,SING,CBB,HBBA,no,N,44,,256573,6987,HEM
45,,SING,C1C,C2C,no,N,45,,256573,6987,HEM
46,,SING,C1C,NC,yes,N,46,,256573,6987,HEM
47,,DOUB,C2C,C3C,yes,N,47,,256573,6987,HEM
48,,SING,C2C,CMC,yes,N,48,,256573,6987,HEM
49,,SING,C3C,C4C,no,N,49,,256573,6987,HEM
50,,SING,C3C,CAC,yes,N,50,,256573,6987,HEM
51,,SING,C4C,NC,no,N,51,,256573,6987,HEM
52,,SING,CMC,HMC,yes,N,52,,256573,6987,HEM
53,,SING,CMC,HMCA,no,N,53,,256573,6987,HEM
54,,SING,CMC,HMCB,no,N,54,,256573,6987,HEM
55,,DOUB,CAC,CBC,no,N,55,,256573,6987,HEM
56,,SING,CAC,HAC,no,N,56,,256573,6987,HEM
57,,SING,CBC,HBC,no,N,57,,256573,6987,HEM
58,,SING,CBC,HBCA,no,N,58,,256573,6987,HEM
59,,SING,C1D,C2D,no,N,59,,256573,6987,HEM
60,,DOUB,C1D,ND,yes,N,60,,256573,6987,HEM
61,,DOUB,C2D,C3D,yes,N,61,,256573,6987,HEM
62,,SING,C2D,CMD,yes,N,62,,256573,6987,HEM
63,,SING,C3D,C4D,no,N,63,,256573,6987,HEM
64,,SING,C3D,CAD,yes,N,64,,256573,6987,HEM
65,,SING,C4D,ND,no,N,65,,256573,6987,HEM
66,,SING,CMD,HMD,yes,N,66,,256573,6987,HEM
67,,SING,CMD,HMDA,no,N,67,,256573,6987,HEM
68,,SING,CMD,HMDB,no,N,68,,256573,6987,HEM
69,,SING,CAD,CBD,no,N,69,,256573,6987,HEM
70,,SING,CAD,HAD,no,N,70,,256573,6987,HEM
71,,SING,CAD,HADA,no,N,71,,256573,6987,HEM
72,,SING,CBD,CGD,no,N,72,,256573,6987,HEM
73,,SING,CBD,HBD,no,N,73,,256573,6987,HEM
74,,SING,CBD,HBDA,no,N,74,,256573,6987,HEM
75,,DOUB,CGD,O1D,no,N,75,,256573,6987,HEM
76,,SING,CGD,O2D,no,N,76,,256573,6987,HEM
77,,SING,O2A,H2A,no,N,77,,256573,6987,HEM
78,,SING,O2D,H2D,no,N,78,,256573,6987,HEM
79,,SING,FE,NA,no,N,79,,256573,6987,HEM
80,,SING,FE,NB,no,N,80,,256573,6987,HEM
81,,SING,FE,NC,no,N,81,,256573,6987,HEM
82,,SING,FE,ND,no,N,82,,256573,6987,HEM
1,,TRIP,C,N,no,N,1,,256574,6987,CYN
1,,SING,C1,C2,no,N,1,,256665,6992,NAG
2,,SING,C1,O1,no,N,2,,256665,6992,NAG
3,,SING,C1,O5,no,N,3,,256665,6992,NAG
4,,SING,C1,H1,no,N,4,,256665,6992,NAG
5,,SING,C2,C3,no,N,5,,256665,6992,NAG
6,,SING,C2,N2,no,N,6,,256665,6992,NAG
7,,SING,C2,H2,no,N,7,,256665,6992,NAG
8,,SING,C3,C4,no,N,8,,256665,6992,NAG
9,,SING,C3,O3,no,N,9,,256665,6992,NAG
10,,SING,C3,H3,no,N,10,,256665,6992,NAG
11,,SING,C4,C5,no,N,11,,256665,6992,NAG
12,,SING,C4,O4,no,N,12,,256665,6992,NAG
13,,SING,C4,H4,no,N,13,,256665,6992,NAG
14,,SING,C5,C6,no,N,14,,256665,6992,NAG
15,,SING,C5,O5,no,N,15,,256665,6992,NAG
16,,SING,C5,H5,no,N,16,,256665,6992,NAG
17,,SING,C6,O6,no,N,17,,256665,6992,NAG
18,,SING,C6,H61,no,N,18,,256665,6992,NAG
19,,SING,C6,H62,no,N,19,,256665,6992,NAG
20,,SING,C7,C8,no,N,20,,256665,6992,NAG
21,,SING,C7,N2,no,N,21,,256665,6992,NAG
22,,DOUB,C7,O7,no,N,22,,256665,6992,NAG
23,,SING,C8,H81,no,N,23,,256665,6992,NAG
24,,SING,C8,H82,no,N,24,,256665,6992,NAG
25,,SING,C8,H83,no,N,25,,256665,6992,NAG
26,,SING,N2,HN2,no,N,26,,256665,6992,NAG
27,,SING,O1,HO1,no,N,27,,256665,6992,NAG
28,,SING,O3,HO3,no,N,28,,256665,6992,NAG
29,,SING,O4,HO4,no,N,29,,256665,6992,NAG
30,,SING,O6,HO6,no,N,30,,256665,6992,NAG
1,,SING,N,CA,no,N,1,,256666,6992,NAM
2,,SING,N,H,no,N,2,,256666,6992,NAM
3,,SING,N,H2,no,N,3,,256666,6992,NAM
4,,SING,CA,CB,no,N,4,,256666,6992,NAM
5,,SING,CA,C,no,N,5,,256666,6992,NAM
6,,SING,CA,HA,no,N,6,,256666,6992,NAM
7,,SING,CB,CG,no,N,7,,256666,6992,NAM
8,,SING,CB,HB2,no,N,8,,256666,6992,NAM
9,,SING,CB,HB3,no,N,9,,256666,6992,NAM
10,,DOUB,C,O,no,N,10,,256666,6992,NAM
11,,SING,C,NXT,no,N,11,,256666,6992,NAM
12,,SING,NXT,HNX1,no,N,12,,256666,6992,NAM
13,,SING,NXT,HNX2,no,N,13,,256666,6992,NAM
14,,DOUB,CG,CD1,yes,N,14,,256666,6992,NAM
15,,SING,CG,CD2,yes,N,15,,256666,6992,NAM
16,,SING,CD1,CE1,yes,N,16,,256666,6992,NAM
17,,SING,CD1,HD1,no,N,17,,256666,6992,NAM
18,,DOUB,CE1,CZ1,yes,N,18,,256666,6992,NAM
19,,SING,CE1,HE1,no,N,19,,256666,6992,NAM
20,,SING,CZ1,CE2,yes,N,20,,256666,6992,NAM
21,,SING,CZ1,HZ1,no,N,21,,256666,6992,NAM
22,,SING,CE2,CH1,yes,N,22,,256666,6992,NAM
23,,DOUB,CE2,CD2,yes,N,23,,256666,6992,NAM
24,,DOUB,CH1,CP,yes,N,24,,256666,6992,NAM
25,,SING,CH1,HH1,no,N,25,,256666,6992,NAM
26,,SING,CP,CH2,yes,N,26,,256666,6992,NAM
27,,SING,CP,HP,no,N,27,,256666,6992,NAM
28,,DOUB,CH2,CZ2,yes,N,28,,256666,6992,NAM
29,,SING,CH2,HH2,no,N,29,,256666,6992,NAM
30,,SING,CZ2,CD2,yes,N,30,,256666,6992,NAM
31,,SING,CZ2,HZ2,no,N,31,,256666,6992,NAM
1,,SING,N,CA,no,N,1,,256667,6992,DAL
2,,SING,N,H,no,N,2,,256667,6992,DAL
3,,SING,N,H2,no,N,3,,256667,6992,DAL
4,,SING,CA,CB,no,N,4,,256667,6992,DAL
5,,SING,CA,C,no,N,5,,256667,6992,DAL
6,,SING,CA,HA,no,N,6,,256667,6992,DAL
7,,SING,CB,HB1,no,N,7,,256667,6992,DAL
8,,SING,CB,HB2,no,N,8,,256667,6992,DAL
9,,SING,CB,HB3,no,N,9,,256667,6992,DAL
10,,DOUB,C,O,no,N,10,,256667,6992,DAL
11,,SING,C,OXT,no,N,11,,256667,6992,DAL
12,,SING,OXT,HXT,no,N,12,,256667,6992,DAL
1,,SING,N,CA,no,N,1,,256668,6992,DGL
2,,SING,N,H,no,N,2,,256668,6992,DGL
3,,SING,N,H2,no,N,3,,256668,6992,DGL
4,,SING,CA,C,no,N,4,,256668,6992,DGL
5,,SING,CA,CB,no,N,5,,256668,6992,DGL
6,,SING,CA,HA,no,N,6,,256668,6992,DGL
7,,DOUB,C,O,no,N,7,,256668,6992,DGL
8,,SING,C,OXT,no,N,8,,256668,6992,DGL
9,,SING,CB,CG,no,N,9,,256668,6992,DGL
10,,SING,CB,HB2,no,N,10,,256668,6992,DGL
11,,SING,CB,HB3,no,N,11,,256668,6992,DGL
12,,SING,CG,CD,no,N,12,,256668,6992,DGL
13,,SING,CG,HG2,no,N,13,,256668,6992,DGL
14,,SING,CG,HG3,no,N,14,,256668,6992,DGL
15,,DOUB,CD,OE1,no,N,15,,256668,6992,DGL
16,,SING,CD,OE2,no,N,16,,256668,6992,DGL
17,,SING,OE2,HE2,no,N,17,,256668,6992,DGL
18,,SING,OXT,HXT,no,N,18,,256668,6992,DGL
1,,SING,N,CA,no,N,1,,256686,6993,SEP
2,,SING,N,H,no,N,2,,256686,6993,SEP
3,,SING,N,H2,no,N,3,,256686,6993,SEP
4,,SING,CA,CB,no,N,4,,256686,6993,SEP
5,,SING,CA,C,no,N,5,,256686,6993,SEP
6,,SING,CA,HA,no,N,6,,256686,6993,SEP
7,,SING,CB,OG,no,N,7,,256686,6993,SEP
8,,SING,CB,HB2,no,N,8,,256686,6993,SEP
9,,SING,CB,HB3,no,N,9,,256686,6993,SEP
10,,SING,OG,P,no,N,10,,256686,6993,SEP
11,,DOUB,C,O,no,N,11,,256686,6993,SEP
12,,SING,C,OXT,no,N,12,,256686,6993,SEP
13,,SING,OXT,HXT,no,N,13,,256686,6993,SEP
14,,DOUB,P,O1P,no,N,14,,256686,6993,SEP
15,,SING,P,O2P,no,N,15,,256686,6993,SEP
16,,SING,P,O3P,no,N,16,,256686,6993,SEP
17,,SING,O2P,HOP2,no,N,17,,256686,6993,SEP
18,,SING,O3P,HOP3,no,N,18,,256686,6993,SEP
1,,DOUB,PB,O1B,no,N,1,,256703,6995,GDP
2,,SING,PB,O2B,no,N,2,,256703,6995,GDP
3,,SING,PB,O3B,no,N,3,,256703,6995,GDP
4,,SING,PB,O3A,no,N,4,,256703,6995,GDP
5,,SING,O2B,HOB2,no,N,5,,256703,6995,GDP
6,,SING,O3B,HOB3,no,N,6,,256703,6995,GDP
7,,SING,O3A,PA,no,N,7,,256703,6995,GDP
8,,DOUB,PA,O1A,no,N,8,,256703,6995,GDP
9,,SING,PA,O2A,no,N,9,,256703,6995,GDP
10,,SING,PA,O5',no,N,10,,256703,6995,GDP
11,,SING,O2A,HOA2,no,N,11,,256703,6995,GDP
12,,SING,O5',C5',no,N,12,,256703,6995,GDP
13,,SING,C5',C4',no,N,13,,256703,6995,GDP
14,,SING,C5',H5',no,N,14,,256703,6995,GDP
15,,SING,C5',H5'',no,N,15,,256703,6995,GDP
16,,SING,C4',O4',no,N,16,,256703,6995,GDP
17,,SING,C4',C3',no,N,17,,256703,6995,GDP
18,,SING,C4',H4',no,N,18,,256703,6995,GDP
19,,SING,O4',C1',no,N,19,,256703,6995,GDP
20,,SING,C3',O3',no,N,20,,256703,6995,GDP
21,,SING,C3',C2',no,N,21,,256703,6995,GDP
22,,SING,C3',H3',no,N,22,,256703,6995,GDP
23,,SING,O3',HO3',no,N,23,,256703,6995,GDP
24,,SING,C2',O2',no,N,24,,256703,6995,GDP
25,,SING,C2',C1',no,N,25,,256703,6995,GDP
26,,SING,C2',H2',no,N,26,,256703,6995,GDP
27,,SING,O2',HO2',no,N,27,,256703,6995,GDP
28,,SING,C1',N9,no,N,28,,256703,6995,GDP
29,,SING,C1',H1',no,N,29,,256703,6995,GDP
30,,SING,N9,C8,yes,N,30,,256703,6995,GDP
31,,SING,N9,C4,yes,N,31,,256703,6995,GDP
32,,DOUB,C8,N7,yes,N,32,,256703,6995,GDP
33,,SING,C8,H8,no,N,33,,256703,6995,GDP
34,,SING,N7,C5,yes,N,34,,256703,6995,GDP
35,,SING,C5,C6,no,N,35,,256703,6995,GDP
36,,DOUB,C5,C4,yes,N,36,,256703,6995,GDP
37,,DOUB,C6,O6,no,N,37,,256703,6995,GDP
38,,SING,C6,N1,no,N,38,,256703,6995,GDP
39,,SING,N1,C2,no,N,39,,256703,6995,GDP
40,,SING,N1,HN1,no,N,40,,256703,6995,GDP
41,,SING,C2,N2,no,N,41,,256703,6995,GDP
42,,DOUB,C2,N3,no,N,42,,256703,6995,GDP
43,,SING,N2,HN21,no,N,43,,256703,6995,GDP
44,,SING,N2,HN22,no,N,44,,256703,6995,GDP
45,,SING,N3,C4,no,N,45,,256703,6995,GDP
1,,SING,N,CA,no,N,1,,256722,6996,SEP
2,,SING,N,H,no,N,2,,256722,6996,SEP
3,,SING,N,H2,no,N,3,,256722,6996,SEP
4,,SING,CA,CB,no,N,4,,256722,6996,SEP
5,,SING,CA,C,no,N,5,,256722,6996,SEP
6,,SING,CA,HA,no,N,6,,256722,6996,SEP
7,,SING,CB,OG,no,N,7,,256722,6996,SEP
8,,SING,CB,HB2,no,N,8,,256722,6996,SEP
9,,SING,CB,HB3,no,N,9,,256722,6996,SEP
10,,SING,OG,P,no,N,10,,256722,6996,SEP
11,,DOUB,C,O,no,N,11,,256722,6996,SEP
12,,SING,C,OXT,no,N,12,,256722,6996,SEP
13,,SING,OXT,HXT,no,N,13,,256722,6996,SEP
14,,DOUB,P,O1P,no,N,14,,256722,6996,SEP
15,,SING,P,O2P,no,N,15,,256722,6996,SEP
16,,SING,P,O3P,no,N,16,,256722,6996,SEP
17,,SING,O2P,HOP2,no,N,17,,256722,6996,SEP
18,,SING,O3P,HOP3,no,N,18,,256722,6996,SEP
1,,SING,N,CA,no,N,1,,256740,6997,MLZ
2,,SING,N,H,no,N,2,,256740,6997,MLZ
3,,SING,N,H2,no,N,3,,256740,6997,MLZ
4,,SING,CA,CB,no,N,4,,256740,6997,MLZ
5,,SING,CA,C,no,N,5,,256740,6997,MLZ
6,,SING,CA,HA,no,N,6,,256740,6997,MLZ
7,,SING,CB,CG,no,N,7,,256740,6997,MLZ
8,,SING,CB,HB2,no,N,8,,256740,6997,MLZ
9,,SING,CB,HB3,no,N,9,,256740,6997,MLZ
10,,SING,CG,CD,no,N,10,,256740,6997,MLZ
11,,SING,CG,HG2,no,N,11,,256740,6997,MLZ
12,,SING,CG,HG3,no,N,12,,256740,6997,MLZ
13,,SING,CD,CE,no,N,13,,256740,6997,MLZ
14,,SING,CD,HD2,no,N,14,,256740,6997,MLZ
15,,SING,CD,HD3,no,N,15,,256740,6997,MLZ
16,,SING,CE,NZ,no,N,16,,256740,6997,MLZ
17,,SING,CE,HE2,no,N,17,,256740,6997,MLZ
18,,SING,CE,HE3,no,N,18,,256740,6997,MLZ
19,,SING,NZ,CM,no,N,19,,256740,6997,MLZ
20,,SING,NZ,HZ,no,N,20,,256740,6997,MLZ
21,,SING,CM,HCM1,no,N,21,,256740,6997,MLZ
22,,SING,CM,HCM2,no,N,22,,256740,6997,MLZ
23,,SING,CM,HCM3,no,N,23,,256740,6997,MLZ
24,,DOUB,C,O,no,N,24,,256740,6997,MLZ
25,,SING,C,OXT,no,N,25,,256740,6997,MLZ
26,,SING,OXT,HXT,no,N,26,,256740,6997,MLZ
1,,SING,N,CA,no,N,1,,256741,6997,SAH
2,,SING,N,HN1,no,N,2,,256741,6997,SAH
3,,SING,N,HN2,no,N,3,,256741,6997,SAH
4,,SING,CA,CB,no,N,4,,256741,6997,SAH
5,,SING,CA,C,no,N,5,,256741,6997,SAH
6,,SING,CA,HA,no,N,6,,256741,6997,SAH
7,,SING,CB,CG,no,N,7,,256741,6997,SAH
8,,SING,CB,HB1,no,N,8,,256741,6997,SAH
9,,SING,CB,HB2,no,N,9,,256741,6997,SAH
10,,SING,CG,SD,no,N,10,,256741,6997,SAH
11,,SING,CG,HG1,no,N,11,,256741,6997,SAH
12,,SING,CG,HG2,no,N,12,,256741,6997,SAH
13,,SING,SD,C5',no,N,13,,256741,6997,SAH
14,,DOUB,C,O,no,N,14,,256741,6997,SAH
15,,SING,C,OXT,no,N,15,,256741,6997,SAH
16,,SING,OXT,HXT,no,N,16,,256741,6997,SAH
17,,SING,C5',C4',no,N,17,,256741,6997,SAH
18,,SING,C5',H5'1,no,N,18,,256741,6997,SAH
19,,SING,C5',H5'2,no,N,19,,256741,6997,SAH
20,,SING,C4',O4',no,N,20,,256741,6997,SAH
21,,SING,C4',C3',no,N,21,,256741,6997,SAH
22,,SING,C4',H4',no,N,22,,256741,6997,SAH
23,,SING,O4',C1',no,N,23,,256741,6997,SAH
24,,SING,C3',O3',no,N,24,,256741,6997,SAH
25,,SING,C3',C2',no,N,25,,256741,6997,SAH
26,,SING,C3',H3',no,N,26,,256741,6997,SAH
27,,SING,O3',HO3',no,N,27,,256741,6997,SAH
28,,SING,C2',O2',no,N,28,,256741,6997,SAH
29,,SING,C2',C1',no,N,29,,256741,6997,SAH
30,,SING,C2',H2',no,N,30,,256741,6997,SAH
31,,SING,O2',HO2',no,N,31,,256741,6997,SAH
32,,SING,C1',N9,no,N,32,,256741,6997,SAH
33,,SING,C1',H1',no,N,33,,256741,6997,SAH
34,,SING,N9,C8,yes,N,34,,256741,6997,SAH
35,,SING,N9,C4,yes,N,35,,256741,6997,SAH
36,,DOUB,C8,N7,yes,N,36,,256741,6997,SAH
37,,SING,C8,H8,no,N,37,,256741,6997,SAH
38,,SING,N7,C5,yes,N,38,,256741,6997,SAH
39,,SING,C5,C6,yes,N,39,,256741,6997,SAH
40,,DOUB,C5,C4,yes,N,40,,256741,6997,SAH
41,,SING,C6,N6,no,N,41,,256741,6997,SAH
42,,DOUB,C6,N1,yes,N,42,,256741,6997,SAH
43,,SING,N6,HN61,no,N,43,,256741,6997,SAH
44,,SING,N6,HN62,no,N,44,,256741,6997,SAH
45,,SING,N1,C2,yes,N,45,,256741,6997,SAH
46,,DOUB,C2,N3,yes,N,46,,256741,6997,SAH
47,,SING,C2,H2,no,N,47,,256741,6997,SAH
48,,SING,N3,C4,yes,N,48,,256741,6997,SAH
1,,SING,N,CA,no,N,1,,256757,6998,SEP
2,,SING,N,H,no,N,2,,256757,6998,SEP
3,,SING,N,H2,no,N,3,,256757,6998,SEP
4,,SING,CA,CB,no,N,4,,256757,6998,SEP
5,,SING,CA,C,no,N,5,,256757,6998,SEP
6,,SING,CA,HA,no,N,6,,256757,6998,SEP
7,,SING,CB,OG,no,N,7,,256757,6998,SEP
8,,SING,CB,HB2,no,N,8,,256757,6998,SEP
9,,SING,CB,HB3,no,N,9,,256757,6998,SEP
10,,SING,OG,P,no,N,10,,256757,6998,SEP
11,,DOUB,C,O,no,N,11,,256757,6998,SEP
12,,SING,C,OXT,no,N,12,,256757,6998,SEP
13,,SING,OXT,HXT,no,N,13,,256757,6998,SEP
14,,DOUB,P,O1P,no,N,14,,256757,6998,SEP
15,,SING,P,O2P,no,N,15,,256757,6998,SEP
16,,SING,P,O3P,no,N,16,,256757,6998,SEP
17,,SING,O2P,HOP2,no,N,17,,256757,6998,SEP
18,,SING,O3P,HOP3,no,N,18,,256757,6998,SEP
1,,SING,N,CA,no,N,1,,256788,7,PCA
2,,SING,N,CD,no,N,2,,256788,7,PCA
3,,SING,N,H,no,N,3,,256788,7,PCA
4,,SING,CA,CB,no,N,4,,256788,7,PCA
5,,SING,CA,C,no,N,5,,256788,7,PCA
6,,SING,CA,HA,no,N,6,,256788,7,PCA
7,,SING,CB,CG,no,N,7,,256788,7,PCA
8,,SING,CB,HB2,no,N,8,,256788,7,PCA
9,,SING,CB,HB3,no,N,9,,256788,7,PCA
10,,SING,CG,CD,no,N,10,,256788,7,PCA
11,,SING,CG,HG2,no,N,11,,256788,7,PCA
12,,SING,CG,HG3,no,N,12,,256788,7,PCA
13,,DOUB,CD,OE,no,N,13,,256788,7,PCA
14,,DOUB,C,O,no,N,14,,256788,7,PCA
15,,SING,C,OXT,no,N,15,,256788,7,PCA
16,,SING,OXT,HXT,no,N,16,,256788,7,PCA
1,,SING,N,HN1,no,N,1,,256789,7,NH2
2,,SING,N,HN2,no,N,2,,256789,7,NH2
1,,DOUB,C,O,no,N,1,,256828,7001,ACE
2,,SING,C,CH3,no,N,2,,256828,7001,ACE
3,,SING,C,H,no,N,3,,256828,7001,ACE
4,,SING,CH3,H1,no,N,4,,256828,7001,ACE
5,,SING,CH3,H2,no,N,5,,256828,7001,ACE
6,,SING,CH3,H3,no,N,6,,256828,7001,ACE
1,,SING,N,CA,no,N,1,,256829,7001,SEP
2,,SING,N,H,no,N,2,,256829,7001,SEP
3,,SING,N,H2,no,N,3,,256829,7001,SEP
4,,SING,CA,CB,no,N,4,,256829,7001,SEP
5,,SING,CA,C,no,N,5,,256829,7001,SEP
6,,SING,CA,HA,no,N,6,,256829,7001,SEP
7,,SING,CB,OG,no,N,7,,256829,7001,SEP
8,,SING,CB,HB2,no,N,8,,256829,7001,SEP
9,,SING,CB,HB3,no,N,9,,256829,7001,SEP
10,,SING,OG,P,no,N,10,,256829,7001,SEP
11,,DOUB,C,O,no,N,11,,256829,7001,SEP
12,,SING,C,OXT,no,N,12,,256829,7001,SEP
13,,SING,OXT,HXT,no,N,13,,256829,7001,SEP
14,,DOUB,P,O1P,no,N,14,,256829,7001,SEP
15,,SING,P,O2P,no,N,15,,256829,7001,SEP
16,,SING,P,O3P,no,N,16,,256829,7001,SEP
17,,SING,O2P,HOP2,no,N,17,,256829,7001,SEP
18,,SING,O3P,HOP3,no,N,18,,256829,7001,SEP
1,,SING,N,HN1,no,N,1,,256830,7001,NH2
2,,SING,N,HN2,no,N,2,,256830,7001,NH2
1,,SING,N,HN1,no,N,1,,256882,7005,NH2
2,,SING,N,HN2,no,N,2,,256882,7005,NH2
1,,SING,N,HN1,no,N,1,,256904,7006,NH2
2,,SING,N,HN2,no,N,2,,256904,7006,NH2
1,,SING,N,HN1,no,N,1,,256992,7010,NH2
2,,SING,N,HN2,no,N,2,,256992,7010,NH2
1,,SING,N,CA,no,N,1,,257724,7061,PTR
2,,SING,N,H,no,N,2,,257724,7061,PTR
3,,SING,N,HN2,no,N,3,,257724,7061,PTR
4,,SING,CA,C,no,N,4,,257724,7061,PTR
5,,SING,CA,CB,no,N,5,,257724,7061,PTR
6,,SING,CA,HA,no,N,6,,257724,7061,PTR
7,,DOUB,C,O,no,N,7,,257724,7061,PTR
8,,SING,C,OXT,no,N,8,,257724,7061,PTR
9,,SING,OXT,HXT,no,N,9,,257724,7061,PTR
10,,SING,CB,CG,no,N,10,,257724,7061,PTR
11,,SING,CB,HB2,no,N,11,,257724,7061,PTR
12,,SING,CB,HB3,no,N,12,,257724,7061,PTR
13,,DOUB,CG,CD1,yes,N,13,,257724,7061,PTR
14,,SING,CG,CD2,yes,N,14,,257724,7061,PTR
15,,SING,CD1,CE1,yes,N,15,,257724,7061,PTR
16,,SING,CD1,HD1,no,N,16,,257724,7061,PTR
17,,DOUB,CD2,CE2,yes,N,17,,257724,7061,PTR
18,,SING,CD2,HD2,no,N,18,,257724,7061,PTR
19,,DOUB,CE1,CZ,yes,N,19,,257724,7061,PTR
20,,SING,CE1,HE1,no,N,20,,257724,7061,PTR
21,,SING,CE2,CZ,yes,N,21,,257724,7061,PTR
22,,SING,CE2,HE2,no,N,22,,257724,7061,PTR
23,,SING,CZ,OH,no,N,23,,257724,7061,PTR
24,,SING,OH,P,no,N,24,,257724,7061,PTR
25,,DOUB,P,O1P,no,N,25,,257724,7061,PTR
26,,SING,P,O2P,no,N,26,,257724,7061,PTR
27,,SING,P,O3P,no,N,27,,257724,7061,PTR
28,,SING,O2P,HO2P,no,N,28,,257724,7061,PTR
29,,SING,O3P,HO3P,no,N,29,,257724,7061,PTR
1,,SING,C1,C2,no,N,1,,258366,7093,TSA
2,,SING,C1,C6,no,N,2,,258366,7093,TSA
3,,SING,C1,C9,no,N,3,,258366,7093,TSA
4,,SING,C1,C10,no,N,4,,258366,7093,TSA
5,,DOUB,C2,C3,no,N,5,,258366,7093,TSA
6,,SING,C2,H2,no,N,6,,258366,7093,TSA
7,,SING,C3,C4,no,N,7,,258366,7093,TSA
8,,SING,C3,H3,no,N,8,,258366,7093,TSA
9,,SING,C4,O5,no,N,9,,258366,7093,TSA
10,,SING,C4,C5,no,N,10,,258366,7093,TSA
11,,SING,C4,H4,no,N,11,,258366,7093,TSA
12,,SING,O5,HO5,no,N,12,,258366,7093,TSA
13,,SING,C5,C6,no,N,13,,258366,7093,TSA
14,,SING,C5,O7,no,N,14,,258366,7093,TSA
15,,SING,C5,H5,no,N,15,,258366,7093,TSA
16,,SING,C6,H61,no,N,16,,258366,7093,TSA
17,,SING,C6,H62,no,N,17,,258366,7093,TSA
18,,SING,O7,C8,no,N,18,,258366,7093,TSA
19,,SING,C8,C9,no,N,19,,258366,7093,TSA
20,,SING,C8,C11,no,N,20,,258366,7093,TSA
21,,SING,C8,H8,no,N,21,,258366,7093,TSA
22,,SING,C9,H91,no,N,22,,258366,7093,TSA
23,,SING,C9,H92,no,N,23,,258366,7093,TSA
24,,DOUB,C10,O1,no,N,24,,258366,7093,TSA
25,,SING,C10,O2,no,N,25,,258366,7093,TSA
26,,SING,O2,HO2,no,N,26,,258366,7093,TSA
27,,DOUB,C11,O3,no,N,27,,258366,7093,TSA
28,,SING,C11,O4,no,N,28,,258366,7093,TSA
29,,SING,O4,HO4,no,N,29,,258366,7093,TSA
1,,SING,C1,C7,,,,,258598,7107,BMS4
2,,DOUB,C1,C2,,,,,258598,7107,BMS4
3,,DOUB,C1,C6,,,,,258598,7107,BMS4
4,,SING,C2,O1,,,,,258598,7107,BMS4
5,,DOUB,C2,C3,,,,,258598,7107,BMS4
6,,SING,C3,O2,,,,,258598,7107,BMS4
7,,DOUB,C3,C4,,,,,258598,7107,BMS4
8,,DOUB,C4,C5,,,,,258598,7107,BMS4
9,,SING,C4,H4,,,,,258598,7107,BMS4
10,,DOUB,C5,C6,,,,,258598,7107,BMS4
11,,SING,C5,H5,,,,,258598,7107,BMS4
12,,SING,C6,H6,,,,,258598,7107,BMS4
13,,SING,C7,O3,,,,,258598,7107,BMS4
14,,SING,C7,C8,,,,,258598,7107,BMS4
15,,SING,C7,H7,,,,,258598,7107,BMS4
16,,DOUB,C8,O4,,,,,258598,7107,BMS4
17,,SING,C8,O5,,,,,258598,7107,BMS4
18,,SING,O3,H8,,,,,258598,7107,BMS4
19,,SING,O1,C22,,,,,258598,7107,BMS4
20,,SING,C22,1H22,,,,,258598,7107,BMS4
21,,SING,C22,2H22,,,,,258598,7107,BMS4
22,,SING,C22,C20,,,,,258598,7107,BMS4
23,,DOUB,C20,C21,,,,,258598,7107,BMS4
24,,DOUB,C20,C19,,,,,258598,7107,BMS4
25,,SING,C21,Cl1,,,,,258598,7107,BMS4
26,,DOUB,C21,C16,,,,,258598,7107,BMS4
27,,DOUB,C16,C17,,,,,258598,7107,BMS4
28,,SING,C16,H16,,,,,258598,7107,BMS4
29,,DOUB,C17,C18,,,,,258598,7107,BMS4
30,,SING,C17,H17,,,,,258598,7107,BMS4
31,,DOUB,C18,C19,,,,,258598,7107,BMS4
32,,SING,C18,H18,,,,,258598,7107,BMS4
33,,SING,C19,H19,,,,,258598,7107,BMS4
34,,SING,O2,C15,,,,,258598,7107,BMS4
35,,SING,C15,1H15,,,,,258598,7107,BMS4
36,,SING,C15,2H15,,,,,258598,7107,BMS4
37,,SING,C15,C13,,,,,258598,7107,BMS4
38,,DOUB,C13,C12,,,,,258598,7107,BMS4
39,,DOUB,C13,C14,,,,,258598,7107,BMS4
40,,DOUB,C12,C11,,,,,258598,7107,BMS4
41,,SING,C12,H12,,,,,258598,7107,BMS4
42,,DOUB,C11,C10,,,,,258598,7107,BMS4
43,,SING,C11,H11,,,,,258598,7107,BMS4
44,,DOUB,C10,C9,,,,,258598,7107,BMS4
45,,SING,C10,H10,,,,,258598,7107,BMS4
46,,DOUB,C9,C14,,,,,258598,7107,BMS4
47,,SING,C9,H9,,,,,258598,7107,BMS4
48,,SING,C14,Cl2,,,,,258598,7107,BMS4
1,,SING,C11,C21,no,N,1,,258707,7114,BCD
2,,SING,C11,O51,no,N,2,,258707,7114,BCD
3,,SING,C11,O47,no,N,3,,258707,7114,BCD
4,,SING,C11,H11,no,N,4,,258707,7114,BCD
5,,SING,C21,O21,no,N,5,,258707,7114,BCD
6,,SING,C21,C31,no,N,6,,258707,7114,BCD
7,,SING,C21,H21,no,N,7,,258707,7114,BCD
8,,SING,O21,HO21,no,N,8,,258707,7114,BCD
9,,SING,C31,O31,no,N,9,,258707,7114,BCD
10,,SING,C31,C41,no,N,10,,258707,7114,BCD
11,,SING,C31,H31,no,N,11,,258707,7114,BCD
12,,SING,O31,HO31,no,N,12,,258707,7114,BCD
13,,SING,C41,O41,no,N,13,,258707,7114,BCD
14,,SING,C41,C51,no,N,14,,258707,7114,BCD
15,,SING,C41,H41,no,N,15,,258707,7114,BCD
16,,SING,O41,C12,no,N,16,,258707,7114,BCD
17,,SING,C51,O51,no,N,17,,258707,7114,BCD
18,,SING,C51,C61,no,N,18,,258707,7114,BCD
19,,SING,C51,H51,no,N,19,,258707,7114,BCD
20,,SING,C61,O61,no,N,20,,258707,7114,BCD
21,,SING,C61,H611,no,N,21,,258707,7114,BCD
22,,SING,C61,H612,no,N,22,,258707,7114,BCD
23,,SING,O61,HO61,no,N,23,,258707,7114,BCD
24,,SING,C12,C22,no,N,24,,258707,7114,BCD
25,,SING,C12,O52,no,N,25,,258707,7114,BCD
26,,SING,C12,H12,no,N,26,,258707,7114,BCD
27,,SING,C22,O22,no,N,27,,258707,7114,BCD
28,,SING,C22,C32,no,N,28,,258707,7114,BCD
29,,SING,C22,H22,no,N,29,,258707,7114,BCD
30,,SING,O22,HO22,no,N,30,,258707,7114,BCD
31,,SING,C32,O32,no,N,31,,258707,7114,BCD
32,,SING,C32,C42,no,N,32,,258707,7114,BCD
33,,SING,C32,H32,no,N,33,,258707,7114,BCD
34,,SING,O32,HO32,no,N,34,,258707,7114,BCD
35,,SING,C42,O42,no,N,35,,258707,7114,BCD
36,,SING,C42,C52,no,N,36,,258707,7114,BCD
37,,SING,C42,H42,no,N,37,,258707,7114,BCD
38,,SING,O42,C13,no,N,38,,258707,7114,BCD
39,,SING,C52,O52,no,N,39,,258707,7114,BCD
40,,SING,C52,C62,no,N,40,,258707,7114,BCD
41,,SING,C52,H52,no,N,41,,258707,7114,BCD
42,,SING,C62,O62,no,N,42,,258707,7114,BCD
43,,SING,C62,H621,no,N,43,,258707,7114,BCD
44,,SING,C62,H622,no,N,44,,258707,7114,BCD
45,,SING,O62,HO62,no,N,45,,258707,7114,BCD
46,,SING,C13,C23,no,N,46,,258707,7114,BCD
47,,SING,C13,O53,no,N,47,,258707,7114,BCD
48,,SING,C13,H13,no,N,48,,258707,7114,BCD
49,,SING,C23,O23,no,N,49,,258707,7114,BCD
50,,SING,C23,C33,no,N,50,,258707,7114,BCD
51,,SING,C23,H23,no,N,51,,258707,7114,BCD
52,,SING,O23,HO23,no,N,52,,258707,7114,BCD
53,,SING,C33,O33,no,N,53,,258707,7114,BCD
54,,SING,C33,C43,no,N,54,,258707,7114,BCD
55,,SING,C33,H33,no,N,55,,258707,7114,BCD
56,,SING,O33,HO33,no,N,56,,258707,7114,BCD
57,,SING,C43,O43,no,N,57,,258707,7114,BCD
58,,SING,C43,C53,no,N,58,,258707,7114,BCD
59,,SING,C43,H43,no,N,59,,258707,7114,BCD
60,,SING,O43,C14,no,N,60,,258707,7114,BCD
61,,SING,C53,O53,no,N,61,,258707,7114,BCD
62,,SING,C53,C63,no,N,62,,258707,7114,BCD
63,,SING,C53,H53,no,N,63,,258707,7114,BCD
64,,SING,C63,O63,no,N,64,,258707,7114,BCD
65,,SING,C63,H631,no,N,65,,258707,7114,BCD
66,,SING,C63,H632,no,N,66,,258707,7114,BCD
67,,SING,O63,HO63,no,N,67,,258707,7114,BCD
68,,SING,C14,C24,no,N,68,,258707,7114,BCD
69,,SING,C14,O54,no,N,69,,258707,7114,BCD
70,,SING,C14,H14,no,N,70,,258707,7114,BCD
71,,SING,C24,O24,no,N,71,,258707,7114,BCD
72,,SING,C24,C34,no,N,72,,258707,7114,BCD
73,,SING,C24,H24,no,N,73,,258707,7114,BCD
74,,SING,O24,HO24,no,N,74,,258707,7114,BCD
75,,SING,C34,O34,no,N,75,,258707,7114,BCD
76,,SING,C34,C44,no,N,76,,258707,7114,BCD
77,,SING,C34,H34,no,N,77,,258707,7114,BCD
78,,SING,O34,HO34,no,N,78,,258707,7114,BCD
79,,SING,C44,O44,no,N,79,,258707,7114,BCD
80,,SING,C44,C54,no,N,80,,258707,7114,BCD
81,,SING,C44,H44,no,N,81,,258707,7114,BCD
82,,SING,O44,C15,no,N,82,,258707,7114,BCD
83,,SING,C54,O54,no,N,83,,258707,7114,BCD
84,,SING,C54,C64,no,N,84,,258707,7114,BCD
85,,SING,C54,H54,no,N,85,,258707,7114,BCD
86,,SING,C64,O64,no,N,86,,258707,7114,BCD
87,,SING,C64,H641,no,N,87,,258707,7114,BCD
88,,SING,C64,H642,no,N,88,,258707,7114,BCD
89,,SING,O64,HO64,no,N,89,,258707,7114,BCD
90,,SING,C15,C25,no,N,90,,258707,7114,BCD
91,,SING,C15,O55,no,N,91,,258707,7114,BCD
92,,SING,C15,H15,no,N,92,,258707,7114,BCD
93,,SING,C25,O25,no,N,93,,258707,7114,BCD
94,,SING,C25,C35,no,N,94,,258707,7114,BCD
95,,SING,C25,H25,no,N,95,,258707,7114,BCD
96,,SING,O25,HO25,no,N,96,,258707,7114,BCD
97,,SING,C35,O35,no,N,97,,258707,7114,BCD
98,,SING,C35,C45,no,N,98,,258707,7114,BCD
99,,SING,C35,H35,no,N,99,,258707,7114,BCD
100,,SING,O35,HO35,no,N,100,,258707,7114,BCD
101,,SING,C45,O45,no,N,101,,258707,7114,BCD
102,,SING,C45,C55,no,N,102,,258707,7114,BCD
103,,SING,C45,H45,no,N,103,,258707,7114,BCD
104,,SING,O45,C16,no,N,104,,258707,7114,BCD
105,,SING,C55,O55,no,N,105,,258707,7114,BCD
106,,SING,C55,C65,no,N,106,,258707,7114,BCD
107,,SING,C55,H55,no,N,107,,258707,7114,BCD
108,,SING,C65,O65,no,N,108,,258707,7114,BCD
109,,SING,C65,H651,no,N,109,,258707,7114,BCD
110,,SING,C65,H652,no,N,110,,258707,7114,BCD
111,,SING,O65,HO65,no,N,111,,258707,7114,BCD
112,,SING,C16,C26,no,N,112,,258707,7114,BCD
113,,SING,C16,O56,no,N,113,,258707,7114,BCD
114,,SING,C16,H16,no,N,114,,258707,7114,BCD
115,,SING,C26,O26,no,N,115,,258707,7114,BCD
116,,SING,C26,C36,no,N,116,,258707,7114,BCD
117,,SING,C26,H26,no,N,117,,258707,7114,BCD
118,,SING,O26,HO26,no,N,118,,258707,7114,BCD
119,,SING,C36,O36,no,N,119,,258707,7114,BCD
120,,SING,C36,C46,no,N,120,,258707,7114,BCD
121,,SING,C36,H36,no,N,121,,258707,7114,BCD
122,,SING,O36,HO36,no,N,122,,258707,7114,BCD
123,,SING,C46,O46,no,N,123,,258707,7114,BCD
124,,SING,C46,C56,no,N,124,,258707,7114,BCD
125,,SING,C46,H46,no,N,125,,258707,7114,BCD
126,,SING,O46,C17,no,N,126,,258707,7114,BCD
127,,SING,C56,O56,no,N,127,,258707,7114,BCD
128,,SING,C56,C66,no,N,128,,258707,7114,BCD
129,,SING,C56,H56,no,N,129,,258707,7114,BCD
130,,SING,C66,O66,no,N,130,,258707,7114,BCD
131,,SING,C66,H661,no,N,131,,258707,7114,BCD
132,,SING,C66,H662,no,N,132,,258707,7114,BCD
133,,SING,O66,HO66,no,N,133,,258707,7114,BCD
134,,SING,C17,C27,no,N,134,,258707,7114,BCD
135,,SING,C17,O57,no,N,135,,258707,7114,BCD
136,,SING,C17,H17,no,N,136,,258707,7114,BCD
137,,SING,C27,O27,no,N,137,,258707,7114,BCD
138,,SING,C27,C37,no,N,138,,258707,7114,BCD
139,,SING,C27,H27,no,N,139,,258707,7114,BCD
140,,SING,O27,HO27,no,N,140,,258707,7114,BCD
141,,SING,C37,O37,no,N,141,,258707,7114,BCD
142,,SING,C37,C47,no,N,142,,258707,7114,BCD
143,,SING,C37,H37,no,N,143,,258707,7114,BCD
144,,SING,O37,HO37,no,N,144,,258707,7114,BCD
145,,SING,C47,O47,no,N,145,,258707,7114,BCD
146,,SING,C47,C57,no,N,146,,258707,7114,BCD
147,,SING,C47,H47,no,N,147,,258707,7114,BCD
148,,SING,C57,O57,no,N,148,,258707,7114,BCD
149,,SING,C57,C67,no,N,149,,258707,7114,BCD
150,,SING,C57,H57,no,N,150,,258707,7114,BCD
151,,SING,C67,O67,no,N,151,,258707,7114,BCD
152,,SING,C67,H671,no,N,152,,258707,7114,BCD
153,,SING,C67,H672,no,N,153,,258707,7114,BCD
154,,SING,O67,HO67,no,N,154,,258707,7114,BCD
1,,SING,FE,NA,,,,,258896,7125,HEM_red
2,,SING,FE,NB,,,,,258896,7125,HEM_red
3,,SING,FE,NC,,,,,258896,7125,HEM_red
4,,SING,FE,ND,,,,,258896,7125,HEM_red
5,,DOUB,CHA,C1A,,,,,258896,7125,HEM_red
6,,SING,CHA,C4D,,,,,258896,7125,HEM_red
7,,SING,CHA,HHA,,,,,258896,7125,HEM_red
8,,DOUB,CHB,C4A,,,,,258896,7125,HEM_red
9,,SING,CHB,C1B,,,,,258896,7125,HEM_red
10,,SING,CHB,HHB,,,,,258896,7125,HEM_red
11,,DOUB,CHC,C4B,,,,,258896,7125,HEM_red
12,,SING,CHC,C1C,,,,,258896,7125,HEM_red
13,,SING,CHC,HHC,,,,,258896,7125,HEM_red
14,,SING,CHD,C4C,,,,,258896,7125,HEM_red
15,,DOUB,CHD,C1D,,,,,258896,7125,HEM_red
16,,SING,CHD,HHD,,,,,258896,7125,HEM_red
17,,SING,NA,C1A,,,,,258896,7125,HEM_red
18,,SING,NA,C4A,,,,,258896,7125,HEM_red
19,,SING,C1A,C2A,,,,,258896,7125,HEM_red
20,,DOUB,C2A,C3A,,,,,258896,7125,HEM_red
21,,SING,C2A,CAA,,,,,258896,7125,HEM_red
22,,SING,C3A,C4A,,,,,258896,7125,HEM_red
23,,SING,C3A,CMA,,,,,258896,7125,HEM_red
24,,SING,CMA,1HMA,,,,,258896,7125,HEM_red
25,,SING,CMA,2HMA,,,,,258896,7125,HEM_red
26,,SING,CMA,3HMA,,,,,258896,7125,HEM_red
27,,SING,CAA,CBA,,,,,258896,7125,HEM_red
28,,SING,CAA,1HAA,,,,,258896,7125,HEM_red
29,,SING,CAA,2HAA,,,,,258896,7125,HEM_red
30,,SING,CBA,CGA,,,,,258896,7125,HEM_red
31,,SING,CBA,1HBA,,,,,258896,7125,HEM_red
32,,SING,CBA,2HBA,,,,,258896,7125,HEM_red
33,,DOUB,CGA,O1A,,,,,258896,7125,HEM_red
34,,SING,CGA,O2A,,,,,258896,7125,HEM_red
35,,SING,O2A,H2A,,,,,258896,7125,HEM_red
36,,DOUB,NB,C1B,,,,,258896,7125,HEM_red
37,,SING,NB,C4B,,,,,258896,7125,HEM_red
38,,SING,C1B,C2B,,,,,258896,7125,HEM_red
39,,DOUB,C2B,C3B,,,,,258896,7125,HEM_red
40,,SING,C2B,CMB,,,,,258896,7125,HEM_red
41,,SING,C3B,C4B,,,,,258896,7125,HEM_red
42,,SING,C3B,CAB,,,,,258896,7125,HEM_red
43,,SING,CMB,1HMB,,,,,258896,7125,HEM_red
44,,SING,CMB,2HMB,,,,,258896,7125,HEM_red
45,,SING,CMB,3HMB,,,,,258896,7125,HEM_red
46,,DOUB,CAB,CBB,,,,,258896,7125,HEM_red
47,,SING,CAB,HAB,,,,,258896,7125,HEM_red
48,,SING,CBB,1HBB,,,,,258896,7125,HEM_red
49,,SING,CBB,2HBB,,,,,258896,7125,HEM_red
50,,SING,NC,C1C,,,,,258896,7125,HEM_red
51,,SING,NC,C4C,,,,,258896,7125,HEM_red
52,,DOUB,C1C,C2C,,,,,258896,7125,HEM_red
53,,SING,C2C,C3C,,,,,258896,7125,HEM_red
54,,SING,C2C,CMC,,,,,258896,7125,HEM_red
55,,DOUB,C3C,C4C,,,,,258896,7125,HEM_red
56,,SING,C3C,CAC,,,,,258896,7125,HEM_red
57,,SING,CMC,1HMC,,,,,258896,7125,HEM_red
58,,SING,CMC,2HMC,,,,,258896,7125,HEM_red
59,,SING,CMC,3HMC,,,,,258896,7125,HEM_red
60,,DOUB,CAC,CBC,,,,,258896,7125,HEM_red
61,,SING,CAC,HAC,,,,,258896,7125,HEM_red
62,,SING,CBC,1HBC,,,,,258896,7125,HEM_red
63,,SING,CBC,2HBC,,,,,258896,7125,HEM_red
64,,SING,ND,C1D,,,,,258896,7125,HEM_red
65,,DOUB,ND,C4D,,,,,258896,7125,HEM_red
66,,SING,C1D,C2D,,,,,258896,7125,HEM_red
67,,DOUB,C2D,C3D,,,,,258896,7125,HEM_red
68,,SING,C2D,CMD,,,,,258896,7125,HEM_red
69,,SING,C3D,C4D,,,,,258896,7125,HEM_red
70,,SING,C3D,CAD,,,,,258896,7125,HEM_red
71,,SING,CMD,1HMD,,,,,258896,7125,HEM_red
72,,SING,CMD,2HMD,,,,,258896,7125,HEM_red
73,,SING,CMD,3HMD,,,,,258896,7125,HEM_red
74,,SING,CAD,CBD,,,,,258896,7125,HEM_red
75,,SING,CAD,1HAD,,,,,258896,7125,HEM_red
76,,SING,CAD,2HAD,,,,,258896,7125,HEM_red
77,,SING,CBD,CGD,,,,,258896,7125,HEM_red
78,,SING,CBD,1HBD,,,,,258896,7125,HEM_red
79,,SING,CBD,2HBD,,,,,258896,7125,HEM_red
80,,DOUB,CGD,O1D,,,,,258896,7125,HEM_red
81,,SING,CGD,O2D,,,,,258896,7125,HEM_red
82,,SING,O2D,H2D,,,,,258896,7125,HEM_red
1,,SING,O1,N2,no,N,1,,259161,7141,CBP
2,,SING,O1,HO1I,no,N,2,,259161,7141,CBP
3,,SING,N2,C3,no,N,3,,259161,7141,CBP
4,,SING,N2,HN21,no,N,4,,259161,7141,CBP
5,,DOUB,C3,O4,no,N,5,,259161,7141,CBP
6,,SING,C3,C5,no,N,6,,259161,7141,CBP
7,,SING,C5,C6,no,N,7,,259161,7141,CBP
8,,SING,C5,HC51,no,N,8,,259161,7141,CBP
9,,SING,C5,HC52,no,N,9,,259161,7141,CBP
10,,SING,C6,C7,no,N,10,,259161,7141,CBP
11,,SING,C6,C11,no,N,11,,259161,7141,CBP
12,,SING,C6,S12,no,N,12,,259161,7141,CBP
13,,SING,C7,C8,no,N,13,,259161,7141,CBP
14,,SING,C7,HC71,no,N,14,,259161,7141,CBP
15,,SING,C7,HC72,no,N,15,,259161,7141,CBP
16,,SING,C8,O9,no,N,16,,259161,7141,CBP
17,,SING,C8,HC81,no,N,17,,259161,7141,CBP
18,,SING,C8,HC82,no,N,18,,259161,7141,CBP
19,,SING,O9,C10,no,N,19,,259161,7141,CBP
20,,SING,C10,C11,no,N,20,,259161,7141,CBP
21,,SING,C10,H101,no,N,21,,259161,7141,CBP
22,,SING,C10,H102,no,N,22,,259161,7141,CBP
23,,SING,C11,H111,no,N,23,,259161,7141,CBP
24,,SING,C11,H112,no,N,24,,259161,7141,CBP
25,,DOUB,S12,O13,no,N,25,,259161,7141,CBP
26,,DOUB,S12,O14,no,N,26,,259161,7141,CBP
27,,SING,S12,C15,no,N,27,,259161,7141,CBP
28,,DOUB,C15,C16,yes,N,28,,259161,7141,CBP
29,,SING,C15,C20,yes,N,29,,259161,7141,CBP
30,,SING,C16,C17,yes,N,30,,259161,7141,CBP
31,,SING,C16,H161,no,N,31,,259161,7141,CBP
32,,DOUB,C17,C18,yes,N,32,,259161,7141,CBP
33,,SING,C17,H171,no,N,33,,259161,7141,CBP
34,,SING,C18,C19,yes,N,34,,259161,7141,CBP
35,,SING,C18,O21,no,N,35,,259161,7141,CBP
36,,DOUB,C19,C20,yes,N,36,,259161,7141,CBP
37,,SING,C19,H191,no,N,37,,259161,7141,CBP
38,,SING,C20,H201,no,N,38,,259161,7141,CBP
39,,SING,O21,C22,no,N,39,,259161,7141,CBP
40,,DOUB,C22,C23,yes,N,40,,259161,7141,CBP
41,,SING,C22,C27,yes,N,41,,259161,7141,CBP
42,,SING,C23,C24,yes,N,42,,259161,7141,CBP
43,,SING,C23,H231,no,N,43,,259161,7141,CBP
44,,DOUB,C24,C25,yes,N,44,,259161,7141,CBP
45,,SING,C24,H241,no,N,45,,259161,7141,CBP
46,,SING,C25,C26,yes,N,46,,259161,7141,CBP
47,,SING,C25,CL28,no,N,47,,259161,7141,CBP
48,,DOUB,C26,C27,yes,N,48,,259161,7141,CBP
49,,SING,C26,H261,no,N,49,,259161,7141,CBP
50,,SING,C27,H271,no,N,50,,259161,7141,CBP
1,,SING,N,CA,no,N,1,,259228,7150,PTR
2,,SING,N,H,no,N,2,,259228,7150,PTR
3,,SING,N,HN2,no,N,3,,259228,7150,PTR
4,,SING,CA,C,no,N,4,,259228,7150,PTR
5,,SING,CA,CB,no,N,5,,259228,7150,PTR
6,,SING,CA,HA,no,N,6,,259228,7150,PTR
7,,DOUB,C,O,no,N,7,,259228,7150,PTR
8,,SING,C,OXT,no,N,8,,259228,7150,PTR
9,,SING,OXT,HXT,no,N,9,,259228,7150,PTR
10,,SING,CB,CG,no,N,10,,259228,7150,PTR
11,,SING,CB,HB2,no,N,11,,259228,7150,PTR
12,,SING,CB,HB3,no,N,12,,259228,7150,PTR
13,,DOUB,CG,CD1,yes,N,13,,259228,7150,PTR
14,,SING,CG,CD2,yes,N,14,,259228,7150,PTR
15,,SING,CD1,CE1,yes,N,15,,259228,7150,PTR
16,,SING,CD1,HD1,no,N,16,,259228,7150,PTR
17,,DOUB,CD2,CE2,yes,N,17,,259228,7150,PTR
18,,SING,CD2,HD2,no,N,18,,259228,7150,PTR
19,,DOUB,CE1,CZ,yes,N,19,,259228,7150,PTR
20,,SING,CE1,HE1,no,N,20,,259228,7150,PTR
21,,SING,CE2,CZ,yes,N,21,,259228,7150,PTR
22,,SING,CE2,HE2,no,N,22,,259228,7150,PTR
23,,SING,CZ,OH,no,N,23,,259228,7150,PTR
24,,SING,OH,P,no,N,24,,259228,7150,PTR
25,,DOUB,P,O1P,no,N,25,,259228,7150,PTR
26,,SING,P,O2P,no,N,26,,259228,7150,PTR
27,,SING,P,O3P,no,N,27,,259228,7150,PTR
28,,SING,O2P,HO2P,no,N,28,,259228,7150,PTR
29,,SING,O3P,HO3P,no,N,29,,259228,7150,PTR
1,,SING,N,CA,no,N,1,,259442,7166,HYP
2,,SING,N,CD,no,N,2,,259442,7166,HYP
3,,SING,N,H,no,N,3,,259442,7166,HYP
4,,SING,CA,C,no,N,4,,259442,7166,HYP
5,,SING,CA,CB,no,N,5,,259442,7166,HYP
6,,SING,CA,HA,no,N,6,,259442,7166,HYP
7,,DOUB,C,O,no,N,7,,259442,7166,HYP
8,,SING,C,OXT,no,N,8,,259442,7166,HYP
9,,SING,CB,CG,no,N,9,,259442,7166,HYP
10,,SING,CB,HB2,no,N,10,,259442,7166,HYP
11,,SING,CB,HB3,no,N,11,,259442,7166,HYP
12,,SING,CG,CD,no,N,12,,259442,7166,HYP
13,,SING,CG,OD1,no,N,13,,259442,7166,HYP
14,,SING,CG,HG,no,N,14,,259442,7166,HYP
15,,SING,CD,HD22,no,N,15,,259442,7166,HYP
16,,SING,CD,HD23,no,N,16,,259442,7166,HYP
17,,SING,OD1,HD1,no,N,17,,259442,7166,HYP
18,,SING,OXT,HXT,no,N,18,,259442,7166,HYP
1,,SING,N,HN1,no,N,1,,259606,7177,NH2
2,,SING,N,HN2,no,N,2,,259606,7177,NH2
1,,DOUB,N1,C2,yes,N,1,,259919,7196,MTX
2,,SING,N1,C8A,yes,N,2,,259919,7196,MTX
3,,SING,C2,NA2,no,N,3,,259919,7196,MTX
4,,SING,C2,N3,yes,N,4,,259919,7196,MTX
5,,SING,NA2,HN21,no,N,5,,259919,7196,MTX
6,,SING,NA2,HN22,no,N,6,,259919,7196,MTX
7,,DOUB,N3,C4,yes,N,7,,259919,7196,MTX
8,,SING,C4,NA4,no,N,8,,259919,7196,MTX
9,,SING,C4,C4A,yes,N,9,,259919,7196,MTX
10,,SING,NA4,HN41,no,N,10,,259919,7196,MTX
11,,SING,NA4,HN42,no,N,11,,259919,7196,MTX
12,,SING,C4A,N5,yes,N,12,,259919,7196,MTX
13,,DOUB,C4A,C8A,yes,N,13,,259919,7196,MTX
14,,DOUB,N5,C6,yes,N,14,,259919,7196,MTX
15,,SING,C6,C7,yes,N,15,,259919,7196,MTX
16,,SING,C6,C9,no,N,16,,259919,7196,MTX
17,,DOUB,C7,N8,yes,N,17,,259919,7196,MTX
18,,SING,C7,H7,no,N,18,,259919,7196,MTX
19,,SING,N8,C8A,yes,N,19,,259919,7196,MTX
20,,SING,C9,N10,no,N,20,,259919,7196,MTX
21,,SING,C9,H91,no,N,21,,259919,7196,MTX
22,,SING,C9,H92,no,N,22,,259919,7196,MTX
23,,SING,N10,CM,no,N,23,,259919,7196,MTX
24,,SING,N10,C14,no,N,24,,259919,7196,MTX
25,,SING,CM,HM1,no,N,25,,259919,7196,MTX
26,,SING,CM,HM2,no,N,26,,259919,7196,MTX
27,,SING,CM,HM3,no,N,27,,259919,7196,MTX
28,,DOUB,C11,C12,yes,N,28,,259919,7196,MTX
29,,SING,C11,C16,yes,N,29,,259919,7196,MTX
30,,SING,C11,C,no,N,30,,259919,7196,MTX
31,,SING,C12,C13,yes,N,31,,259919,7196,MTX
32,,SING,C12,H12,no,N,32,,259919,7196,MTX
33,,DOUB,C13,C14,yes,N,33,,259919,7196,MTX
34,,SING,C13,H13,no,N,34,,259919,7196,MTX
35,,SING,C14,C15,yes,N,35,,259919,7196,MTX
36,,DOUB,C15,C16,yes,N,36,,259919,7196,MTX
37,,SING,C15,H15,no,N,37,,259919,7196,MTX
38,,SING,C16,H16,no,N,38,,259919,7196,MTX
39,,DOUB,C,O,no,N,39,,259919,7196,MTX
40,,SING,C,N,no,N,40,,259919,7196,MTX
41,,SING,N,CA,no,N,41,,259919,7196,MTX
42,,SING,N,HN,no,N,42,,259919,7196,MTX
43,,SING,CA,CT,no,N,43,,259919,7196,MTX
44,,SING,CA,CB,no,N,44,,259919,7196,MTX
45,,SING,CA,HA,no,N,45,,259919,7196,MTX
46,,DOUB,CT,O1,no,N,46,,259919,7196,MTX
47,,SING,CT,O2,no,N,47,,259919,7196,MTX
48,,SING,O2,HO2,no,N,48,,259919,7196,MTX
49,,SING,CB,CG,no,N,49,,259919,7196,MTX
50,,SING,CB,HB1,no,N,50,,259919,7196,MTX
51,,SING,CB,HB2,no,N,51,,259919,7196,MTX
52,,SING,CG,CD,no,N,52,,259919,7196,MTX
53,,SING,CG,HG1,no,N,53,,259919,7196,MTX
54,,SING,CG,HG2,no,N,54,,259919,7196,MTX
55,,DOUB,CD,OE1,no,N,55,,259919,7196,MTX
56,,SING,CD,OE2,no,N,56,,259919,7196,MTX
57,,SING,OE2,HOE2,no,N,57,,259919,7196,MTX
1,,DOUB,C1,N2,yes,N,1,,259951,7200,TOP
2,,SING,C1,C8,yes,N,2,,259951,7200,TOP
3,,SING,C1,H1,no,N,3,,259951,7200,TOP
4,,SING,N2,C3,yes,N,4,,259951,7200,TOP
5,,SING,C3,N4,no,N,5,,259951,7200,TOP
6,,DOUB,C3,N5,yes,N,6,,259951,7200,TOP
7,,SING,N4,HN41,no,N,7,,259951,7200,TOP
8,,SING,N4,HN42,no,N,8,,259951,7200,TOP
9,,SING,N5,C6,yes,N,9,,259951,7200,TOP
10,,SING,C6,N7,no,N,10,,259951,7200,TOP
11,,DOUB,C6,C8,yes,N,11,,259951,7200,TOP
12,,SING,N7,HN71,no,N,12,,259951,7200,TOP
13,,SING,N7,HN72,no,N,13,,259951,7200,TOP
14,,SING,C8,C9,no,N,14,,259951,7200,TOP
15,,SING,C9,C10,no,N,15,,259951,7200,TOP
16,,SING,C9,H91,no,N,16,,259951,7200,TOP
17,,SING,C9,H92,no,N,17,,259951,7200,TOP
18,,DOUB,C10,C11,yes,N,18,,259951,7200,TOP
19,,SING,C10,C21,yes,N,19,,259951,7200,TOP
20,,SING,C11,C12,yes,N,20,,259951,7200,TOP
21,,SING,C11,H11,no,N,21,,259951,7200,TOP
22,,SING,C12,O13,no,N,22,,259951,7200,TOP
23,,DOUB,C12,C15,yes,N,23,,259951,7200,TOP
24,,SING,O13,C14,no,N,24,,259951,7200,TOP
25,,SING,C14,H141,no,N,25,,259951,7200,TOP
26,,SING,C14,H142,no,N,26,,259951,7200,TOP
27,,SING,C14,H143,no,N,27,,259951,7200,TOP
28,,SING,C15,O16,no,N,28,,259951,7200,TOP
29,,SING,C15,C18,yes,N,29,,259951,7200,TOP
30,,SING,O16,C17,no,N,30,,259951,7200,TOP
31,,SING,C17,H171,no,N,31,,259951,7200,TOP
32,,SING,C17,H172,no,N,32,,259951,7200,TOP
33,,SING,C17,H173,no,N,33,,259951,7200,TOP
34,,SING,C18,O19,no,N,34,,259951,7200,TOP
35,,DOUB,C18,C21,yes,N,35,,259951,7200,TOP
36,,SING,O19,C20,no,N,36,,259951,7200,TOP
37,,SING,C20,H201,no,N,37,,259951,7200,TOP
38,,SING,C20,H202,no,N,38,,259951,7200,TOP
39,,SING,C20,H203,no,N,39,,259951,7200,TOP
40,,SING,C21,H21,no,N,40,,259951,7200,TOP
1,,SING,N,CA,no,N,1,,260755,7232,EAB
2,,SING,N,HN1,no,N,2,,260755,7232,EAB
3,,SING,N,HN2,no,N,3,,260755,7232,EAB
4,,SING,CA,CB,no,N,4,,260755,7232,EAB
5,,SING,CA,HA2,no,N,5,,260755,7232,EAB
6,,SING,CA,HA3,no,N,6,,260755,7232,EAB
7,,DOUB,CB,CG2,yes,N,7,,260755,7232,EAB
8,,SING,CB,CG1,yes,N,8,,260755,7232,EAB
9,,SING,CG2,CD2,yes,N,9,,260755,7232,EAB
10,,SING,CG2,HG2,no,N,10,,260755,7232,EAB
11,,DOUB,CD2,CE,yes,N,11,,260755,7232,EAB
12,,SING,CD2,HD2,no,N,12,,260755,7232,EAB
13,,SING,CE,CD1,yes,N,13,,260755,7232,EAB
14,,SING,CE,HE,no,N,14,,260755,7232,EAB
15,,DOUB,CD1,CG1,yes,N,15,,260755,7232,EAB
16,,SING,CD1,NG,no,N,16,,260755,7232,EAB
17,,SING,CG1,HG1,no,N,17,,260755,7232,EAB
18,,DOUB,NG,NI,no,E,18,,260755,7232,EAB
19,,SING,NI,CI,no,N,19,,260755,7232,EAB
20,,SING,CI,CJ2,yes,N,20,,260755,7232,EAB
21,,DOUB,CI,CJ1,yes,N,21,,260755,7232,EAB
22,,DOUB,CJ2,CK2,yes,N,22,,260755,7232,EAB
23,,SING,CJ2,HJ2,no,N,23,,260755,7232,EAB
24,,SING,CK2,CL,yes,N,24,,260755,7232,EAB
25,,SING,CK2,HK2,no,N,25,,260755,7232,EAB
26,,DOUB,CL,CK1,yes,N,26,,260755,7232,EAB
27,,SING,CL,HL,no,N,27,,260755,7232,EAB
28,,SING,CK1,CJ1,yes,N,28,,260755,7232,EAB
29,,SING,CK1,CM,no,N,29,,260755,7232,EAB
30,,SING,CJ1,HJ1,no,N,30,,260755,7232,EAB
31,,SING,CM,C,no,N,31,,260755,7232,EAB
32,,SING,CM,HM3,no,N,32,,260755,7232,EAB
33,,SING,CM,HM2,no,N,33,,260755,7232,EAB
34,,DOUB,C,O,no,N,34,,260755,7232,EAB
35,,SING,C,OXT,no,N,35,,260755,7232,EAB
36,,SING,OXT,HXT,no,N,36,,260755,7232,EAB
1,,SING,N,HN1,no,N,1,,260756,7232,NH2
2,,SING,N,HN2,no,N,2,,260756,7232,NH2
1,,SING,N,CA,no,N,1,,260777,7233,EAB
2,,SING,N,HN1,no,N,2,,260777,7233,EAB
3,,SING,N,HN2,no,N,3,,260777,7233,EAB
4,,SING,CA,CB,no,N,4,,260777,7233,EAB
5,,SING,CA,HA2,no,N,5,,260777,7233,EAB
6,,SING,CA,HA3,no,N,6,,260777,7233,EAB
7,,DOUB,CB,CG2,yes,N,7,,260777,7233,EAB
8,,SING,CB,CG1,yes,N,8,,260777,7233,EAB
9,,SING,CG2,CD2,yes,N,9,,260777,7233,EAB
10,,SING,CG2,HG2,no,N,10,,260777,7233,EAB
11,,DOUB,CD2,CE,yes,N,11,,260777,7233,EAB
12,,SING,CD2,HD2,no,N,12,,260777,7233,EAB
13,,SING,CE,CD1,yes,N,13,,260777,7233,EAB
14,,SING,CE,HE,no,N,14,,260777,7233,EAB
15,,DOUB,CD1,CG1,yes,N,15,,260777,7233,EAB
16,,SING,CD1,NG,no,N,16,,260777,7233,EAB
17,,SING,CG1,HG1,no,N,17,,260777,7233,EAB
18,,DOUB,NG,NI,no,E,18,,260777,7233,EAB
19,,SING,NI,CI,no,N,19,,260777,7233,EAB
20,,SING,CI,CJ2,yes,N,20,,260777,7233,EAB
21,,DOUB,CI,CJ1,yes,N,21,,260777,7233,EAB
22,,DOUB,CJ2,CK2,yes,N,22,,260777,7233,EAB
23,,SING,CJ2,HJ2,no,N,23,,260777,7233,EAB
24,,SING,CK2,CL,yes,N,24,,260777,7233,EAB
25,,SING,CK2,HK2,no,N,25,,260777,7233,EAB
26,,DOUB,CL,CK1,yes,N,26,,260777,7233,EAB
27,,SING,CL,HL,no,N,27,,260777,7233,EAB
28,,SING,CK1,CJ1,yes,N,28,,260777,7233,EAB
29,,SING,CK1,CM,no,N,29,,260777,7233,EAB
30,,SING,CJ1,HJ1,no,N,30,,260777,7233,EAB
31,,SING,CM,C,no,N,31,,260777,7233,EAB
32,,SING,CM,HM3,no,N,32,,260777,7233,EAB
33,,SING,CM,HM2,no,N,33,,260777,7233,EAB
34,,DOUB,C,O,no,N,34,,260777,7233,EAB
35,,SING,C,OXT,no,N,35,,260777,7233,EAB
36,,SING,OXT,HXT,no,N,36,,260777,7233,EAB
1,,SING,N,HN1,no,N,1,,260778,7233,NH2
2,,SING,N,HN2,no,N,2,,260778,7233,NH2
1,,SING,C1,C2,no,N,1,,260806,7234,BG6
2,,SING,C1,O1,no,N,2,,260806,7234,BG6
3,,SING,C1,O5,no,N,3,,260806,7234,BG6
4,,SING,C1,HC1,no,N,4,,260806,7234,BG6
5,,SING,C2,C3,no,N,5,,260806,7234,BG6
6,,SING,C2,O2,no,N,6,,260806,7234,BG6
7,,SING,C2,HC2,no,N,7,,260806,7234,BG6
8,,SING,O1,HO1,no,N,8,,260806,7234,BG6
9,,SING,O5,C5,no,N,9,,260806,7234,BG6
10,,SING,C3,C4,no,N,10,,260806,7234,BG6
11,,SING,C3,O3,no,N,11,,260806,7234,BG6
12,,SING,C3,HC3,no,N,12,,260806,7234,BG6
13,,SING,O2,HO2,no,N,13,,260806,7234,BG6
14,,SING,C4,C5,no,N,14,,260806,7234,BG6
15,,SING,C4,O4,no,N,15,,260806,7234,BG6
16,,SING,C4,HC4,no,N,16,,260806,7234,BG6
17,,SING,O3,HO3,no,N,17,,260806,7234,BG6
18,,SING,C5,C6,no,N,18,,260806,7234,BG6
19,,SING,C5,HC5,no,N,19,,260806,7234,BG6
20,,SING,O4,HO4,no,N,20,,260806,7234,BG6
21,,SING,C6,O6,no,N,21,,260806,7234,BG6
22,,SING,C6,HC61,no,N,22,,260806,7234,BG6
23,,SING,C6,HC62,no,N,23,,260806,7234,BG6
24,,SING,O6,P,no,N,24,,260806,7234,BG6
25,,SING,P,O1P,no,N,25,,260806,7234,BG6
26,,SING,P,O2P,no,N,26,,260806,7234,BG6
27,,DOUB,P,O3P,no,N,27,,260806,7234,BG6
28,,SING,O1P,H1O1,no,N,28,,260806,7234,BG6
29,,SING,O2P,H2O2,no,N,29,,260806,7234,BG6
1,,SING,F1,MG,no,N,1,,260807,7234,MGF
2,,SING,MG,F2,no,N,2,,260807,7234,MGF
3,,SING,MG,F3,no,N,3,,260807,7234,MGF
1,,SING,N,HN1,no,N,1,,261044,7245,NH2
2,,SING,N,HN2,no,N,2,,261044,7245,NH2
1,,SING,N,CA,no,N,1,,262039,7294,DTY
2,,SING,N,H,no,N,2,,262039,7294,DTY
3,,SING,N,H2,no,N,3,,262039,7294,DTY
4,,SING,CA,C,no,N,4,,262039,7294,DTY
5,,SING,CA,CB,no,N,5,,262039,7294,DTY
6,,SING,CA,HA,no,N,6,,262039,7294,DTY
7,,DOUB,C,O,no,N,7,,262039,7294,DTY
8,,SING,C,OXT,no,N,8,,262039,7294,DTY
9,,SING,CB,CG,no,N,9,,262039,7294,DTY
10,,SING,CB,HB2,no,N,10,,262039,7294,DTY
11,,SING,CB,HB3,no,N,11,,262039,7294,DTY
12,,DOUB,CG,CD1,yes,N,12,,262039,7294,DTY
13,,SING,CG,CD2,yes,N,13,,262039,7294,DTY
14,,SING,CD1,CE1,yes,N,14,,262039,7294,DTY
15,,SING,CD1,HD1,no,N,15,,262039,7294,DTY
16,,DOUB,CD2,CE2,yes,N,16,,262039,7294,DTY
17,,SING,CD2,HD2,no,N,17,,262039,7294,DTY
18,,DOUB,CE1,CZ,yes,N,18,,262039,7294,DTY
19,,SING,CE1,HE1,no,N,19,,262039,7294,DTY
20,,SING,CE2,CZ,yes,N,20,,262039,7294,DTY
21,,SING,CE2,HE2,no,N,21,,262039,7294,DTY
22,,SING,CZ,OH,no,N,22,,262039,7294,DTY
23,,SING,OH,HH,no,N,23,,262039,7294,DTY
24,,SING,OXT,HXT,no,N,24,,262039,7294,DTY
1,,SING,N,CA,no,N,1,,262040,7294,DSN
2,,SING,N,H,no,N,2,,262040,7294,DSN
3,,SING,N,H2,no,N,3,,262040,7294,DSN
4,,SING,CA,C,no,N,4,,262040,7294,DSN
5,,SING,CA,CB,no,N,5,,262040,7294,DSN
6,,SING,CA,HA,no,N,6,,262040,7294,DSN
7,,DOUB,C,O,no,N,7,,262040,7294,DSN
8,,SING,C,OXT,no,N,8,,262040,7294,DSN
9,,SING,OXT,HXT,no,N,9,,262040,7294,DSN
10,,SING,CB,OG,no,N,10,,262040,7294,DSN
11,,SING,CB,HB2,no,N,11,,262040,7294,DSN
12,,SING,CB,HB3,no,N,12,,262040,7294,DSN
13,,SING,OG,HG,no,N,13,,262040,7294,DSN
1,,SING,N,CA,no,N,1,,262041,7294,DSG
2,,SING,N,H,no,N,2,,262041,7294,DSG
3,,SING,N,H2,no,N,3,,262041,7294,DSG
4,,SING,CA,C,no,N,4,,262041,7294,DSG
5,,SING,CA,CB,no,N,5,,262041,7294,DSG
6,,SING,CA,HA,no,N,6,,262041,7294,DSG
7,,DOUB,C,O,no,N,7,,262041,7294,DSG
8,,SING,C,OXT,no,N,8,,262041,7294,DSG
9,,SING,CB,CG,no,N,9,,262041,7294,DSG
10,,SING,CB,HB2,no,N,10,,262041,7294,DSG
11,,SING,CB,HB3,no,N,11,,262041,7294,DSG
12,,DOUB,CG,OD1,no,N,12,,262041,7294,DSG
13,,SING,CG,ND2,no,N,13,,262041,7294,DSG
14,,SING,ND2,HD21,no,N,14,,262041,7294,DSG
15,,SING,ND2,HD22,no,N,15,,262041,7294,DSG
16,,SING,OXT,HXT,no,N,16,,262041,7294,DSG
1,,SING,N,H,no,N,1,,262042,7294,AFC
2,,SING,N,CA,no,N,2,,262042,7294,AFC
3,,SING,CA,HA,no,N,3,,262042,7294,AFC
4,,SING,CA,CG,no,N,4,,262042,7294,AFC
5,,SING,CA,CB,no,N,5,,262042,7294,AFC
6,,SING,CB,HB2,no,N,6,,262042,7294,AFC
7,,SING,CB,HB3,no,N,7,,262042,7294,AFC
8,,SING,CB,CD,no,N,8,,262042,7294,AFC
9,,SING,C,CG,no,N,9,,262042,7294,AFC
10,,DOUB,C,O,no,N,10,,262042,7294,AFC
11,,SING,CD,HD1,no,N,11,,262042,7294,AFC
12,,SING,CD,HD2,no,N,12,,262042,7294,AFC
13,,SING,CD,CE,no,N,13,,262042,7294,AFC
14,,SING,CE,HE1,no,N,14,,262042,7294,AFC
15,,SING,CE,HE2,no,N,15,,262042,7294,AFC
16,,SING,CE,CF,no,N,16,,262042,7294,AFC
17,,SING,CF,HF1,no,N,17,,262042,7294,AFC
18,,SING,CF,HF2,no,N,18,,262042,7294,AFC
19,,SING,CF,CI,no,N,19,,262042,7294,AFC
20,,SING,CI,HI1,no,N,20,,262042,7294,AFC
21,,SING,CI,HI2,no,N,21,,262042,7294,AFC
22,,SING,CI,CJ,no,N,22,,262042,7294,AFC
23,,SING,CJ,HJ1,no,N,23,,262042,7294,AFC
24,,SING,CJ,HJ2,no,N,24,,262042,7294,AFC
25,,SING,CJ,CK,no,N,25,,262042,7294,AFC
26,,SING,CK,HK1,no,N,26,,262042,7294,AFC
27,,SING,CK,HK2,no,N,27,,262042,7294,AFC
28,,SING,CK,CL,no,N,28,,262042,7294,AFC
29,,SING,CL,HL1,no,N,29,,262042,7294,AFC
30,,SING,CL,HL2,no,N,30,,262042,7294,AFC
31,,SING,CL,CM,no,N,31,,262042,7294,AFC
32,,SING,CM,HM,no,N,32,,262042,7294,AFC
33,,SING,CM,CN2,no,N,33,,262042,7294,AFC
34,,SING,CM,CN1,no,N,34,,262042,7294,AFC
35,,SING,CN2,HN21,no,N,35,,262042,7294,AFC
36,,SING,CN2,HN22,no,N,36,,262042,7294,AFC
37,,SING,CN2,HN23,no,N,37,,262042,7294,AFC
38,,SING,CN1,HN11,no,N,38,,262042,7294,AFC
39,,SING,CN1,HN12,no,N,39,,262042,7294,AFC
40,,SING,CN1,CO1,no,N,40,,262042,7294,AFC
41,,SING,CO1,HO11,no,N,41,,262042,7294,AFC
42,,SING,CO1,HO12,no,N,42,,262042,7294,AFC
43,,SING,CO1,HO13,no,N,43,,262042,7294,AFC
44,,SING,CG,HG1,no,N,44,,262042,7294,AFC
45,,SING,CG,HG2,no,N,45,,262042,7294,AFC
46,,SING,OXT,C,no,N,46,,262042,7294,AFC
47,,SING,H2,N,no,N,47,,262042,7294,AFC
48,,SING,OXT,HXT,no,N,48,,262042,7294,AFC
1,,SING,N,CA,no,N,1,,262065,7295,DTY
2,,SING,N,H,no,N,2,,262065,7295,DTY
3,,SING,N,H2,no,N,3,,262065,7295,DTY
4,,SING,CA,C,no,N,4,,262065,7295,DTY
5,,SING,CA,CB,no,N,5,,262065,7295,DTY
6,,SING,CA,HA,no,N,6,,262065,7295,DTY
7,,DOUB,C,O,no,N,7,,262065,7295,DTY
8,,SING,C,OXT,no,N,8,,262065,7295,DTY
9,,SING,CB,CG,no,N,9,,262065,7295,DTY
10,,SING,CB,HB2,no,N,10,,262065,7295,DTY
11,,SING,CB,HB3,no,N,11,,262065,7295,DTY
12,,DOUB,CG,CD1,yes,N,12,,262065,7295,DTY
13,,SING,CG,CD2,yes,N,13,,262065,7295,DTY
14,,SING,CD1,CE1,yes,N,14,,262065,7295,DTY
15,,SING,CD1,HD1,no,N,15,,262065,7295,DTY
16,,DOUB,CD2,CE2,yes,N,16,,262065,7295,DTY
17,,SING,CD2,HD2,no,N,17,,262065,7295,DTY
18,,DOUB,CE1,CZ,yes,N,18,,262065,7295,DTY
19,,SING,CE1,HE1,no,N,19,,262065,7295,DTY
20,,SING,CE2,CZ,yes,N,20,,262065,7295,DTY
21,,SING,CE2,HE2,no,N,21,,262065,7295,DTY
22,,SING,CZ,OH,no,N,22,,262065,7295,DTY
23,,SING,OH,HH,no,N,23,,262065,7295,DTY
24,,SING,OXT,HXT,no,N,24,,262065,7295,DTY
1,,SING,N,CA,no,N,1,,262066,7295,DSN
2,,SING,N,H,no,N,2,,262066,7295,DSN
3,,SING,N,H2,no,N,3,,262066,7295,DSN
4,,SING,CA,C,no,N,4,,262066,7295,DSN
5,,SING,CA,CB,no,N,5,,262066,7295,DSN
6,,SING,CA,HA,no,N,6,,262066,7295,DSN
7,,DOUB,C,O,no,N,7,,262066,7295,DSN
8,,SING,C,OXT,no,N,8,,262066,7295,DSN
9,,SING,OXT,HXT,no,N,9,,262066,7295,DSN
10,,SING,CB,OG,no,N,10,,262066,7295,DSN
11,,SING,CB,HB2,no,N,11,,262066,7295,DSN
12,,SING,CB,HB3,no,N,12,,262066,7295,DSN
13,,SING,OG,HG,no,N,13,,262066,7295,DSN
1,,SING,N,CA,no,N,1,,262067,7295,DSG
2,,SING,N,H,no,N,2,,262067,7295,DSG
3,,SING,N,H2,no,N,3,,262067,7295,DSG
4,,SING,CA,C,no,N,4,,262067,7295,DSG
5,,SING,CA,CB,no,N,5,,262067,7295,DSG
6,,SING,CA,HA,no,N,6,,262067,7295,DSG
7,,DOUB,C,O,no,N,7,,262067,7295,DSG
8,,SING,C,OXT,no,N,8,,262067,7295,DSG
9,,SING,CB,CG,no,N,9,,262067,7295,DSG
10,,SING,CB,HB2,no,N,10,,262067,7295,DSG
11,,SING,CB,HB3,no,N,11,,262067,7295,DSG
12,,DOUB,CG,OD1,no,N,12,,262067,7295,DSG
13,,SING,CG,ND2,no,N,13,,262067,7295,DSG
14,,SING,ND2,HD21,no,N,14,,262067,7295,DSG
15,,SING,ND2,HD22,no,N,15,,262067,7295,DSG
16,,SING,OXT,HXT,no,N,16,,262067,7295,DSG
1,,SING,N,CB,no,N,1,,262068,7295,BAL
2,,SING,N,H,no,N,2,,262068,7295,BAL
3,,SING,N,H2,no,N,3,,262068,7295,BAL
4,,SING,CB,CA,no,N,4,,262068,7295,BAL
5,,SING,CB,HB3,no,N,5,,262068,7295,BAL
6,,SING,CB,HB2,no,N,6,,262068,7295,BAL
7,,SING,CA,C,no,N,7,,262068,7295,BAL
8,,SING,CA,HA1,no,N,8,,262068,7295,BAL
9,,SING,CA,HA2,no,N,9,,262068,7295,BAL
10,,DOUB,C,O,no,N,10,,262068,7295,BAL
11,,SING,C,OXT,no,N,11,,262068,7295,BAL
12,,SING,OXT,HXT,no,N,12,,262068,7295,BAL
1,,SING,CHA,C1A,yes,N,1,,262090,7296,HEM
2,,DOUB,CHA,C4D,yes,N,2,,262090,7296,HEM
3,,SING,CHA,HHA,no,N,3,,262090,7296,HEM
4,,SING,CHB,C4A,yes,N,4,,262090,7296,HEM
5,,DOUB,CHB,C1B,yes,N,5,,262090,7296,HEM
6,,SING,CHB,HHB,no,N,6,,262090,7296,HEM
7,,SING,CHC,C4B,yes,N,7,,262090,7296,HEM
8,,DOUB,CHC,C1C,yes,N,8,,262090,7296,HEM
9,,SING,CHC,HHC,no,N,9,,262090,7296,HEM
10,,DOUB,CHD,C4C,yes,N,10,,262090,7296,HEM
11,,SING,CHD,C1D,yes,N,11,,262090,7296,HEM
12,,SING,CHD,HHD,no,N,12,,262090,7296,HEM
13,,DOUB,C1A,C2A,yes,N,13,,262090,7296,HEM
14,,SING,C1A,NA,yes,N,14,,262090,7296,HEM
15,,SING,C2A,C3A,yes,N,15,,262090,7296,HEM
16,,SING,C2A,CAA,no,N,16,,262090,7296,HEM
17,,DOUB,C3A,C4A,yes,N,17,,262090,7296,HEM
18,,SING,C3A,CMA,no,N,18,,262090,7296,HEM
19,,SING,C4A,NA,yes,N,19,,262090,7296,HEM
20,,SING,CMA,HMA,no,N,20,,262090,7296,HEM
21,,SING,CMA,HMAA,no,N,21,,262090,7296,HEM
22,,SING,CMA,HMAB,no,N,22,,262090,7296,HEM
23,,SING,CAA,CBA,no,N,23,,262090,7296,HEM
24,,SING,CAA,HAA,no,N,24,,262090,7296,HEM
25,,SING,CAA,HAAA,no,N,25,,262090,7296,HEM
26,,SING,CBA,CGA,no,N,26,,262090,7296,HEM
27,,SING,CBA,HBA,no,N,27,,262090,7296,HEM
28,,SING,CBA,HBAA,no,N,28,,262090,7296,HEM
29,,DOUB,CGA,O1A,no,N,29,,262090,7296,HEM
30,,SING,CGA,O2A,no,N,30,,262090,7296,HEM
31,,SING,C1B,C2B,no,N,31,,262090,7296,HEM
32,,SING,C1B,NB,yes,N,32,,262090,7296,HEM
33,,DOUB,C2B,C3B,yes,N,33,,262090,7296,HEM
34,,SING,C2B,CMB,yes,N,34,,262090,7296,HEM
35,,SING,C3B,C4B,no,N,35,,262090,7296,HEM
36,,SING,C3B,CAB,yes,N,36,,262090,7296,HEM
37,,DOUB,C4B,NB,no,N,37,,262090,7296,HEM
38,,SING,CMB,HMB,yes,N,38,,262090,7296,HEM
39,,SING,CMB,HMBA,no,N,39,,262090,7296,HEM
40,,SING,CMB,HMBB,no,N,40,,262090,7296,HEM
41,,DOUB,CAB,CBB,no,N,41,,262090,7296,HEM
42,,SING,CAB,HAB,no,N,42,,262090,7296,HEM
43,,SING,CBB,HBB,no,N,43,,262090,7296,HEM
44,,SING,CBB,HBBA,no,N,44,,262090,7296,HEM
45,,SING,C1C,C2C,no,N,45,,262090,7296,HEM
46,,SING,C1C,NC,yes,N,46,,262090,7296,HEM
47,,DOUB,C2C,C3C,yes,N,47,,262090,7296,HEM
48,,SING,C2C,CMC,yes,N,48,,262090,7296,HEM
49,,SING,C3C,C4C,no,N,49,,262090,7296,HEM
50,,SING,C3C,CAC,yes,N,50,,262090,7296,HEM
51,,SING,C4C,NC,no,N,51,,262090,7296,HEM
52,,SING,CMC,HMC,yes,N,52,,262090,7296,HEM
53,,SING,CMC,HMCA,no,N,53,,262090,7296,HEM
54,,SING,CMC,HMCB,no,N,54,,262090,7296,HEM
55,,DOUB,CAC,CBC,no,N,55,,262090,7296,HEM
56,,SING,CAC,HAC,no,N,56,,262090,7296,HEM
57,,SING,CBC,HBC,no,N,57,,262090,7296,HEM
58,,SING,CBC,HBCA,no,N,58,,262090,7296,HEM
59,,SING,C1D,C2D,no,N,59,,262090,7296,HEM
60,,DOUB,C1D,ND,yes,N,60,,262090,7296,HEM
61,,DOUB,C2D,C3D,yes,N,61,,262090,7296,HEM
62,,SING,C2D,CMD,yes,N,62,,262090,7296,HEM
63,,SING,C3D,C4D,no,N,63,,262090,7296,HEM
64,,SING,C3D,CAD,yes,N,64,,262090,7296,HEM
65,,SING,C4D,ND,no,N,65,,262090,7296,HEM
66,,SING,CMD,HMD,yes,N,66,,262090,7296,HEM
67,,SING,CMD,HMDA,no,N,67,,262090,7296,HEM
68,,SING,CMD,HMDB,no,N,68,,262090,7296,HEM
69,,SING,CAD,CBD,no,N,69,,262090,7296,HEM
70,,SING,CAD,HAD,no,N,70,,262090,7296,HEM
71,,SING,CAD,HADA,no,N,71,,262090,7296,HEM
72,,SING,CBD,CGD,no,N,72,,262090,7296,HEM
73,,SING,CBD,HBD,no,N,73,,262090,7296,HEM
74,,SING,CBD,HBDA,no,N,74,,262090,7296,HEM
75,,DOUB,CGD,O1D,no,N,75,,262090,7296,HEM
76,,SING,CGD,O2D,no,N,76,,262090,7296,HEM
77,,SING,O2A,H2A,no,N,77,,262090,7296,HEM
78,,SING,O2D,H2D,no,N,78,,262090,7296,HEM
79,,SING,FE,NA,no,N,79,,262090,7296,HEM
80,,SING,FE,NB,no,N,80,,262090,7296,HEM
81,,SING,FE,NC,no,N,81,,262090,7296,HEM
82,,SING,FE,ND,no,N,82,,262090,7296,HEM
1,,DOUB,C,O,no,N,1,,262161,7299,ACE
2,,SING,C,CH3,no,N,2,,262161,7299,ACE
3,,SING,C,H,no,N,3,,262161,7299,ACE
4,,SING,CH3,H1,no,N,4,,262161,7299,ACE
5,,SING,CH3,H2,no,N,5,,262161,7299,ACE
6,,SING,CH3,H3,no,N,6,,262161,7299,ACE
1,,SING,N,HN1,no,N,1,,262162,7299,NH2
2,,SING,N,HN2,no,N,2,,262162,7299,NH2
1,,DOUB,C,O,no,N,1,,262283,7306,ACE
2,,SING,C,CH3,no,N,2,,262283,7306,ACE
3,,SING,C,H,no,N,3,,262283,7306,ACE
4,,SING,CH3,H1,no,N,4,,262283,7306,ACE
5,,SING,CH3,H2,no,N,5,,262283,7306,ACE
6,,SING,CH3,H3,no,N,6,,262283,7306,ACE
1,,DOUB,C2,N1,yes,N,1,,262318,7308,TZO
2,,SING,C2,S3,yes,N,2,,262318,7308,TZO
3,,SING,C2,HC21,no,N,3,,262318,7308,TZO
4,,SING,N1,C5,yes,N,4,,262318,7308,TZO
5,,SING,S3,C4,yes,N,5,,262318,7308,TZO
6,,DOUB,C5,C4,yes,N,6,,262318,7308,TZO
7,,SING,C5,C6,no,N,7,,262318,7308,TZO
8,,SING,C4,HC41,no,N,8,,262318,7308,TZO
9,,DOUB,C6,O7,no,N,9,,262318,7308,TZO
10,,SING,C6,O61,no,N,10,,262318,7308,TZO
11,,SING,O61,HO',no,N,11,,262318,7308,TZO
1,,SING,C31,C41,no,N,1,,262319,7308,TZB
2,,DOUB,C31,C21,no,Z,2,,262319,7308,TZB
3,,SING,C31,HC3,no,N,3,,262319,7308,TZB
4,,SING,C41,HC1,no,N,4,,262319,7308,TZB
5,,SING,C41,HC2,no,N,5,,262319,7308,TZB
6,,SING,C41,HC3A,no,N,6,,262319,7308,TZB
7,,SING,C21,N,no,N,7,,262319,7308,TZB
8,,SING,C21,C2,no,N,8,,262319,7308,TZB
9,,SING,N,HN1,no,N,9,,262319,7308,TZB
10,,SING,N,HN2,no,N,10,,262319,7308,TZB
11,,SING,C2,S6,no,N,11,,262319,7308,TZB
12,,DOUB,C2,N1,no,N,12,,262319,7308,TZB
13,,SING,S6,C4,no,N,13,,262319,7308,TZB
14,,SING,C4,C5,no,N,14,,262319,7308,TZB
15,,SING,C4,HC41,no,N,15,,262319,7308,TZB
16,,SING,C4,HC42,no,N,16,,262319,7308,TZB
17,,SING,C5,C6,no,N,17,,262319,7308,TZB
18,,SING,C5,N1,no,N,18,,262319,7308,TZB
19,,SING,C5,HC5,no,N,19,,262319,7308,TZB
20,,DOUB,O7,C6,no,N,20,,262319,7308,TZB
21,,SING,C6,O71,no,N,21,,262319,7308,TZB
22,,SING,O71,HO',no,N,22,,262319,7308,TZB
1,,SING,C2,N1,no,N,1,,262320,7308,TSI
2,,SING,C2,C3,no,N,2,,262320,7308,TSI
3,,SING,C2,HC1,no,N,3,,262320,7308,TSI
4,,SING,C2,HC2,no,N,4,,262320,7308,TSI
5,,SING,N1,HN11,no,N,5,,262320,7308,TSI
6,,SING,N1,HN12,no,N,6,,262320,7308,TSI
7,,SING,C3,C5,no,N,7,,262320,7308,TSI
8,,SING,C3,O4,no,N,8,,262320,7308,TSI
9,,SING,C3,C6,no,N,9,,262320,7308,TSI
10,,SING,C5,HC1A,no,N,10,,262320,7308,TSI
11,,SING,C5,HC2A,no,N,11,,262320,7308,TSI
12,,SING,C5,HC3,no,N,12,,262320,7308,TSI
13,,SING,O4,HO4,no,N,13,,262320,7308,TSI
14,,SING,C6,C8,no,N,14,,262320,7308,TSI
15,,SING,C6,O7,no,N,15,,262320,7308,TSI
16,,SING,C6,HC6,no,N,16,,262320,7308,TSI
17,,SING,C8,H81,no,N,17,,262320,7308,TSI
18,,SING,C8,H82,no,N,18,,262320,7308,TSI
19,,SING,C8,H83,no,N,19,,262320,7308,TSI
20,,SING,O7,HO7,no,N,20,,262320,7308,TSI
1,,SING,C5,N1,yes,N,1,,262321,7308,XAA
2,,DOUB,C5,C4,yes,N,2,,262321,7308,XAA
3,,SING,C5,HC5,no,N,3,,262321,7308,XAA
4,,DOUB,N1,C2,yes,N,4,,262321,7308,XAA
5,,SING,C4,S3,yes,N,5,,262321,7308,XAA
6,,SING,C4,HC4,no,N,6,,262321,7308,XAA
7,,SING,C2,S3,yes,N,7,,262321,7308,XAA
8,,SING,C2,C6,no,N,8,,262321,7308,XAA
9,,SING,C6,N7,no,N,9,,262321,7308,XAA
10,,SING,C6,C8,no,N,10,,262321,7308,XAA
11,,SING,C6,HC6,no,N,11,,262321,7308,XAA
12,,SING,N7,HN71,no,N,12,,262321,7308,XAA
13,,SING,N7,HN72,no,N,13,,262321,7308,XAA
14,,SING,C8,C9,no,N,14,,262321,7308,XAA
15,,SING,C8,O10,no,N,15,,262321,7308,XAA
16,,SING,C8,HC8,no,N,16,,262321,7308,XAA
17,,SING,C9,HC1,no,N,17,,262321,7308,XAA
18,,SING,C9,HC2,no,N,18,,262321,7308,XAA
19,,SING,C9,HC3,no,N,19,,262321,7308,XAA
20,,SING,O10,H10,no,N,20,,262321,7308,XAA
1,,DOUB,O12,C11,no,N,1,,262322,7308,QUA
2,,SING,C11,C2,no,N,2,,262322,7308,QUA
3,,SING,C11,O1',no,N,3,,262322,7308,QUA
4,,DOUB,C2,N1,yes,N,4,,262322,7308,QUA
5,,SING,C2,C3,yes,N,5,,262322,7308,QUA
6,,SING,N1,C9,yes,N,6,,262322,7308,QUA
7,,DOUB,C3,C4,yes,N,7,,262322,7308,QUA
8,,SING,C3,HC3,no,N,8,,262322,7308,QUA
9,,SING,C9,C8,no,N,9,,262322,7308,QUA
10,,DOUB,C9,C10,yes,N,10,,262322,7308,QUA
11,,SING,C4,C10,yes,N,11,,262322,7308,QUA
12,,SING,C4,C13,no,N,12,,262322,7308,QUA
13,,SING,C8,O16,no,N,13,,262322,7308,QUA
14,,SING,C8,C7,no,N,14,,262322,7308,QUA
15,,SING,C8,HC8,no,N,15,,262322,7308,QUA
16,,SING,C10,C5,no,N,16,,262322,7308,QUA
17,,SING,O16,H16,no,N,17,,262322,7308,QUA
18,,SING,C7,C6,no,N,18,,262322,7308,QUA
19,,SING,C7,HC71,no,N,19,,262322,7308,QUA
20,,SING,C7,HC72,no,N,20,,262322,7308,QUA
21,,SING,C13,O15,no,N,21,,262322,7308,QUA
22,,SING,C13,C14,no,N,22,,262322,7308,QUA
23,,SING,C13,H13,no,N,23,,262322,7308,QUA
24,,SING,O15,H15,no,N,24,,262322,7308,QUA
25,,DOUB,C5,C6,no,N,25,,262322,7308,QUA
26,,SING,C5,HC5,no,N,26,,262322,7308,QUA
27,,SING,C14,H141,no,N,27,,262322,7308,QUA
28,,SING,C14,H142,no,N,28,,262322,7308,QUA
29,,SING,C14,H143,no,N,29,,262322,7308,QUA
30,,SING,C6,HC6,no,N,30,,262322,7308,QUA
31,,SING,O1',H1',no,N,31,,262322,7308,QUA
1,,SING,N,CA,no,N,1,,262323,7308,DHA
2,,SING,N,H,no,N,2,,262323,7308,DHA
3,,SING,N,H2,no,N,3,,262323,7308,DHA
4,,DOUB,CA,CB,no,N,4,,262323,7308,DHA
5,,SING,CA,C,no,N,5,,262323,7308,DHA
6,,SING,CB,HB1,no,N,6,,262323,7308,DHA
7,,SING,CB,HB2,no,N,7,,262323,7308,DHA
8,,DOUB,C,O,no,N,8,,262323,7308,DHA
9,,SING,C,OXT,no,N,9,,262323,7308,DHA
10,,SING,OXT,HXT,no,N,10,,262323,7308,DHA
1,,DOUB,C2,N1,no,N,1,,262324,7308,XBB
2,,SING,C2,C3,no,N,2,,262324,7308,XBB
3,,SING,C2,HC2,no,N,3,,262324,7308,XBB
4,,SING,N1,C6,no,N,4,,262324,7308,XBB
5,,SING,C3,C4,no,N,5,,262324,7308,XBB
6,,SING,C3,HC31,no,N,6,,262324,7308,XBB
7,,SING,C3,HC32,no,N,7,,262324,7308,XBB
8,,SING,C6,C5,no,N,8,,262324,7308,XBB
9,,SING,C6,HC61,no,N,9,,262324,7308,XBB
10,,SING,C6,HC62,no,N,10,,262324,7308,XBB
11,,SING,C5,C4,no,N,11,,262324,7308,XBB
12,,SING,C5,N7,no,N,12,,262324,7308,XBB
13,,SING,C5,HC5,no,N,13,,262324,7308,XBB
14,,SING,C4,HC41,no,N,14,,262324,7308,XBB
15,,SING,C4,HC42,no,N,15,,262324,7308,XBB
16,,SING,N7,HN71,no,N,16,,262324,7308,XBB
17,,SING,N7,HN72,no,N,17,,262324,7308,XBB
1,,SING,N,CA,no,N,1,,262325,7308,PYT
2,,SING,N,HN1,no,N,2,,262325,7308,PYT
3,,SING,N,HN2,no,N,3,,262325,7308,PYT
4,,DOUB,CA,CB,no,N,4,,262325,7308,PYT
5,,SING,CA,C,no,N,5,,262325,7308,PYT
6,,SING,CB,HC1,no,N,6,,262325,7308,PYT
7,,SING,CB,HC2,no,N,7,,262325,7308,PYT
8,,SING,C,NT,no,N,8,,262325,7308,PYT
9,,DOUB,C,O,no,N,9,,262325,7308,PYT
10,,SING,NT,HT1,no,N,10,,262325,7308,PYT
11,,SING,NT,HT2,no,N,11,,262325,7308,PYT
1,,DOUB,C1,O1,no,N,1,,262342,7309,MYR
2,,SING,C1,O2,no,N,2,,262342,7309,MYR
3,,SING,C1,C2,no,N,3,,262342,7309,MYR
4,,SING,O2,HO2,no,N,4,,262342,7309,MYR
5,,SING,C2,C3,no,N,5,,262342,7309,MYR
6,,SING,C2,H21,no,N,6,,262342,7309,MYR
7,,SING,C2,H22,no,N,7,,262342,7309,MYR
8,,SING,C3,C4,no,N,8,,262342,7309,MYR
9,,SING,C3,H31,no,N,9,,262342,7309,MYR
10,,SING,C3,H32,no,N,10,,262342,7309,MYR
11,,SING,C4,C5,no,N,11,,262342,7309,MYR
12,,SING,C4,H41,no,N,12,,262342,7309,MYR
13,,SING,C4,H42,no,N,13,,262342,7309,MYR
14,,SING,C5,C6,no,N,14,,262342,7309,MYR
15,,SING,C5,H51,no,N,15,,262342,7309,MYR
16,,SING,C5,H52,no,N,16,,262342,7309,MYR
17,,SING,C6,C7,no,N,17,,262342,7309,MYR
18,,SING,C6,H61,no,N,18,,262342,7309,MYR
19,,SING,C6,H62,no,N,19,,262342,7309,MYR
20,,SING,C7,C8,no,N,20,,262342,7309,MYR
21,,SING,C7,H71,no,N,21,,262342,7309,MYR
22,,SING,C7,H72,no,N,22,,262342,7309,MYR
23,,SING,C8,C9,no,N,23,,262342,7309,MYR
24,,SING,C8,H81,no,N,24,,262342,7309,MYR
25,,SING,C8,H82,no,N,25,,262342,7309,MYR
26,,SING,C9,C10,no,N,26,,262342,7309,MYR
27,,SING,C9,H91,no,N,27,,262342,7309,MYR
28,,SING,C9,H92,no,N,28,,262342,7309,MYR
29,,SING,C10,C11,no,N,29,,262342,7309,MYR
30,,SING,C10,H101,no,N,30,,262342,7309,MYR
31,,SING,C10,H102,no,N,31,,262342,7309,MYR
32,,SING,C11,C12,no,N,32,,262342,7309,MYR
33,,SING,C11,H111,no,N,33,,262342,7309,MYR
34,,SING,C11,H112,no,N,34,,262342,7309,MYR
35,,SING,C12,C13,no,N,35,,262342,7309,MYR
36,,SING,C12,H121,no,N,36,,262342,7309,MYR
37,,SING,C12,H122,no,N,37,,262342,7309,MYR
38,,SING,C13,C14,no,N,38,,262342,7309,MYR
39,,SING,C13,H131,no,N,39,,262342,7309,MYR
40,,SING,C13,H132,no,N,40,,262342,7309,MYR
41,,SING,C14,H141,no,N,41,,262342,7309,MYR
42,,SING,C14,H142,no,N,42,,262342,7309,MYR
43,,SING,C14,H143,no,N,43,,262342,7309,MYR
1,,SING,N,HN1,no,N,1,,262369,7311,NH2
2,,SING,N,HN2,no,N,2,,262369,7311,NH2
1,,SING,N,CA,no,N,1,,262753,7341,HYP
2,,SING,N,CD,no,N,2,,262753,7341,HYP
3,,SING,N,H,no,N,3,,262753,7341,HYP
4,,SING,CA,C,no,N,4,,262753,7341,HYP
5,,SING,CA,CB,no,N,5,,262753,7341,HYP
6,,SING,CA,HA,no,N,6,,262753,7341,HYP
7,,DOUB,C,O,no,N,7,,262753,7341,HYP
8,,SING,C,OXT,no,N,8,,262753,7341,HYP
9,,SING,CB,CG,no,N,9,,262753,7341,HYP
10,,SING,CB,HB2,no,N,10,,262753,7341,HYP
11,,SING,CB,HB3,no,N,11,,262753,7341,HYP
12,,SING,CG,CD,no,N,12,,262753,7341,HYP
13,,SING,CG,OD1,no,N,13,,262753,7341,HYP
14,,SING,CG,HG,no,N,14,,262753,7341,HYP
15,,SING,CD,HD22,no,N,15,,262753,7341,HYP
16,,SING,CD,HD23,no,N,16,,262753,7341,HYP
17,,SING,OD1,HD1,no,N,17,,262753,7341,HYP
18,,SING,OXT,HXT,no,N,18,,262753,7341,HYP
1,,SING,N,HN1,no,N,1,,262982,7361,NH2
2,,SING,N,HN2,no,N,2,,262982,7361,NH2
1,,SING,FE,NA,no,N,1,,263317,7390,HEC
2,,SING,FE,NB,no,N,2,,263317,7390,HEC
3,,SING,FE,NC,no,N,3,,263317,7390,HEC
4,,SING,FE,ND,no,N,4,,263317,7390,HEC
5,,DOUB,CHA,C1A,no,N,5,,263317,7390,HEC
6,,SING,CHA,C4D,no,N,6,,263317,7390,HEC
7,,SING,CHA,HHA,no,N,7,,263317,7390,HEC
8,,DOUB,CHB,C4A,no,N,8,,263317,7390,HEC
9,,SING,CHB,C1B,no,N,9,,263317,7390,HEC
10,,SING,CHB,HHB,no,N,10,,263317,7390,HEC
11,,DOUB,CHC,C4B,no,N,11,,263317,7390,HEC
12,,SING,CHC,C1C,no,N,12,,263317,7390,HEC
13,,SING,CHC,HHC,no,N,13,,263317,7390,HEC
14,,DOUB,CHD,C4C,no,N,14,,263317,7390,HEC
15,,SING,CHD,C1D,no,N,15,,263317,7390,HEC
16,,SING,CHD,HHD,no,N,16,,263317,7390,HEC
17,,SING,NA,C1A,yes,N,17,,263317,7390,HEC
18,,SING,NA,C4A,yes,N,18,,263317,7390,HEC
19,,SING,C1A,C2A,yes,N,19,,263317,7390,HEC
20,,DOUB,C2A,C3A,yes,N,20,,263317,7390,HEC
21,,SING,C2A,CAA,no,N,21,,263317,7390,HEC
22,,SING,C3A,C4A,yes,N,22,,263317,7390,HEC
23,,SING,C3A,CMA,no,N,23,,263317,7390,HEC
24,,SING,CMA,HMA1,no,N,24,,263317,7390,HEC
25,,SING,CMA,HMA2,no,N,25,,263317,7390,HEC
26,,SING,CMA,HMA3,no,N,26,,263317,7390,HEC
27,,SING,CAA,CBA,no,N,27,,263317,7390,HEC
28,,SING,CAA,HAA1,no,N,28,,263317,7390,HEC
29,,SING,CAA,HAA2,no,N,29,,263317,7390,HEC
30,,SING,CBA,CGA,no,N,30,,263317,7390,HEC
31,,SING,CBA,HBA1,no,N,31,,263317,7390,HEC
32,,SING,CBA,HBA2,no,N,32,,263317,7390,HEC
33,,DOUB,CGA,O1A,no,N,33,,263317,7390,HEC
34,,SING,CGA,O2A,no,N,34,,263317,7390,HEC
35,,SING,O2A,H2A,no,N,35,,263317,7390,HEC
36,,SING,NB,C1B,yes,N,36,,263317,7390,HEC
37,,SING,NB,C4B,yes,N,37,,263317,7390,HEC
38,,DOUB,C1B,C2B,yes,N,38,,263317,7390,HEC
39,,SING,C2B,C3B,yes,N,39,,263317,7390,HEC
40,,SING,C2B,CMB,no,N,40,,263317,7390,HEC
41,,SING,C3B,C4B,yes,N,41,,263317,7390,HEC
42,,DOUB,C3B,CAB,no,E,42,,263317,7390,HEC
43,,SING,CMB,HMB1,no,N,43,,263317,7390,HEC
44,,SING,CMB,HMB2,no,N,44,,263317,7390,HEC
45,,SING,CMB,HMB3,no,N,45,,263317,7390,HEC
46,,SING,CAB,CBB,no,N,46,,263317,7390,HEC
47,,SING,CAB,HAB,no,N,47,,263317,7390,HEC
48,,SING,CBB,HBB1,no,N,48,,263317,7390,HEC
49,,SING,CBB,HBB2,no,N,49,,263317,7390,HEC
50,,SING,CBB,HBB3,no,N,50,,263317,7390,HEC
51,,SING,NC,C1C,yes,N,51,,263317,7390,HEC
52,,SING,NC,C4C,yes,N,52,,263317,7390,HEC
53,,DOUB,C1C,C2C,yes,N,53,,263317,7390,HEC
54,,SING,C2C,C3C,yes,N,54,,263317,7390,HEC
55,,SING,C2C,CMC,no,N,55,,263317,7390,HEC
56,,SING,C3C,C4C,yes,N,56,,263317,7390,HEC
57,,DOUB,C3C,CAC,no,E,57,,263317,7390,HEC
58,,SING,CMC,HMC1,no,N,58,,263317,7390,HEC
59,,SING,CMC,HMC2,no,N,59,,263317,7390,HEC
60,,SING,CMC,HMC3,no,N,60,,263317,7390,HEC
61,,SING,CAC,CBC,no,N,61,,263317,7390,HEC
62,,SING,CAC,HAC,no,N,62,,263317,7390,HEC
63,,SING,CBC,HBC1,no,N,63,,263317,7390,HEC
64,,SING,CBC,HBC2,no,N,64,,263317,7390,HEC
65,,SING,CBC,HBC3,no,N,65,,263317,7390,HEC
66,,SING,ND,C1D,yes,N,66,,263317,7390,HEC
67,,SING,ND,C4D,yes,N,67,,263317,7390,HEC
68,,DOUB,C1D,C2D,yes,N,68,,263317,7390,HEC
69,,SING,C2D,C3D,yes,N,69,,263317,7390,HEC
70,,SING,C2D,CMD,no,N,70,,263317,7390,HEC
71,,DOUB,C3D,C4D,yes,N,71,,263317,7390,HEC
72,,SING,C3D,CAD,no,N,72,,263317,7390,HEC
73,,SING,CMD,HMD1,no,N,73,,263317,7390,HEC
74,,SING,CMD,HMD2,no,N,74,,263317,7390,HEC
75,,SING,CMD,HMD3,no,N,75,,263317,7390,HEC
76,,SING,CAD,CBD,no,N,76,,263317,7390,HEC
77,,SING,CAD,HAD1,no,N,77,,263317,7390,HEC
78,,SING,CAD,HAD2,no,N,78,,263317,7390,HEC
79,,SING,CBD,CGD,no,N,79,,263317,7390,HEC
80,,SING,CBD,HBD1,no,N,80,,263317,7390,HEC
81,,SING,CBD,HBD2,no,N,81,,263317,7390,HEC
82,,DOUB,CGD,O1D,no,N,82,,263317,7390,HEC
83,,SING,CGD,O2D,no,N,83,,263317,7390,HEC
84,,SING,O2D,H2D,no,N,84,,263317,7390,HEC
1,,SING,FE1,S1,no,N,1,,263318,7390,FES
2,,SING,FE1,S2,no,N,2,,263318,7390,FES
3,,SING,FE2,S1,no,N,3,,263318,7390,FES
4,,SING,FE2,S2,no,N,4,,263318,7390,FES
1,,SING,N,CA,,,,,263887,7429,PTR
2,,SING,N,H,,,,,263887,7429,PTR
3,,SING,N,HN2,,,,,263887,7429,PTR
4,,SING,CA,C,,,,,263887,7429,PTR
5,,SING,CA,CB,,,,,263887,7429,PTR
6,,SING,CA,HA,,,,,263887,7429,PTR
7,,DOUB,C,O,,,,,263887,7429,PTR
8,,SING,C,OXT,,,,,263887,7429,PTR
9,,SING,OXT,HXT,,,,,263887,7429,PTR
10,,SING,CB,CG,,,,,263887,7429,PTR
11,,SING,CB,HB2,,,,,263887,7429,PTR
12,,SING,CB,HB3,,,,,263887,7429,PTR
13,,DOUB,CG,CD1,,,,,263887,7429,PTR
14,,SING,CG,CD2,,,,,263887,7429,PTR
15,,SING,CD1,CE1,,,,,263887,7429,PTR
16,,SING,CD1,HD1,,,,,263887,7429,PTR
17,,DOUB,CD2,CE2,,,,,263887,7429,PTR
18,,SING,CD2,HD2,,,,,263887,7429,PTR
19,,DOUB,CE1,CZ,,,,,263887,7429,PTR
20,,SING,CE1,HE1,,,,,263887,7429,PTR
21,,SING,CE2,CZ,,,,,263887,7429,PTR
22,,SING,CE2,HE2,,,,,263887,7429,PTR
23,,SING,CZ,OH,,,,,263887,7429,PTR
24,,SING,OH,P,,,,,263887,7429,PTR
25,,DOUB,P,O1P,,,,,263887,7429,PTR
26,,SING,P,O2P,,,,,263887,7429,PTR
27,,SING,P,O3P,,,,,263887,7429,PTR
28,,SING,O2P,HO2P,,,,,263887,7429,PTR
29,,SING,O3P,HO3P,,,,,263887,7429,PTR
1,,SING,FE,NA,no,N,1,,264052,758,HEC
2,,SING,FE,NB,no,N,2,,264052,758,HEC
3,,SING,FE,NC,no,N,3,,264052,758,HEC
4,,SING,FE,ND,no,N,4,,264052,758,HEC
5,,DOUB,CHA,C1A,no,N,5,,264052,758,HEC
6,,SING,CHA,C4D,no,N,6,,264052,758,HEC
7,,SING,CHA,HHA,no,N,7,,264052,758,HEC
8,,DOUB,CHB,C4A,no,N,8,,264052,758,HEC
9,,SING,CHB,C1B,no,N,9,,264052,758,HEC
10,,SING,CHB,HHB,no,N,10,,264052,758,HEC
11,,DOUB,CHC,C4B,no,N,11,,264052,758,HEC
12,,SING,CHC,C1C,no,N,12,,264052,758,HEC
13,,SING,CHC,HHC,no,N,13,,264052,758,HEC
14,,DOUB,CHD,C4C,no,N,14,,264052,758,HEC
15,,SING,CHD,C1D,no,N,15,,264052,758,HEC
16,,SING,CHD,HHD,no,N,16,,264052,758,HEC
17,,SING,NA,C1A,yes,N,17,,264052,758,HEC
18,,SING,NA,C4A,yes,N,18,,264052,758,HEC
19,,SING,C1A,C2A,yes,N,19,,264052,758,HEC
20,,DOUB,C2A,C3A,yes,N,20,,264052,758,HEC
21,,SING,C2A,CAA,no,N,21,,264052,758,HEC
22,,SING,C3A,C4A,yes,N,22,,264052,758,HEC
23,,SING,C3A,CMA,no,N,23,,264052,758,HEC
24,,SING,CMA,HMA1,no,N,24,,264052,758,HEC
25,,SING,CMA,HMA2,no,N,25,,264052,758,HEC
26,,SING,CMA,HMA3,no,N,26,,264052,758,HEC
27,,SING,CAA,CBA,no,N,27,,264052,758,HEC
28,,SING,CAA,HAA1,no,N,28,,264052,758,HEC
29,,SING,CAA,HAA2,no,N,29,,264052,758,HEC
30,,SING,CBA,CGA,no,N,30,,264052,758,HEC
31,,SING,CBA,HBA1,no,N,31,,264052,758,HEC
32,,SING,CBA,HBA2,no,N,32,,264052,758,HEC
33,,DOUB,CGA,O1A,no,N,33,,264052,758,HEC
34,,SING,CGA,O2A,no,N,34,,264052,758,HEC
35,,SING,O2A,H2A,no,N,35,,264052,758,HEC
36,,SING,NB,C1B,yes,N,36,,264052,758,HEC
37,,SING,NB,C4B,yes,N,37,,264052,758,HEC
38,,DOUB,C1B,C2B,yes,N,38,,264052,758,HEC
39,,SING,C2B,C3B,yes,N,39,,264052,758,HEC
40,,SING,C2B,CMB,no,N,40,,264052,758,HEC
41,,SING,C3B,C4B,yes,N,41,,264052,758,HEC
42,,DOUB,C3B,CAB,no,E,42,,264052,758,HEC
43,,SING,CMB,HMB1,no,N,43,,264052,758,HEC
44,,SING,CMB,HMB2,no,N,44,,264052,758,HEC
45,,SING,CMB,HMB3,no,N,45,,264052,758,HEC
46,,SING,CAB,CBB,no,N,46,,264052,758,HEC
47,,SING,CAB,HAB,no,N,47,,264052,758,HEC
48,,SING,CBB,HBB1,no,N,48,,264052,758,HEC
49,,SING,CBB,HBB2,no,N,49,,264052,758,HEC
50,,SING,CBB,HBB3,no,N,50,,264052,758,HEC
51,,SING,NC,C1C,yes,N,51,,264052,758,HEC
52,,SING,NC,C4C,yes,N,52,,264052,758,HEC
53,,DOUB,C1C,C2C,yes,N,53,,264052,758,HEC
54,,SING,C2C,C3C,yes,N,54,,264052,758,HEC
55,,SING,C2C,CMC,no,N,55,,264052,758,HEC
56,,SING,C3C,C4C,yes,N,56,,264052,758,HEC
57,,DOUB,C3C,CAC,no,E,57,,264052,758,HEC
58,,SING,CMC,HMC1,no,N,58,,264052,758,HEC
59,,SING,CMC,HMC2,no,N,59,,264052,758,HEC
60,,SING,CMC,HMC3,no,N,60,,264052,758,HEC
61,,SING,CAC,CBC,no,N,61,,264052,758,HEC
62,,SING,CAC,HAC,no,N,62,,264052,758,HEC
63,,SING,CBC,HBC1,no,N,63,,264052,758,HEC
64,,SING,CBC,HBC2,no,N,64,,264052,758,HEC
65,,SING,CBC,HBC3,no,N,65,,264052,758,HEC
66,,SING,ND,C1D,yes,N,66,,264052,758,HEC
67,,SING,ND,C4D,yes,N,67,,264052,758,HEC
68,,DOUB,C1D,C2D,yes,N,68,,264052,758,HEC
69,,SING,C2D,C3D,yes,N,69,,264052,758,HEC
70,,SING,C2D,CMD,no,N,70,,264052,758,HEC
71,,DOUB,C3D,C4D,yes,N,71,,264052,758,HEC
72,,SING,C3D,CAD,no,N,72,,264052,758,HEC
73,,SING,CMD,HMD1,no,N,73,,264052,758,HEC
74,,SING,CMD,HMD2,no,N,74,,264052,758,HEC
75,,SING,CMD,HMD3,no,N,75,,264052,758,HEC
76,,SING,CAD,CBD,no,N,76,,264052,758,HEC
77,,SING,CAD,HAD1,no,N,77,,264052,758,HEC
78,,SING,CAD,HAD2,no,N,78,,264052,758,HEC
79,,SING,CBD,CGD,no,N,79,,264052,758,HEC
80,,SING,CBD,HBD1,no,N,80,,264052,758,HEC
81,,SING,CBD,HBD2,no,N,81,,264052,758,HEC
82,,DOUB,CGD,O1D,no,N,82,,264052,758,HEC
83,,SING,CGD,O2D,no,N,83,,264052,758,HEC
84,,SING,O2D,H2D,no,N,84,,264052,758,HEC
1,,SING,FE,NA,no,N,1,,264067,759,HEC
2,,SING,FE,NB,no,N,2,,264067,759,HEC
3,,SING,FE,NC,no,N,3,,264067,759,HEC
4,,SING,FE,ND,no,N,4,,264067,759,HEC
5,,DOUB,CHA,C1A,no,N,5,,264067,759,HEC
6,,SING,CHA,C4D,no,N,6,,264067,759,HEC
7,,SING,CHA,HHA,no,N,7,,264067,759,HEC
8,,DOUB,CHB,C4A,no,N,8,,264067,759,HEC
9,,SING,CHB,C1B,no,N,9,,264067,759,HEC
10,,SING,CHB,HHB,no,N,10,,264067,759,HEC
11,,DOUB,CHC,C4B,no,N,11,,264067,759,HEC
12,,SING,CHC,C1C,no,N,12,,264067,759,HEC
13,,SING,CHC,HHC,no,N,13,,264067,759,HEC
14,,DOUB,CHD,C4C,no,N,14,,264067,759,HEC
15,,SING,CHD,C1D,no,N,15,,264067,759,HEC
16,,SING,CHD,HHD,no,N,16,,264067,759,HEC
17,,SING,NA,C1A,yes,N,17,,264067,759,HEC
18,,SING,NA,C4A,yes,N,18,,264067,759,HEC
19,,SING,C1A,C2A,yes,N,19,,264067,759,HEC
20,,DOUB,C2A,C3A,yes,N,20,,264067,759,HEC
21,,SING,C2A,CAA,no,N,21,,264067,759,HEC
22,,SING,C3A,C4A,yes,N,22,,264067,759,HEC
23,,SING,C3A,CMA,no,N,23,,264067,759,HEC
24,,SING,CMA,HMA1,no,N,24,,264067,759,HEC
25,,SING,CMA,HMA2,no,N,25,,264067,759,HEC
26,,SING,CMA,HMA3,no,N,26,,264067,759,HEC
27,,SING,CAA,CBA,no,N,27,,264067,759,HEC
28,,SING,CAA,HAA1,no,N,28,,264067,759,HEC
29,,SING,CAA,HAA2,no,N,29,,264067,759,HEC
30,,SING,CBA,CGA,no,N,30,,264067,759,HEC
31,,SING,CBA,HBA1,no,N,31,,264067,759,HEC
32,,SING,CBA,HBA2,no,N,32,,264067,759,HEC
33,,DOUB,CGA,O1A,no,N,33,,264067,759,HEC
34,,SING,CGA,O2A,no,N,34,,264067,759,HEC
35,,SING,O2A,H2A,no,N,35,,264067,759,HEC
36,,SING,NB,C1B,yes,N,36,,264067,759,HEC
37,,SING,NB,C4B,yes,N,37,,264067,759,HEC
38,,DOUB,C1B,C2B,yes,N,38,,264067,759,HEC
39,,SING,C2B,C3B,yes,N,39,,264067,759,HEC
40,,SING,C2B,CMB,no,N,40,,264067,759,HEC
41,,SING,C3B,C4B,yes,N,41,,264067,759,HEC
42,,DOUB,C3B,CAB,no,E,42,,264067,759,HEC
43,,SING,CMB,HMB1,no,N,43,,264067,759,HEC
44,,SING,CMB,HMB2,no,N,44,,264067,759,HEC
45,,SING,CMB,HMB3,no,N,45,,264067,759,HEC
46,,SING,CAB,CBB,no,N,46,,264067,759,HEC
47,,SING,CAB,HAB,no,N,47,,264067,759,HEC
48,,SING,CBB,HBB1,no,N,48,,264067,759,HEC
49,,SING,CBB,HBB2,no,N,49,,264067,759,HEC
50,,SING,CBB,HBB3,no,N,50,,264067,759,HEC
51,,SING,NC,C1C,yes,N,51,,264067,759,HEC
52,,SING,NC,C4C,yes,N,52,,264067,759,HEC
53,,DOUB,C1C,C2C,yes,N,53,,264067,759,HEC
54,,SING,C2C,C3C,yes,N,54,,264067,759,HEC
55,,SING,C2C,CMC,no,N,55,,264067,759,HEC
56,,SING,C3C,C4C,yes,N,56,,264067,759,HEC
57,,DOUB,C3C,CAC,no,E,57,,264067,759,HEC
58,,SING,CMC,HMC1,no,N,58,,264067,759,HEC
59,,SING,CMC,HMC2,no,N,59,,264067,759,HEC
60,,SING,CMC,HMC3,no,N,60,,264067,759,HEC
61,,SING,CAC,CBC,no,N,61,,264067,759,HEC
62,,SING,CAC,HAC,no,N,62,,264067,759,HEC
63,,SING,CBC,HBC1,no,N,63,,264067,759,HEC
64,,SING,CBC,HBC2,no,N,64,,264067,759,HEC
65,,SING,CBC,HBC3,no,N,65,,264067,759,HEC
66,,SING,ND,C1D,yes,N,66,,264067,759,HEC
67,,SING,ND,C4D,yes,N,67,,264067,759,HEC
68,,DOUB,C1D,C2D,yes,N,68,,264067,759,HEC
69,,SING,C2D,C3D,yes,N,69,,264067,759,HEC
70,,SING,C2D,CMD,no,N,70,,264067,759,HEC
71,,DOUB,C3D,C4D,yes,N,71,,264067,759,HEC
72,,SING,C3D,CAD,no,N,72,,264067,759,HEC
73,,SING,CMD,HMD1,no,N,73,,264067,759,HEC
74,,SING,CMD,HMD2,no,N,74,,264067,759,HEC
75,,SING,CMD,HMD3,no,N,75,,264067,759,HEC
76,,SING,CAD,CBD,no,N,76,,264067,759,HEC
77,,SING,CAD,HAD1,no,N,77,,264067,759,HEC
78,,SING,CAD,HAD2,no,N,78,,264067,759,HEC
79,,SING,CBD,CGD,no,N,79,,264067,759,HEC
80,,SING,CBD,HBD1,no,N,80,,264067,759,HEC
81,,SING,CBD,HBD2,no,N,81,,264067,759,HEC
82,,DOUB,CGD,O1D,no,N,82,,264067,759,HEC
83,,SING,CGD,O2D,no,N,83,,264067,759,HEC
84,,SING,O2D,H2D,no,N,84,,264067,759,HEC
1,,SING,FE,NA,no,N,1,,264095,760,HEC
2,,SING,FE,NB,no,N,2,,264095,760,HEC
3,,SING,FE,NC,no,N,3,,264095,760,HEC
4,,SING,FE,ND,no,N,4,,264095,760,HEC
5,,DOUB,CHA,C1A,no,N,5,,264095,760,HEC
6,,SING,CHA,C4D,no,N,6,,264095,760,HEC
7,,SING,CHA,HHA,no,N,7,,264095,760,HEC
8,,DOUB,CHB,C4A,no,N,8,,264095,760,HEC
9,,SING,CHB,C1B,no,N,9,,264095,760,HEC
10,,SING,CHB,HHB,no,N,10,,264095,760,HEC
11,,DOUB,CHC,C4B,no,N,11,,264095,760,HEC
12,,SING,CHC,C1C,no,N,12,,264095,760,HEC
13,,SING,CHC,HHC,no,N,13,,264095,760,HEC
14,,DOUB,CHD,C4C,no,N,14,,264095,760,HEC
15,,SING,CHD,C1D,no,N,15,,264095,760,HEC
16,,SING,CHD,HHD,no,N,16,,264095,760,HEC
17,,SING,NA,C1A,yes,N,17,,264095,760,HEC
18,,SING,NA,C4A,yes,N,18,,264095,760,HEC
19,,SING,C1A,C2A,yes,N,19,,264095,760,HEC
20,,DOUB,C2A,C3A,yes,N,20,,264095,760,HEC
21,,SING,C2A,CAA,no,N,21,,264095,760,HEC
22,,SING,C3A,C4A,yes,N,22,,264095,760,HEC
23,,SING,C3A,CMA,no,N,23,,264095,760,HEC
24,,SING,CMA,HMA1,no,N,24,,264095,760,HEC
25,,SING,CMA,HMA2,no,N,25,,264095,760,HEC
26,,SING,CMA,HMA3,no,N,26,,264095,760,HEC
27,,SING,CAA,CBA,no,N,27,,264095,760,HEC
28,,SING,CAA,HAA1,no,N,28,,264095,760,HEC
29,,SING,CAA,HAA2,no,N,29,,264095,760,HEC
30,,SING,CBA,CGA,no,N,30,,264095,760,HEC
31,,SING,CBA,HBA1,no,N,31,,264095,760,HEC
32,,SING,CBA,HBA2,no,N,32,,264095,760,HEC
33,,DOUB,CGA,O1A,no,N,33,,264095,760,HEC
34,,SING,CGA,O2A,no,N,34,,264095,760,HEC
35,,SING,O2A,H2A,no,N,35,,264095,760,HEC
36,,SING,NB,C1B,yes,N,36,,264095,760,HEC
37,,SING,NB,C4B,yes,N,37,,264095,760,HEC
38,,DOUB,C1B,C2B,yes,N,38,,264095,760,HEC
39,,SING,C2B,C3B,yes,N,39,,264095,760,HEC
40,,SING,C2B,CMB,no,N,40,,264095,760,HEC
41,,SING,C3B,C4B,yes,N,41,,264095,760,HEC
42,,DOUB,C3B,CAB,no,E,42,,264095,760,HEC
43,,SING,CMB,HMB1,no,N,43,,264095,760,HEC
44,,SING,CMB,HMB2,no,N,44,,264095,760,HEC
45,,SING,CMB,HMB3,no,N,45,,264095,760,HEC
46,,SING,CAB,CBB,no,N,46,,264095,760,HEC
47,,SING,CAB,HAB,no,N,47,,264095,760,HEC
48,,SING,CBB,HBB1,no,N,48,,264095,760,HEC
49,,SING,CBB,HBB2,no,N,49,,264095,760,HEC
50,,SING,CBB,HBB3,no,N,50,,264095,760,HEC
51,,SING,NC,C1C,yes,N,51,,264095,760,HEC
52,,SING,NC,C4C,yes,N,52,,264095,760,HEC
53,,DOUB,C1C,C2C,yes,N,53,,264095,760,HEC
54,,SING,C2C,C3C,yes,N,54,,264095,760,HEC
55,,SING,C2C,CMC,no,N,55,,264095,760,HEC
56,,SING,C3C,C4C,yes,N,56,,264095,760,HEC
57,,DOUB,C3C,CAC,no,E,57,,264095,760,HEC
58,,SING,CMC,HMC1,no,N,58,,264095,760,HEC
59,,SING,CMC,HMC2,no,N,59,,264095,760,HEC
60,,SING,CMC,HMC3,no,N,60,,264095,760,HEC
61,,SING,CAC,CBC,no,N,61,,264095,760,HEC
62,,SING,CAC,HAC,no,N,62,,264095,760,HEC
63,,SING,CBC,HBC1,no,N,63,,264095,760,HEC
64,,SING,CBC,HBC2,no,N,64,,264095,760,HEC
65,,SING,CBC,HBC3,no,N,65,,264095,760,HEC
66,,SING,ND,C1D,yes,N,66,,264095,760,HEC
67,,SING,ND,C4D,yes,N,67,,264095,760,HEC
68,,DOUB,C1D,C2D,yes,N,68,,264095,760,HEC
69,,SING,C2D,C3D,yes,N,69,,264095,760,HEC
70,,SING,C2D,CMD,no,N,70,,264095,760,HEC
71,,DOUB,C3D,C4D,yes,N,71,,264095,760,HEC
72,,SING,C3D,CAD,no,N,72,,264095,760,HEC
73,,SING,CMD,HMD1,no,N,73,,264095,760,HEC
74,,SING,CMD,HMD2,no,N,74,,264095,760,HEC
75,,SING,CMD,HMD3,no,N,75,,264095,760,HEC
76,,SING,CAD,CBD,no,N,76,,264095,760,HEC
77,,SING,CAD,HAD1,no,N,77,,264095,760,HEC
78,,SING,CAD,HAD2,no,N,78,,264095,760,HEC
79,,SING,CBD,CGD,no,N,79,,264095,760,HEC
80,,SING,CBD,HBD1,no,N,80,,264095,760,HEC
81,,SING,CBD,HBD2,no,N,81,,264095,760,HEC
82,,DOUB,CGD,O1D,no,N,82,,264095,760,HEC
83,,SING,CGD,O2D,no,N,83,,264095,760,HEC
84,,SING,O2D,H2D,no,N,84,,264095,760,HEC
1,,SING,FE,NA,no,N,1,,264110,761,HEC
2,,SING,FE,NB,no,N,2,,264110,761,HEC
3,,SING,FE,NC,no,N,3,,264110,761,HEC
4,,SING,FE,ND,no,N,4,,264110,761,HEC
5,,DOUB,CHA,C1A,no,N,5,,264110,761,HEC
6,,SING,CHA,C4D,no,N,6,,264110,761,HEC
7,,SING,CHA,HHA,no,N,7,,264110,761,HEC
8,,DOUB,CHB,C4A,no,N,8,,264110,761,HEC
9,,SING,CHB,C1B,no,N,9,,264110,761,HEC
10,,SING,CHB,HHB,no,N,10,,264110,761,HEC
11,,DOUB,CHC,C4B,no,N,11,,264110,761,HEC
12,,SING,CHC,C1C,no,N,12,,264110,761,HEC
13,,SING,CHC,HHC,no,N,13,,264110,761,HEC
14,,DOUB,CHD,C4C,no,N,14,,264110,761,HEC
15,,SING,CHD,C1D,no,N,15,,264110,761,HEC
16,,SING,CHD,HHD,no,N,16,,264110,761,HEC
17,,SING,NA,C1A,yes,N,17,,264110,761,HEC
18,,SING,NA,C4A,yes,N,18,,264110,761,HEC
19,,SING,C1A,C2A,yes,N,19,,264110,761,HEC
20,,DOUB,C2A,C3A,yes,N,20,,264110,761,HEC
21,,SING,C2A,CAA,no,N,21,,264110,761,HEC
22,,SING,C3A,C4A,yes,N,22,,264110,761,HEC
23,,SING,C3A,CMA,no,N,23,,264110,761,HEC
24,,SING,CMA,HMA1,no,N,24,,264110,761,HEC
25,,SING,CMA,HMA2,no,N,25,,264110,761,HEC
26,,SING,CMA,HMA3,no,N,26,,264110,761,HEC
27,,SING,CAA,CBA,no,N,27,,264110,761,HEC
28,,SING,CAA,HAA1,no,N,28,,264110,761,HEC
29,,SING,CAA,HAA2,no,N,29,,264110,761,HEC
30,,SING,CBA,CGA,no,N,30,,264110,761,HEC
31,,SING,CBA,HBA1,no,N,31,,264110,761,HEC
32,,SING,CBA,HBA2,no,N,32,,264110,761,HEC
33,,DOUB,CGA,O1A,no,N,33,,264110,761,HEC
34,,SING,CGA,O2A,no,N,34,,264110,761,HEC
35,,SING,O2A,H2A,no,N,35,,264110,761,HEC
36,,SING,NB,C1B,yes,N,36,,264110,761,HEC
37,,SING,NB,C4B,yes,N,37,,264110,761,HEC
38,,DOUB,C1B,C2B,yes,N,38,,264110,761,HEC
39,,SING,C2B,C3B,yes,N,39,,264110,761,HEC
40,,SING,C2B,CMB,no,N,40,,264110,761,HEC
41,,SING,C3B,C4B,yes,N,41,,264110,761,HEC
42,,DOUB,C3B,CAB,no,E,42,,264110,761,HEC
43,,SING,CMB,HMB1,no,N,43,,264110,761,HEC
44,,SING,CMB,HMB2,no,N,44,,264110,761,HEC
45,,SING,CMB,HMB3,no,N,45,,264110,761,HEC
46,,SING,CAB,CBB,no,N,46,,264110,761,HEC
47,,SING,CAB,HAB,no,N,47,,264110,761,HEC
48,,SING,CBB,HBB1,no,N,48,,264110,761,HEC
49,,SING,CBB,HBB2,no,N,49,,264110,761,HEC
50,,SING,CBB,HBB3,no,N,50,,264110,761,HEC
51,,SING,NC,C1C,yes,N,51,,264110,761,HEC
52,,SING,NC,C4C,yes,N,52,,264110,761,HEC
53,,DOUB,C1C,C2C,yes,N,53,,264110,761,HEC
54,,SING,C2C,C3C,yes,N,54,,264110,761,HEC
55,,SING,C2C,CMC,no,N,55,,264110,761,HEC
56,,SING,C3C,C4C,yes,N,56,,264110,761,HEC
57,,DOUB,C3C,CAC,no,E,57,,264110,761,HEC
58,,SING,CMC,HMC1,no,N,58,,264110,761,HEC
59,,SING,CMC,HMC2,no,N,59,,264110,761,HEC
60,,SING,CMC,HMC3,no,N,60,,264110,761,HEC
61,,SING,CAC,CBC,no,N,61,,264110,761,HEC
62,,SING,CAC,HAC,no,N,62,,264110,761,HEC
63,,SING,CBC,HBC1,no,N,63,,264110,761,HEC
64,,SING,CBC,HBC2,no,N,64,,264110,761,HEC
65,,SING,CBC,HBC3,no,N,65,,264110,761,HEC
66,,SING,ND,C1D,yes,N,66,,264110,761,HEC
67,,SING,ND,C4D,yes,N,67,,264110,761,HEC
68,,DOUB,C1D,C2D,yes,N,68,,264110,761,HEC
69,,SING,C2D,C3D,yes,N,69,,264110,761,HEC
70,,SING,C2D,CMD,no,N,70,,264110,761,HEC
71,,DOUB,C3D,C4D,yes,N,71,,264110,761,HEC
72,,SING,C3D,CAD,no,N,72,,264110,761,HEC
73,,SING,CMD,HMD1,no,N,73,,264110,761,HEC
74,,SING,CMD,HMD2,no,N,74,,264110,761,HEC
75,,SING,CMD,HMD3,no,N,75,,264110,761,HEC
76,,SING,CAD,CBD,no,N,76,,264110,761,HEC
77,,SING,CAD,HAD1,no,N,77,,264110,761,HEC
78,,SING,CAD,HAD2,no,N,78,,264110,761,HEC
79,,SING,CBD,CGD,no,N,79,,264110,761,HEC
80,,SING,CBD,HBD1,no,N,80,,264110,761,HEC
81,,SING,CBD,HBD2,no,N,81,,264110,761,HEC
82,,DOUB,CGD,O1D,no,N,82,,264110,761,HEC
83,,SING,CGD,O2D,no,N,83,,264110,761,HEC
84,,SING,O2D,H2D,no,N,84,,264110,761,HEC
1,,SING,N,HN1,no,N,1,,264124,779,NH2
2,,SING,N,HN2,no,N,2,,264124,779,NH2
1,,SING,N,CA,no,N,1,,264240,811,AYA
2,,SING,N,CT,no,N,2,,264240,811,AYA
3,,SING,N,H,no,N,3,,264240,811,AYA
4,,SING,CA,CB,no,N,4,,264240,811,AYA
5,,SING,CA,C,no,N,5,,264240,811,AYA
6,,SING,CA,HA,no,N,6,,264240,811,AYA
7,,SING,CB,HB1,no,N,7,,264240,811,AYA
8,,SING,CB,HB2,no,N,8,,264240,811,AYA
9,,SING,CB,HB3,no,N,9,,264240,811,AYA
10,,DOUB,C,O,no,N,10,,264240,811,AYA
11,,SING,C,OXT,no,N,11,,264240,811,AYA
12,,SING,OXT,HXT,no,N,12,,264240,811,AYA
13,,DOUB,CT,OT,no,N,13,,264240,811,AYA
14,,SING,CT,CM,no,N,14,,264240,811,AYA
15,,SING,CM,HM1,no,N,15,,264240,811,AYA
16,,SING,CM,HM2,no,N,16,,264240,811,AYA
17,,SING,CM,HM3,no,N,17,,264240,811,AYA
1,,SING,N,CA,no,N,1,,264254,812,AYA
2,,SING,N,CT,no,N,2,,264254,812,AYA
3,,SING,N,H,no,N,3,,264254,812,AYA
4,,SING,CA,CB,no,N,4,,264254,812,AYA
5,,SING,CA,C,no,N,5,,264254,812,AYA
6,,SING,CA,HA,no,N,6,,264254,812,AYA
7,,SING,CB,HB1,no,N,7,,264254,812,AYA
8,,SING,CB,HB2,no,N,8,,264254,812,AYA
9,,SING,CB,HB3,no,N,9,,264254,812,AYA
10,,DOUB,C,O,no,N,10,,264254,812,AYA
11,,SING,C,OXT,no,N,11,,264254,812,AYA
12,,SING,OXT,HXT,no,N,12,,264254,812,AYA
13,,DOUB,CT,OT,no,N,13,,264254,812,AYA
14,,SING,CT,CM,no,N,14,,264254,812,AYA
15,,SING,CM,HM1,no,N,15,,264254,812,AYA
16,,SING,CM,HM2,no,N,16,,264254,812,AYA
17,,SING,CM,HM3,no,N,17,,264254,812,AYA
1,,SING,N,CA,no,N,1,,264268,813,AYA
2,,SING,N,CT,no,N,2,,264268,813,AYA
3,,SING,N,H,no,N,3,,264268,813,AYA
4,,SING,CA,CB,no,N,4,,264268,813,AYA
5,,SING,CA,C,no,N,5,,264268,813,AYA
6,,SING,CA,HA,no,N,6,,264268,813,AYA
7,,SING,CB,HB1,no,N,7,,264268,813,AYA
8,,SING,CB,HB2,no,N,8,,264268,813,AYA
9,,SING,CB,HB3,no,N,9,,264268,813,AYA
10,,DOUB,C,O,no,N,10,,264268,813,AYA
11,,SING,C,OXT,no,N,11,,264268,813,AYA
12,,SING,OXT,HXT,no,N,12,,264268,813,AYA
13,,DOUB,CT,OT,no,N,13,,264268,813,AYA
14,,SING,CT,CM,no,N,14,,264268,813,AYA
15,,SING,CM,HM1,no,N,15,,264268,813,AYA
16,,SING,CM,HM2,no,N,16,,264268,813,AYA
17,,SING,CM,HM3,no,N,17,,264268,813,AYA
1,,SING,N,CA,no,N,1,,264282,814,AYA
2,,SING,N,CT,no,N,2,,264282,814,AYA
3,,SING,N,H,no,N,3,,264282,814,AYA
4,,SING,CA,CB,no,N,4,,264282,814,AYA
5,,SING,CA,C,no,N,5,,264282,814,AYA
6,,SING,CA,HA,no,N,6,,264282,814,AYA
7,,SING,CB,HB1,no,N,7,,264282,814,AYA
8,,SING,CB,HB2,no,N,8,,264282,814,AYA
9,,SING,CB,HB3,no,N,9,,264282,814,AYA
10,,DOUB,C,O,no,N,10,,264282,814,AYA
11,,SING,C,OXT,no,N,11,,264282,814,AYA
12,,SING,OXT,HXT,no,N,12,,264282,814,AYA
13,,DOUB,CT,OT,no,N,13,,264282,814,AYA
14,,SING,CT,CM,no,N,14,,264282,814,AYA
15,,SING,CM,HM1,no,N,15,,264282,814,AYA
16,,SING,CM,HM2,no,N,16,,264282,814,AYA
17,,SING,CM,HM3,no,N,17,,264282,814,AYA
1,,SING,CT2,CT1,no,N,1,,264348,846,AME
2,,SING,CT2,HT23,no,N,2,,264348,846,AME
3,,SING,CT2,HT22,no,N,3,,264348,846,AME
4,,SING,CT2,HT21,no,N,4,,264348,846,AME
5,,DOUB,CT1,OT,no,N,5,,264348,846,AME
6,,SING,CT1,N,no,N,6,,264348,846,AME
7,,SING,CB,CG,no,N,7,,264348,846,AME
8,,SING,CB,CA,no,N,8,,264348,846,AME
9,,SING,CB,HB2,no,N,9,,264348,846,AME
10,,SING,CB,HB1,no,N,10,,264348,846,AME
11,,SING,CG,SD,no,N,11,,264348,846,AME
12,,SING,CG,HG2,no,N,12,,264348,846,AME
13,,SING,CG,HG1,no,N,13,,264348,846,AME
14,,SING,SD,CE,no,N,14,,264348,846,AME
15,,SING,CE,HE3,no,N,15,,264348,846,AME
16,,SING,CE,HE2,no,N,16,,264348,846,AME
17,,SING,CE,HE1,no,N,17,,264348,846,AME
18,,DOUB,C,O,no,N,18,,264348,846,AME
19,,SING,C,OXT,no,N,19,,264348,846,AME
20,,SING,C,CA,no,N,20,,264348,846,AME
21,,SING,OXT,HO,no,N,21,,264348,846,AME
22,,SING,N,CA,no,N,22,,264348,846,AME
23,,SING,N,HN1,no,N,23,,264348,846,AME
24,,SING,CA,HA,no,N,24,,264348,846,AME
1,,DOUB,C,O,no,N,1,,264388,86,ACE
2,,SING,C,CH3,no,N,2,,264388,86,ACE
3,,SING,C,H,no,N,3,,264388,86,ACE
4,,SING,CH3,H1,no,N,4,,264388,86,ACE
5,,SING,CH3,H2,no,N,5,,264388,86,ACE
6,,SING,CH3,H3,no,N,6,,264388,86,ACE
1,,SING,N,CA,no,N,1,,264389,86,AIB
2,,SING,N,H,no,N,2,,264389,86,AIB
3,,SING,N,H2,no,N,3,,264389,86,AIB
4,,SING,CA,C,no,N,4,,264389,86,AIB
5,,SING,CA,CB1,no,N,5,,264389,86,AIB
6,,SING,CA,CB2,no,N,6,,264389,86,AIB
7,,DOUB,C,O,no,N,7,,264389,86,AIB
8,,SING,C,OXT,no,N,8,,264389,86,AIB
9,,SING,OXT,HO2,no,N,9,,264389,86,AIB
10,,SING,CB1,HB11,no,N,10,,264389,86,AIB
11,,SING,CB1,HB12,no,N,11,,264389,86,AIB
12,,SING,CB1,HB13,no,N,12,,264389,86,AIB
13,,SING,CB2,HB21,no,N,13,,264389,86,AIB
14,,SING,CB2,HB22,no,N,14,,264389,86,AIB
15,,SING,CB2,HB23,no,N,15,,264389,86,AIB
1,,SING,N,CA,no,N,1,,264390,86,PHL
2,,SING,N,H,no,N,2,,264390,86,PHL
3,,SING,N,H2,no,N,3,,264390,86,PHL
4,,SING,CA,C,no,N,4,,264390,86,PHL
5,,SING,CA,CB,no,N,5,,264390,86,PHL
6,,SING,CA,HA,no,N,6,,264390,86,PHL
7,,SING,C,O,no,N,7,,264390,86,PHL
8,,SING,C,HC1,no,N,8,,264390,86,PHL
9,,SING,C,HC2,no,N,9,,264390,86,PHL
10,,SING,O,HO,no,N,10,,264390,86,PHL
11,,SING,CB,CG,no,N,11,,264390,86,PHL
12,,SING,CB,HB2,no,N,12,,264390,86,PHL
13,,SING,CB,HB3,no,N,13,,264390,86,PHL
14,,DOUB,CG,CD1,yes,N,14,,264390,86,PHL
15,,SING,CG,CD2,yes,N,15,,264390,86,PHL
16,,SING,CD1,CE1,yes,N,16,,264390,86,PHL
17,,SING,CD1,HD1,no,N,17,,264390,86,PHL
18,,DOUB,CD2,CE2,yes,N,18,,264390,86,PHL
19,,SING,CD2,HD2,no,N,19,,264390,86,PHL
20,,DOUB,CE1,CZ,yes,N,20,,264390,86,PHL
21,,SING,CE1,HE1,no,N,21,,264390,86,PHL
22,,SING,CE2,CZ,yes,N,22,,264390,86,PHL
23,,SING,CE2,HE2,no,N,23,,264390,86,PHL
24,,SING,CZ,HZ,no,N,24,,264390,86,PHL
1,,SING,CT2,CT1,no,N,1,,264403,862,AME
2,,SING,CT2,HT23,no,N,2,,264403,862,AME
3,,SING,CT2,HT22,no,N,3,,264403,862,AME
4,,SING,CT2,HT21,no,N,4,,264403,862,AME
5,,DOUB,CT1,OT,no,N,5,,264403,862,AME
6,,SING,CT1,N,no,N,6,,264403,862,AME
7,,SING,CB,CG,no,N,7,,264403,862,AME
8,,SING,CB,CA,no,N,8,,264403,862,AME
9,,SING,CB,HB2,no,N,9,,264403,862,AME
10,,SING,CB,HB1,no,N,10,,264403,862,AME
11,,SING,CG,SD,no,N,11,,264403,862,AME
12,,SING,CG,HG2,no,N,12,,264403,862,AME
13,,SING,CG,HG1,no,N,13,,264403,862,AME
14,,SING,SD,CE,no,N,14,,264403,862,AME
15,,SING,CE,HE3,no,N,15,,264403,862,AME
16,,SING,CE,HE2,no,N,16,,264403,862,AME
17,,SING,CE,HE1,no,N,17,,264403,862,AME
18,,DOUB,C,O,no,N,18,,264403,862,AME
19,,SING,C,OXT,no,N,19,,264403,862,AME
20,,SING,C,CA,no,N,20,,264403,862,AME
21,,SING,OXT,HO,no,N,21,,264403,862,AME
22,,SING,N,CA,no,N,22,,264403,862,AME
23,,SING,N,HN1,no,N,23,,264403,862,AME
24,,SING,CA,HA,no,N,24,,264403,862,AME
1,,SING,N,CA,no,N,1,,264417,87,PCA
2,,SING,N,CD,no,N,2,,264417,87,PCA
3,,SING,N,H,no,N,3,,264417,87,PCA
4,,SING,CA,CB,no,N,4,,264417,87,PCA
5,,SING,CA,C,no,N,5,,264417,87,PCA
6,,SING,CA,HA,no,N,6,,264417,87,PCA
7,,SING,CB,CG,no,N,7,,264417,87,PCA
8,,SING,CB,HB2,no,N,8,,264417,87,PCA
9,,SING,CB,HB3,no,N,9,,264417,87,PCA
10,,SING,CG,CD,no,N,10,,264417,87,PCA
11,,SING,CG,HG2,no,N,11,,264417,87,PCA
12,,SING,CG,HG3,no,N,12,,264417,87,PCA
13,,DOUB,CD,OE,no,N,13,,264417,87,PCA
14,,DOUB,C,O,no,N,14,,264417,87,PCA
15,,SING,C,OXT,no,N,15,,264417,87,PCA
16,,SING,OXT,HXT,no,N,16,,264417,87,PCA
1,,SING,N,HN1,no,N,1,,264418,87,NH2
2,,SING,N,HN2,no,N,2,,264418,87,NH2
1,,SING,FE,NA,no,N,1,,264433,877,HEC
2,,SING,FE,NB,no,N,2,,264433,877,HEC
3,,SING,FE,NC,no,N,3,,264433,877,HEC
4,,SING,FE,ND,no,N,4,,264433,877,HEC
5,,DOUB,CHA,C1A,no,N,5,,264433,877,HEC
6,,SING,CHA,C4D,no,N,6,,264433,877,HEC
7,,SING,CHA,HHA,no,N,7,,264433,877,HEC
8,,DOUB,CHB,C4A,no,N,8,,264433,877,HEC
9,,SING,CHB,C1B,no,N,9,,264433,877,HEC
10,,SING,CHB,HHB,no,N,10,,264433,877,HEC
11,,DOUB,CHC,C4B,no,N,11,,264433,877,HEC
12,,SING,CHC,C1C,no,N,12,,264433,877,HEC
13,,SING,CHC,HHC,no,N,13,,264433,877,HEC
14,,DOUB,CHD,C4C,no,N,14,,264433,877,HEC
15,,SING,CHD,C1D,no,N,15,,264433,877,HEC
16,,SING,CHD,HHD,no,N,16,,264433,877,HEC
17,,SING,NA,C1A,yes,N,17,,264433,877,HEC
18,,SING,NA,C4A,yes,N,18,,264433,877,HEC
19,,SING,C1A,C2A,yes,N,19,,264433,877,HEC
20,,DOUB,C2A,C3A,yes,N,20,,264433,877,HEC
21,,SING,C2A,CAA,no,N,21,,264433,877,HEC
22,,SING,C3A,C4A,yes,N,22,,264433,877,HEC
23,,SING,C3A,CMA,no,N,23,,264433,877,HEC
24,,SING,CMA,HMA1,no,N,24,,264433,877,HEC
25,,SING,CMA,HMA2,no,N,25,,264433,877,HEC
26,,SING,CMA,HMA3,no,N,26,,264433,877,HEC
27,,SING,CAA,CBA,no,N,27,,264433,877,HEC
28,,SING,CAA,HAA1,no,N,28,,264433,877,HEC
29,,SING,CAA,HAA2,no,N,29,,264433,877,HEC
30,,SING,CBA,CGA,no,N,30,,264433,877,HEC
31,,SING,CBA,HBA1,no,N,31,,264433,877,HEC
32,,SING,CBA,HBA2,no,N,32,,264433,877,HEC
33,,DOUB,CGA,O1A,no,N,33,,264433,877,HEC
34,,SING,CGA,O2A,no,N,34,,264433,877,HEC
35,,SING,O2A,H2A,no,N,35,,264433,877,HEC
36,,SING,NB,C1B,yes,N,36,,264433,877,HEC
37,,SING,NB,C4B,yes,N,37,,264433,877,HEC
38,,DOUB,C1B,C2B,yes,N,38,,264433,877,HEC
39,,SING,C2B,C3B,yes,N,39,,264433,877,HEC
40,,SING,C2B,CMB,no,N,40,,264433,877,HEC
41,,SING,C3B,C4B,yes,N,41,,264433,877,HEC
42,,DOUB,C3B,CAB,no,E,42,,264433,877,HEC
43,,SING,CMB,HMB1,no,N,43,,264433,877,HEC
44,,SING,CMB,HMB2,no,N,44,,264433,877,HEC
45,,SING,CMB,HMB3,no,N,45,,264433,877,HEC
46,,SING,CAB,CBB,no,N,46,,264433,877,HEC
47,,SING,CAB,HAB,no,N,47,,264433,877,HEC
48,,SING,CBB,HBB1,no,N,48,,264433,877,HEC
49,,SING,CBB,HBB2,no,N,49,,264433,877,HEC
50,,SING,CBB,HBB3,no,N,50,,264433,877,HEC
51,,SING,NC,C1C,yes,N,51,,264433,877,HEC
52,,SING,NC,C4C,yes,N,52,,264433,877,HEC
53,,DOUB,C1C,C2C,yes,N,53,,264433,877,HEC
54,,SING,C2C,C3C,yes,N,54,,264433,877,HEC
55,,SING,C2C,CMC,no,N,55,,264433,877,HEC
56,,SING,C3C,C4C,yes,N,56,,264433,877,HEC
57,,DOUB,C3C,CAC,no,E,57,,264433,877,HEC
58,,SING,CMC,HMC1,no,N,58,,264433,877,HEC
59,,SING,CMC,HMC2,no,N,59,,264433,877,HEC
60,,SING,CMC,HMC3,no,N,60,,264433,877,HEC
61,,SING,CAC,CBC,no,N,61,,264433,877,HEC
62,,SING,CAC,HAC,no,N,62,,264433,877,HEC
63,,SING,CBC,HBC1,no,N,63,,264433,877,HEC
64,,SING,CBC,HBC2,no,N,64,,264433,877,HEC
65,,SING,CBC,HBC3,no,N,65,,264433,877,HEC
66,,SING,ND,C1D,yes,N,66,,264433,877,HEC
67,,SING,ND,C4D,yes,N,67,,264433,877,HEC
68,,DOUB,C1D,C2D,yes,N,68,,264433,877,HEC
69,,SING,C2D,C3D,yes,N,69,,264433,877,HEC
70,,SING,C2D,CMD,no,N,70,,264433,877,HEC
71,,DOUB,C3D,C4D,yes,N,71,,264433,877,HEC
72,,SING,C3D,CAD,no,N,72,,264433,877,HEC
73,,SING,CMD,HMD1,no,N,73,,264433,877,HEC
74,,SING,CMD,HMD2,no,N,74,,264433,877,HEC
75,,SING,CMD,HMD3,no,N,75,,264433,877,HEC
76,,SING,CAD,CBD,no,N,76,,264433,877,HEC
77,,SING,CAD,HAD1,no,N,77,,264433,877,HEC
78,,SING,CAD,HAD2,no,N,78,,264433,877,HEC
79,,SING,CBD,CGD,no,N,79,,264433,877,HEC
80,,SING,CBD,HBD1,no,N,80,,264433,877,HEC
81,,SING,CBD,HBD2,no,N,81,,264433,877,HEC
82,,DOUB,CGD,O1D,no,N,82,,264433,877,HEC
83,,SING,CGD,O2D,no,N,83,,264433,877,HEC
84,,SING,O2D,H2D,no,N,84,,264433,877,HEC
1,,SING,N,CA,no,N,1,,264434,877,M3L
2,,SING,N,H,no,N,2,,264434,877,M3L
3,,SING,N,H2,no,N,3,,264434,877,M3L
4,,SING,CA,CB,no,N,4,,264434,877,M3L
5,,SING,CA,C,no,N,5,,264434,877,M3L
6,,SING,CA,HA,no,N,6,,264434,877,M3L
7,,SING,CB,CG,no,N,7,,264434,877,M3L
8,,SING,CB,HB2,no,N,8,,264434,877,M3L
9,,SING,CB,HB3,no,N,9,,264434,877,M3L
10,,SING,CG,CD,no,N,10,,264434,877,M3L
11,,SING,CG,HG2,no,N,11,,264434,877,M3L
12,,SING,CG,HG3,no,N,12,,264434,877,M3L
13,,SING,CD,CE,no,N,13,,264434,877,M3L
14,,SING,CD,HD2,no,N,14,,264434,877,M3L
15,,SING,CD,HD3,no,N,15,,264434,877,M3L
16,,SING,CE,NZ,no,N,16,,264434,877,M3L
17,,SING,CE,HE2,no,N,17,,264434,877,M3L
18,,SING,CE,HE3,no,N,18,,264434,877,M3L
19,,SING,NZ,CM1,no,N,19,,264434,877,M3L
20,,SING,NZ,CM2,no,N,20,,264434,877,M3L
21,,SING,NZ,CM3,no,N,21,,264434,877,M3L
22,,DOUB,C,O,no,N,22,,264434,877,M3L
23,,SING,C,OXT,no,N,23,,264434,877,M3L
24,,SING,OXT,HXT,no,N,24,,264434,877,M3L
25,,SING,CM1,HM11,no,N,25,,264434,877,M3L
26,,SING,CM1,HM12,no,N,26,,264434,877,M3L
27,,SING,CM1,HM13,no,N,27,,264434,877,M3L
28,,SING,CM2,HM21,no,N,28,,264434,877,M3L
29,,SING,CM2,HM22,no,N,29,,264434,877,M3L
30,,SING,CM2,HM23,no,N,30,,264434,877,M3L
31,,SING,CM3,HM31,no,N,31,,264434,877,M3L
32,,SING,CM3,HM32,no,N,32,,264434,877,M3L
33,,SING,CM3,HM33,no,N,33,,264434,877,M3L
1,,SING,FE,NA,no,N,1,,264449,878,HEC
2,,SING,FE,NB,no,N,2,,264449,878,HEC
3,,SING,FE,NC,no,N,3,,264449,878,HEC
4,,SING,FE,ND,no,N,4,,264449,878,HEC
5,,DOUB,CHA,C1A,no,N,5,,264449,878,HEC
6,,SING,CHA,C4D,no,N,6,,264449,878,HEC
7,,SING,CHA,HHA,no,N,7,,264449,878,HEC
8,,DOUB,CHB,C4A,no,N,8,,264449,878,HEC
9,,SING,CHB,C1B,no,N,9,,264449,878,HEC
10,,SING,CHB,HHB,no,N,10,,264449,878,HEC
11,,DOUB,CHC,C4B,no,N,11,,264449,878,HEC
12,,SING,CHC,C1C,no,N,12,,264449,878,HEC
13,,SING,CHC,HHC,no,N,13,,264449,878,HEC
14,,DOUB,CHD,C4C,no,N,14,,264449,878,HEC
15,,SING,CHD,C1D,no,N,15,,264449,878,HEC
16,,SING,CHD,HHD,no,N,16,,264449,878,HEC
17,,SING,NA,C1A,yes,N,17,,264449,878,HEC
18,,SING,NA,C4A,yes,N,18,,264449,878,HEC
19,,SING,C1A,C2A,yes,N,19,,264449,878,HEC
20,,DOUB,C2A,C3A,yes,N,20,,264449,878,HEC
21,,SING,C2A,CAA,no,N,21,,264449,878,HEC
22,,SING,C3A,C4A,yes,N,22,,264449,878,HEC
23,,SING,C3A,CMA,no,N,23,,264449,878,HEC
24,,SING,CMA,HMA1,no,N,24,,264449,878,HEC
25,,SING,CMA,HMA2,no,N,25,,264449,878,HEC
26,,SING,CMA,HMA3,no,N,26,,264449,878,HEC
27,,SING,CAA,CBA,no,N,27,,264449,878,HEC
28,,SING,CAA,HAA1,no,N,28,,264449,878,HEC
29,,SING,CAA,HAA2,no,N,29,,264449,878,HEC
30,,SING,CBA,CGA,no,N,30,,264449,878,HEC
31,,SING,CBA,HBA1,no,N,31,,264449,878,HEC
32,,SING,CBA,HBA2,no,N,32,,264449,878,HEC
33,,DOUB,CGA,O1A,no,N,33,,264449,878,HEC
34,,SING,CGA,O2A,no,N,34,,264449,878,HEC
35,,SING,O2A,H2A,no,N,35,,264449,878,HEC
36,,SING,NB,C1B,yes,N,36,,264449,878,HEC
37,,SING,NB,C4B,yes,N,37,,264449,878,HEC
38,,DOUB,C1B,C2B,yes,N,38,,264449,878,HEC
39,,SING,C2B,C3B,yes,N,39,,264449,878,HEC
40,,SING,C2B,CMB,no,N,40,,264449,878,HEC
41,,SING,C3B,C4B,yes,N,41,,264449,878,HEC
42,,DOUB,C3B,CAB,no,E,42,,264449,878,HEC
43,,SING,CMB,HMB1,no,N,43,,264449,878,HEC
44,,SING,CMB,HMB2,no,N,44,,264449,878,HEC
45,,SING,CMB,HMB3,no,N,45,,264449,878,HEC
46,,SING,CAB,CBB,no,N,46,,264449,878,HEC
47,,SING,CAB,HAB,no,N,47,,264449,878,HEC
48,,SING,CBB,HBB1,no,N,48,,264449,878,HEC
49,,SING,CBB,HBB2,no,N,49,,264449,878,HEC
50,,SING,CBB,HBB3,no,N,50,,264449,878,HEC
51,,SING,NC,C1C,yes,N,51,,264449,878,HEC
52,,SING,NC,C4C,yes,N,52,,264449,878,HEC
53,,DOUB,C1C,C2C,yes,N,53,,264449,878,HEC
54,,SING,C2C,C3C,yes,N,54,,264449,878,HEC
55,,SING,C2C,CMC,no,N,55,,264449,878,HEC
56,,SING,C3C,C4C,yes,N,56,,264449,878,HEC
57,,DOUB,C3C,CAC,no,E,57,,264449,878,HEC
58,,SING,CMC,HMC1,no,N,58,,264449,878,HEC
59,,SING,CMC,HMC2,no,N,59,,264449,878,HEC
60,,SING,CMC,HMC3,no,N,60,,264449,878,HEC
61,,SING,CAC,CBC,no,N,61,,264449,878,HEC
62,,SING,CAC,HAC,no,N,62,,264449,878,HEC
63,,SING,CBC,HBC1,no,N,63,,264449,878,HEC
64,,SING,CBC,HBC2,no,N,64,,264449,878,HEC
65,,SING,CBC,HBC3,no,N,65,,264449,878,HEC
66,,SING,ND,C1D,yes,N,66,,264449,878,HEC
67,,SING,ND,C4D,yes,N,67,,264449,878,HEC
68,,DOUB,C1D,C2D,yes,N,68,,264449,878,HEC
69,,SING,C2D,C3D,yes,N,69,,264449,878,HEC
70,,SING,C2D,CMD,no,N,70,,264449,878,HEC
71,,DOUB,C3D,C4D,yes,N,71,,264449,878,HEC
72,,SING,C3D,CAD,no,N,72,,264449,878,HEC
73,,SING,CMD,HMD1,no,N,73,,264449,878,HEC
74,,SING,CMD,HMD2,no,N,74,,264449,878,HEC
75,,SING,CMD,HMD3,no,N,75,,264449,878,HEC
76,,SING,CAD,CBD,no,N,76,,264449,878,HEC
77,,SING,CAD,HAD1,no,N,77,,264449,878,HEC
78,,SING,CAD,HAD2,no,N,78,,264449,878,HEC
79,,SING,CBD,CGD,no,N,79,,264449,878,HEC
80,,SING,CBD,HBD1,no,N,80,,264449,878,HEC
81,,SING,CBD,HBD2,no,N,81,,264449,878,HEC
82,,DOUB,CGD,O1D,no,N,82,,264449,878,HEC
83,,SING,CGD,O2D,no,N,83,,264449,878,HEC
84,,SING,O2D,H2D,no,N,84,,264449,878,HEC
1,,SING,N,CA,no,N,1,,264450,878,M3L
2,,SING,N,H,no,N,2,,264450,878,M3L
3,,SING,N,H2,no,N,3,,264450,878,M3L
4,,SING,CA,CB,no,N,4,,264450,878,M3L
5,,SING,CA,C,no,N,5,,264450,878,M3L
6,,SING,CA,HA,no,N,6,,264450,878,M3L
7,,SING,CB,CG,no,N,7,,264450,878,M3L
8,,SING,CB,HB2,no,N,8,,264450,878,M3L
9,,SING,CB,HB3,no,N,9,,264450,878,M3L
10,,SING,CG,CD,no,N,10,,264450,878,M3L
11,,SING,CG,HG2,no,N,11,,264450,878,M3L
12,,SING,CG,HG3,no,N,12,,264450,878,M3L
13,,SING,CD,CE,no,N,13,,264450,878,M3L
14,,SING,CD,HD2,no,N,14,,264450,878,M3L
15,,SING,CD,HD3,no,N,15,,264450,878,M3L
16,,SING,CE,NZ,no,N,16,,264450,878,M3L
17,,SING,CE,HE2,no,N,17,,264450,878,M3L
18,,SING,CE,HE3,no,N,18,,264450,878,M3L
19,,SING,NZ,CM1,no,N,19,,264450,878,M3L
20,,SING,NZ,CM2,no,N,20,,264450,878,M3L
21,,SING,NZ,CM3,no,N,21,,264450,878,M3L
22,,DOUB,C,O,no,N,22,,264450,878,M3L
23,,SING,C,OXT,no,N,23,,264450,878,M3L
24,,SING,OXT,HXT,no,N,24,,264450,878,M3L
25,,SING,CM1,HM11,no,N,25,,264450,878,M3L
26,,SING,CM1,HM12,no,N,26,,264450,878,M3L
27,,SING,CM1,HM13,no,N,27,,264450,878,M3L
28,,SING,CM2,HM21,no,N,28,,264450,878,M3L
29,,SING,CM2,HM22,no,N,29,,264450,878,M3L
30,,SING,CM2,HM23,no,N,30,,264450,878,M3L
31,,SING,CM3,HM31,no,N,31,,264450,878,M3L
32,,SING,CM3,HM32,no,N,32,,264450,878,M3L
33,,SING,CM3,HM33,no,N,33,,264450,878,M3L
1,,SING,N,CA,no,N,1,,264543,9,PCA
2,,SING,N,CD,no,N,2,,264543,9,PCA
3,,SING,N,H,no,N,3,,264543,9,PCA
4,,SING,CA,CB,no,N,4,,264543,9,PCA
5,,SING,CA,C,no,N,5,,264543,9,PCA
6,,SING,CA,HA,no,N,6,,264543,9,PCA
7,,SING,CB,CG,no,N,7,,264543,9,PCA
8,,SING,CB,HB2,no,N,8,,264543,9,PCA
9,,SING,CB,HB3,no,N,9,,264543,9,PCA
10,,SING,CG,CD,no,N,10,,264543,9,PCA
11,,SING,CG,HG2,no,N,11,,264543,9,PCA
12,,SING,CG,HG3,no,N,12,,264543,9,PCA
13,,DOUB,CD,OE,no,N,13,,264543,9,PCA
14,,DOUB,C,O,no,N,14,,264543,9,PCA
15,,SING,C,OXT,no,N,15,,264543,9,PCA
16,,SING,OXT,HXT,no,N,16,,264543,9,PCA
1,,SING,N,CA,no,N,1,,264738,922,M3L
2,,SING,N,H,no,N,2,,264738,922,M3L
3,,SING,N,H2,no,N,3,,264738,922,M3L
4,,SING,CA,CB,no,N,4,,264738,922,M3L
5,,SING,CA,C,no,N,5,,264738,922,M3L
6,,SING,CA,HA,no,N,6,,264738,922,M3L
7,,SING,CB,CG,no,N,7,,264738,922,M3L
8,,SING,CB,HB2,no,N,8,,264738,922,M3L
9,,SING,CB,HB3,no,N,9,,264738,922,M3L
10,,SING,CG,CD,no,N,10,,264738,922,M3L
11,,SING,CG,HG2,no,N,11,,264738,922,M3L
12,,SING,CG,HG3,no,N,12,,264738,922,M3L
13,,SING,CD,CE,no,N,13,,264738,922,M3L
14,,SING,CD,HD2,no,N,14,,264738,922,M3L
15,,SING,CD,HD3,no,N,15,,264738,922,M3L
16,,SING,CE,NZ,no,N,16,,264738,922,M3L
17,,SING,CE,HE2,no,N,17,,264738,922,M3L
18,,SING,CE,HE3,no,N,18,,264738,922,M3L
19,,SING,NZ,CM1,no,N,19,,264738,922,M3L
20,,SING,NZ,CM2,no,N,20,,264738,922,M3L
21,,SING,NZ,CM3,no,N,21,,264738,922,M3L
22,,DOUB,C,O,no,N,22,,264738,922,M3L
23,,SING,C,OXT,no,N,23,,264738,922,M3L
24,,SING,OXT,HXT,no,N,24,,264738,922,M3L
25,,SING,CM1,HM11,no,N,25,,264738,922,M3L
26,,SING,CM1,HM12,no,N,26,,264738,922,M3L
27,,SING,CM1,HM13,no,N,27,,264738,922,M3L
28,,SING,CM2,HM21,no,N,28,,264738,922,M3L
29,,SING,CM2,HM22,no,N,29,,264738,922,M3L
30,,SING,CM2,HM23,no,N,30,,264738,922,M3L
31,,SING,CM3,HM31,no,N,31,,264738,922,M3L
32,,SING,CM3,HM32,no,N,32,,264738,922,M3L
33,,SING,CM3,HM33,no,N,33,,264738,922,M3L
1,,SING,FE,NA,no,N,1,,264739,922,HEC
2,,SING,FE,NB,no,N,2,,264739,922,HEC
3,,SING,FE,NC,no,N,3,,264739,922,HEC
4,,SING,FE,ND,no,N,4,,264739,922,HEC
5,,DOUB,CHA,C1A,no,N,5,,264739,922,HEC
6,,SING,CHA,C4D,no,N,6,,264739,922,HEC
7,,SING,CHA,HHA,no,N,7,,264739,922,HEC
8,,DOUB,CHB,C4A,no,N,8,,264739,922,HEC
9,,SING,CHB,C1B,no,N,9,,264739,922,HEC
10,,SING,CHB,HHB,no,N,10,,264739,922,HEC
11,,DOUB,CHC,C4B,no,N,11,,264739,922,HEC
12,,SING,CHC,C1C,no,N,12,,264739,922,HEC
13,,SING,CHC,HHC,no,N,13,,264739,922,HEC
14,,DOUB,CHD,C4C,no,N,14,,264739,922,HEC
15,,SING,CHD,C1D,no,N,15,,264739,922,HEC
16,,SING,CHD,HHD,no,N,16,,264739,922,HEC
17,,SING,NA,C1A,yes,N,17,,264739,922,HEC
18,,SING,NA,C4A,yes,N,18,,264739,922,HEC
19,,SING,C1A,C2A,yes,N,19,,264739,922,HEC
20,,DOUB,C2A,C3A,yes,N,20,,264739,922,HEC
21,,SING,C2A,CAA,no,N,21,,264739,922,HEC
22,,SING,C3A,C4A,yes,N,22,,264739,922,HEC
23,,SING,C3A,CMA,no,N,23,,264739,922,HEC
24,,SING,CMA,HMA1,no,N,24,,264739,922,HEC
25,,SING,CMA,HMA2,no,N,25,,264739,922,HEC
26,,SING,CMA,HMA3,no,N,26,,264739,922,HEC
27,,SING,CAA,CBA,no,N,27,,264739,922,HEC
28,,SING,CAA,HAA1,no,N,28,,264739,922,HEC
29,,SING,CAA,HAA2,no,N,29,,264739,922,HEC
30,,SING,CBA,CGA,no,N,30,,264739,922,HEC
31,,SING,CBA,HBA1,no,N,31,,264739,922,HEC
32,,SING,CBA,HBA2,no,N,32,,264739,922,HEC
33,,DOUB,CGA,O1A,no,N,33,,264739,922,HEC
34,,SING,CGA,O2A,no,N,34,,264739,922,HEC
35,,SING,O2A,H2A,no,N,35,,264739,922,HEC
36,,SING,NB,C1B,yes,N,36,,264739,922,HEC
37,,SING,NB,C4B,yes,N,37,,264739,922,HEC
38,,DOUB,C1B,C2B,yes,N,38,,264739,922,HEC
39,,SING,C2B,C3B,yes,N,39,,264739,922,HEC
40,,SING,C2B,CMB,no,N,40,,264739,922,HEC
41,,SING,C3B,C4B,yes,N,41,,264739,922,HEC
42,,DOUB,C3B,CAB,no,E,42,,264739,922,HEC
43,,SING,CMB,HMB1,no,N,43,,264739,922,HEC
44,,SING,CMB,HMB2,no,N,44,,264739,922,HEC
45,,SING,CMB,HMB3,no,N,45,,264739,922,HEC
46,,SING,CAB,CBB,no,N,46,,264739,922,HEC
47,,SING,CAB,HAB,no,N,47,,264739,922,HEC
48,,SING,CBB,HBB1,no,N,48,,264739,922,HEC
49,,SING,CBB,HBB2,no,N,49,,264739,922,HEC
50,,SING,CBB,HBB3,no,N,50,,264739,922,HEC
51,,SING,NC,C1C,yes,N,51,,264739,922,HEC
52,,SING,NC,C4C,yes,N,52,,264739,922,HEC
53,,DOUB,C1C,C2C,yes,N,53,,264739,922,HEC
54,,SING,C2C,C3C,yes,N,54,,264739,922,HEC
55,,SING,C2C,CMC,no,N,55,,264739,922,HEC
56,,SING,C3C,C4C,yes,N,56,,264739,922,HEC
57,,DOUB,C3C,CAC,no,E,57,,264739,922,HEC
58,,SING,CMC,HMC1,no,N,58,,264739,922,HEC
59,,SING,CMC,HMC2,no,N,59,,264739,922,HEC
60,,SING,CMC,HMC3,no,N,60,,264739,922,HEC
61,,SING,CAC,CBC,no,N,61,,264739,922,HEC
62,,SING,CAC,HAC,no,N,62,,264739,922,HEC
63,,SING,CBC,HBC1,no,N,63,,264739,922,HEC
64,,SING,CBC,HBC2,no,N,64,,264739,922,HEC
65,,SING,CBC,HBC3,no,N,65,,264739,922,HEC
66,,SING,ND,C1D,yes,N,66,,264739,922,HEC
67,,SING,ND,C4D,yes,N,67,,264739,922,HEC
68,,DOUB,C1D,C2D,yes,N,68,,264739,922,HEC
69,,SING,C2D,C3D,yes,N,69,,264739,922,HEC
70,,SING,C2D,CMD,no,N,70,,264739,922,HEC
71,,DOUB,C3D,C4D,yes,N,71,,264739,922,HEC
72,,SING,C3D,CAD,no,N,72,,264739,922,HEC
73,,SING,CMD,HMD1,no,N,73,,264739,922,HEC
74,,SING,CMD,HMD2,no,N,74,,264739,922,HEC
75,,SING,CMD,HMD3,no,N,75,,264739,922,HEC
76,,SING,CAD,CBD,no,N,76,,264739,922,HEC
77,,SING,CAD,HAD1,no,N,77,,264739,922,HEC
78,,SING,CAD,HAD2,no,N,78,,264739,922,HEC
79,,SING,CBD,CGD,no,N,79,,264739,922,HEC
80,,SING,CBD,HBD1,no,N,80,,264739,922,HEC
81,,SING,CBD,HBD2,no,N,81,,264739,922,HEC
82,,DOUB,CGD,O1D,no,N,82,,264739,922,HEC
83,,SING,CGD,O2D,no,N,83,,264739,922,HEC
84,,SING,O2D,H2D,no,N,84,,264739,922,HEC
1,,SING,FE,NA,no,N,1,,264755,923,HEC
2,,SING,FE,NB,no,N,2,,264755,923,HEC
3,,SING,FE,NC,no,N,3,,264755,923,HEC
4,,SING,FE,ND,no,N,4,,264755,923,HEC
5,,DOUB,CHA,C1A,no,N,5,,264755,923,HEC
6,,SING,CHA,C4D,no,N,6,,264755,923,HEC
7,,SING,CHA,HHA,no,N,7,,264755,923,HEC
8,,DOUB,CHB,C4A,no,N,8,,264755,923,HEC
9,,SING,CHB,C1B,no,N,9,,264755,923,HEC
10,,SING,CHB,HHB,no,N,10,,264755,923,HEC
11,,DOUB,CHC,C4B,no,N,11,,264755,923,HEC
12,,SING,CHC,C1C,no,N,12,,264755,923,HEC
13,,SING,CHC,HHC,no,N,13,,264755,923,HEC
14,,DOUB,CHD,C4C,no,N,14,,264755,923,HEC
15,,SING,CHD,C1D,no,N,15,,264755,923,HEC
16,,SING,CHD,HHD,no,N,16,,264755,923,HEC
17,,SING,NA,C1A,yes,N,17,,264755,923,HEC
18,,SING,NA,C4A,yes,N,18,,264755,923,HEC
19,,SING,C1A,C2A,yes,N,19,,264755,923,HEC
20,,DOUB,C2A,C3A,yes,N,20,,264755,923,HEC
21,,SING,C2A,CAA,no,N,21,,264755,923,HEC
22,,SING,C3A,C4A,yes,N,22,,264755,923,HEC
23,,SING,C3A,CMA,no,N,23,,264755,923,HEC
24,,SING,CMA,HMA1,no,N,24,,264755,923,HEC
25,,SING,CMA,HMA2,no,N,25,,264755,923,HEC
26,,SING,CMA,HMA3,no,N,26,,264755,923,HEC
27,,SING,CAA,CBA,no,N,27,,264755,923,HEC
28,,SING,CAA,HAA1,no,N,28,,264755,923,HEC
29,,SING,CAA,HAA2,no,N,29,,264755,923,HEC
30,,SING,CBA,CGA,no,N,30,,264755,923,HEC
31,,SING,CBA,HBA1,no,N,31,,264755,923,HEC
32,,SING,CBA,HBA2,no,N,32,,264755,923,HEC
33,,DOUB,CGA,O1A,no,N,33,,264755,923,HEC
34,,SING,CGA,O2A,no,N,34,,264755,923,HEC
35,,SING,O2A,H2A,no,N,35,,264755,923,HEC
36,,SING,NB,C1B,yes,N,36,,264755,923,HEC
37,,SING,NB,C4B,yes,N,37,,264755,923,HEC
38,,DOUB,C1B,C2B,yes,N,38,,264755,923,HEC
39,,SING,C2B,C3B,yes,N,39,,264755,923,HEC
40,,SING,C2B,CMB,no,N,40,,264755,923,HEC
41,,SING,C3B,C4B,yes,N,41,,264755,923,HEC
42,,DOUB,C3B,CAB,no,E,42,,264755,923,HEC
43,,SING,CMB,HMB1,no,N,43,,264755,923,HEC
44,,SING,CMB,HMB2,no,N,44,,264755,923,HEC
45,,SING,CMB,HMB3,no,N,45,,264755,923,HEC
46,,SING,CAB,CBB,no,N,46,,264755,923,HEC
47,,SING,CAB,HAB,no,N,47,,264755,923,HEC
48,,SING,CBB,HBB1,no,N,48,,264755,923,HEC
49,,SING,CBB,HBB2,no,N,49,,264755,923,HEC
50,,SING,CBB,HBB3,no,N,50,,264755,923,HEC
51,,SING,NC,C1C,yes,N,51,,264755,923,HEC
52,,SING,NC,C4C,yes,N,52,,264755,923,HEC
53,,DOUB,C1C,C2C,yes,N,53,,264755,923,HEC
54,,SING,C2C,C3C,yes,N,54,,264755,923,HEC
55,,SING,C2C,CMC,no,N,55,,264755,923,HEC
56,,SING,C3C,C4C,yes,N,56,,264755,923,HEC
57,,DOUB,C3C,CAC,no,E,57,,264755,923,HEC
58,,SING,CMC,HMC1,no,N,58,,264755,923,HEC
59,,SING,CMC,HMC2,no,N,59,,264755,923,HEC
60,,SING,CMC,HMC3,no,N,60,,264755,923,HEC
61,,SING,CAC,CBC,no,N,61,,264755,923,HEC
62,,SING,CAC,HAC,no,N,62,,264755,923,HEC
63,,SING,CBC,HBC1,no,N,63,,264755,923,HEC
64,,SING,CBC,HBC2,no,N,64,,264755,923,HEC
65,,SING,CBC,HBC3,no,N,65,,264755,923,HEC
66,,SING,ND,C1D,yes,N,66,,264755,923,HEC
67,,SING,ND,C4D,yes,N,67,,264755,923,HEC
68,,DOUB,C1D,C2D,yes,N,68,,264755,923,HEC
69,,SING,C2D,C3D,yes,N,69,,264755,923,HEC
70,,SING,C2D,CMD,no,N,70,,264755,923,HEC
71,,DOUB,C3D,C4D,yes,N,71,,264755,923,HEC
72,,SING,C3D,CAD,no,N,72,,264755,923,HEC
73,,SING,CMD,HMD1,no,N,73,,264755,923,HEC
74,,SING,CMD,HMD2,no,N,74,,264755,923,HEC
75,,SING,CMD,HMD3,no,N,75,,264755,923,HEC
76,,SING,CAD,CBD,no,N,76,,264755,923,HEC
77,,SING,CAD,HAD1,no,N,77,,264755,923,HEC
78,,SING,CAD,HAD2,no,N,78,,264755,923,HEC
79,,SING,CBD,CGD,no,N,79,,264755,923,HEC
80,,SING,CBD,HBD1,no,N,80,,264755,923,HEC
81,,SING,CBD,HBD2,no,N,81,,264755,923,HEC
82,,DOUB,CGD,O1D,no,N,82,,264755,923,HEC
83,,SING,CGD,O2D,no,N,83,,264755,923,HEC
84,,SING,O2D,H2D,no,N,84,,264755,923,HEC
1,,SING,N,CA,no,N,1,,264756,923,M3L
2,,SING,N,H,no,N,2,,264756,923,M3L
3,,SING,N,H2,no,N,3,,264756,923,M3L
4,,SING,CA,CB,no,N,4,,264756,923,M3L
5,,SING,CA,C,no,N,5,,264756,923,M3L
6,,SING,CA,HA,no,N,6,,264756,923,M3L
7,,SING,CB,CG,no,N,7,,264756,923,M3L
8,,SING,CB,HB2,no,N,8,,264756,923,M3L
9,,SING,CB,HB3,no,N,9,,264756,923,M3L
10,,SING,CG,CD,no,N,10,,264756,923,M3L
11,,SING,CG,HG2,no,N,11,,264756,923,M3L
12,,SING,CG,HG3,no,N,12,,264756,923,M3L
13,,SING,CD,CE,no,N,13,,264756,923,M3L
14,,SING,CD,HD2,no,N,14,,264756,923,M3L
15,,SING,CD,HD3,no,N,15,,264756,923,M3L
16,,SING,CE,NZ,no,N,16,,264756,923,M3L
17,,SING,CE,HE2,no,N,17,,264756,923,M3L
18,,SING,CE,HE3,no,N,18,,264756,923,M3L
19,,SING,NZ,CM1,no,N,19,,264756,923,M3L
20,,SING,NZ,CM2,no,N,20,,264756,923,M3L
21,,SING,NZ,CM3,no,N,21,,264756,923,M3L
22,,DOUB,C,O,no,N,22,,264756,923,M3L
23,,SING,C,OXT,no,N,23,,264756,923,M3L
24,,SING,OXT,HXT,no,N,24,,264756,923,M3L
25,,SING,CM1,HM11,no,N,25,,264756,923,M3L
26,,SING,CM1,HM12,no,N,26,,264756,923,M3L
27,,SING,CM1,HM13,no,N,27,,264756,923,M3L
28,,SING,CM2,HM21,no,N,28,,264756,923,M3L
29,,SING,CM2,HM22,no,N,29,,264756,923,M3L
30,,SING,CM2,HM23,no,N,30,,264756,923,M3L
31,,SING,CM3,HM31,no,N,31,,264756,923,M3L
32,,SING,CM3,HM32,no,N,32,,264756,923,M3L
33,,SING,CM3,HM33,no,N,33,,264756,923,M3L
1,,SING,CT2,CT1,no,N,1,,264783,934,AME
2,,SING,CT2,HT23,no,N,2,,264783,934,AME
3,,SING,CT2,HT22,no,N,3,,264783,934,AME
4,,SING,CT2,HT21,no,N,4,,264783,934,AME
5,,DOUB,CT1,OT,no,N,5,,264783,934,AME
6,,SING,CT1,N,no,N,6,,264783,934,AME
7,,SING,CB,CG,no,N,7,,264783,934,AME
8,,SING,CB,CA,no,N,8,,264783,934,AME
9,,SING,CB,HB2,no,N,9,,264783,934,AME
10,,SING,CB,HB1,no,N,10,,264783,934,AME
11,,SING,CG,SD,no,N,11,,264783,934,AME
12,,SING,CG,HG2,no,N,12,,264783,934,AME
13,,SING,CG,HG1,no,N,13,,264783,934,AME
14,,SING,SD,CE,no,N,14,,264783,934,AME
15,,SING,CE,HE3,no,N,15,,264783,934,AME
16,,SING,CE,HE2,no,N,16,,264783,934,AME
17,,SING,CE,HE1,no,N,17,,264783,934,AME
18,,DOUB,C,O,no,N,18,,264783,934,AME
19,,SING,C,OXT,no,N,19,,264783,934,AME
20,,SING,C,CA,no,N,20,,264783,934,AME
21,,SING,OXT,HO,no,N,21,,264783,934,AME
22,,SING,N,CA,no,N,22,,264783,934,AME
23,,SING,N,HN1,no,N,23,,264783,934,AME
24,,SING,CA,HA,no,N,24,,264783,934,AME
1,,SING,C1,C2,no,N,1,,264863,944,AAC
2,,SING,C1,O1,no,N,2,,264863,944,AAC
3,,DOUB,C1,O2,no,N,3,,264863,944,AAC
4,,SING,C2,N1,no,N,4,,264863,944,AAC
5,,SING,C2,HC21,no,N,5,,264863,944,AAC
6,,SING,C2,HC22,no,N,6,,264863,944,AAC
7,,SING,C3,C4,no,N,7,,264863,944,AAC
8,,SING,C3,N1,no,N,8,,264863,944,AAC
9,,DOUB,C3,O3,no,N,9,,264863,944,AAC
10,,SING,C4,HC41,no,N,10,,264863,944,AAC
11,,SING,C4,HC42,no,N,11,,264863,944,AAC
12,,SING,C4,HC43,no,N,12,,264863,944,AAC
13,,SING,N1,HN1,no,N,13,,264863,944,AAC
14,,SING,O1,HO1,no,N,14,,264863,944,AAC
1,,SING,FE,NA,no,N,1,,264864,944,HEC
2,,SING,FE,NB,no,N,2,,264864,944,HEC
3,,SING,FE,NC,no,N,3,,264864,944,HEC
4,,SING,FE,ND,no,N,4,,264864,944,HEC
5,,DOUB,CHA,C1A,no,N,5,,264864,944,HEC
6,,SING,CHA,C4D,no,N,6,,264864,944,HEC
7,,SING,CHA,HHA,no,N,7,,264864,944,HEC
8,,DOUB,CHB,C4A,no,N,8,,264864,944,HEC
9,,SING,CHB,C1B,no,N,9,,264864,944,HEC
10,,SING,CHB,HHB,no,N,10,,264864,944,HEC
11,,DOUB,CHC,C4B,no,N,11,,264864,944,HEC
12,,SING,CHC,C1C,no,N,12,,264864,944,HEC
13,,SING,CHC,HHC,no,N,13,,264864,944,HEC
14,,DOUB,CHD,C4C,no,N,14,,264864,944,HEC
15,,SING,CHD,C1D,no,N,15,,264864,944,HEC
16,,SING,CHD,HHD,no,N,16,,264864,944,HEC
17,,SING,NA,C1A,yes,N,17,,264864,944,HEC
18,,SING,NA,C4A,yes,N,18,,264864,944,HEC
19,,SING,C1A,C2A,yes,N,19,,264864,944,HEC
20,,DOUB,C2A,C3A,yes,N,20,,264864,944,HEC
21,,SING,C2A,CAA,no,N,21,,264864,944,HEC
22,,SING,C3A,C4A,yes,N,22,,264864,944,HEC
23,,SING,C3A,CMA,no,N,23,,264864,944,HEC
24,,SING,CMA,HMA1,no,N,24,,264864,944,HEC
25,,SING,CMA,HMA2,no,N,25,,264864,944,HEC
26,,SING,CMA,HMA3,no,N,26,,264864,944,HEC
27,,SING,CAA,CBA,no,N,27,,264864,944,HEC
28,,SING,CAA,HAA1,no,N,28,,264864,944,HEC
29,,SING,CAA,HAA2,no,N,29,,264864,944,HEC
30,,SING,CBA,CGA,no,N,30,,264864,944,HEC
31,,SING,CBA,HBA1,no,N,31,,264864,944,HEC
32,,SING,CBA,HBA2,no,N,32,,264864,944,HEC
33,,DOUB,CGA,O1A,no,N,33,,264864,944,HEC
34,,SING,CGA,O2A,no,N,34,,264864,944,HEC
35,,SING,O2A,H2A,no,N,35,,264864,944,HEC
36,,SING,NB,C1B,yes,N,36,,264864,944,HEC
37,,SING,NB,C4B,yes,N,37,,264864,944,HEC
38,,DOUB,C1B,C2B,yes,N,38,,264864,944,HEC
39,,SING,C2B,C3B,yes,N,39,,264864,944,HEC
40,,SING,C2B,CMB,no,N,40,,264864,944,HEC
41,,SING,C3B,C4B,yes,N,41,,264864,944,HEC
42,,DOUB,C3B,CAB,no,E,42,,264864,944,HEC
43,,SING,CMB,HMB1,no,N,43,,264864,944,HEC
44,,SING,CMB,HMB2,no,N,44,,264864,944,HEC
45,,SING,CMB,HMB3,no,N,45,,264864,944,HEC
46,,SING,CAB,CBB,no,N,46,,264864,944,HEC
47,,SING,CAB,HAB,no,N,47,,264864,944,HEC
48,,SING,CBB,HBB1,no,N,48,,264864,944,HEC
49,,SING,CBB,HBB2,no,N,49,,264864,944,HEC
50,,SING,CBB,HBB3,no,N,50,,264864,944,HEC
51,,SING,NC,C1C,yes,N,51,,264864,944,HEC
52,,SING,NC,C4C,yes,N,52,,264864,944,HEC
53,,DOUB,C1C,C2C,yes,N,53,,264864,944,HEC
54,,SING,C2C,C3C,yes,N,54,,264864,944,HEC
55,,SING,C2C,CMC,no,N,55,,264864,944,HEC
56,,SING,C3C,C4C,yes,N,56,,264864,944,HEC
57,,DOUB,C3C,CAC,no,E,57,,264864,944,HEC
58,,SING,CMC,HMC1,no,N,58,,264864,944,HEC
59,,SING,CMC,HMC2,no,N,59,,264864,944,HEC
60,,SING,CMC,HMC3,no,N,60,,264864,944,HEC
61,,SING,CAC,CBC,no,N,61,,264864,944,HEC
62,,SING,CAC,HAC,no,N,62,,264864,944,HEC
63,,SING,CBC,HBC1,no,N,63,,264864,944,HEC
64,,SING,CBC,HBC2,no,N,64,,264864,944,HEC
65,,SING,CBC,HBC3,no,N,65,,264864,944,HEC
66,,SING,ND,C1D,yes,N,66,,264864,944,HEC
67,,SING,ND,C4D,yes,N,67,,264864,944,HEC
68,,DOUB,C1D,C2D,yes,N,68,,264864,944,HEC
69,,SING,C2D,C3D,yes,N,69,,264864,944,HEC
70,,SING,C2D,CMD,no,N,70,,264864,944,HEC
71,,DOUB,C3D,C4D,yes,N,71,,264864,944,HEC
72,,SING,C3D,CAD,no,N,72,,264864,944,HEC
73,,SING,CMD,HMD1,no,N,73,,264864,944,HEC
74,,SING,CMD,HMD2,no,N,74,,264864,944,HEC
75,,SING,CMD,HMD3,no,N,75,,264864,944,HEC
76,,SING,CAD,CBD,no,N,76,,264864,944,HEC
77,,SING,CAD,HAD1,no,N,77,,264864,944,HEC
78,,SING,CAD,HAD2,no,N,78,,264864,944,HEC
79,,SING,CBD,CGD,no,N,79,,264864,944,HEC
80,,SING,CBD,HBD1,no,N,80,,264864,944,HEC
81,,SING,CBD,HBD2,no,N,81,,264864,944,HEC
82,,DOUB,CGD,O1D,no,N,82,,264864,944,HEC
83,,SING,CGD,O2D,no,N,83,,264864,944,HEC
84,,SING,O2D,H2D,no,N,84,,264864,944,HEC
1,,SING,C1,C2,no,N,1,,264892,946,AAC
2,,SING,C1,O1,no,N,2,,264892,946,AAC
3,,DOUB,C1,O2,no,N,3,,264892,946,AAC
4,,SING,C2,N1,no,N,4,,264892,946,AAC
5,,SING,C2,HC21,no,N,5,,264892,946,AAC
6,,SING,C2,HC22,no,N,6,,264892,946,AAC
7,,SING,C3,C4,no,N,7,,264892,946,AAC
8,,SING,C3,N1,no,N,8,,264892,946,AAC
9,,DOUB,C3,O3,no,N,9,,264892,946,AAC
10,,SING,C4,HC41,no,N,10,,264892,946,AAC
11,,SING,C4,HC42,no,N,11,,264892,946,AAC
12,,SING,C4,HC43,no,N,12,,264892,946,AAC
13,,SING,N1,HN1,no,N,13,,264892,946,AAC
14,,SING,O1,HO1,no,N,14,,264892,946,AAC
1,,SING,FE,NA,no,N,1,,264893,946,HEC
2,,SING,FE,NB,no,N,2,,264893,946,HEC
3,,SING,FE,NC,no,N,3,,264893,946,HEC
4,,SING,FE,ND,no,N,4,,264893,946,HEC
5,,DOUB,CHA,C1A,no,N,5,,264893,946,HEC
6,,SING,CHA,C4D,no,N,6,,264893,946,HEC
7,,SING,CHA,HHA,no,N,7,,264893,946,HEC
8,,DOUB,CHB,C4A,no,N,8,,264893,946,HEC
9,,SING,CHB,C1B,no,N,9,,264893,946,HEC
10,,SING,CHB,HHB,no,N,10,,264893,946,HEC
11,,DOUB,CHC,C4B,no,N,11,,264893,946,HEC
12,,SING,CHC,C1C,no,N,12,,264893,946,HEC
13,,SING,CHC,HHC,no,N,13,,264893,946,HEC
14,,DOUB,CHD,C4C,no,N,14,,264893,946,HEC
15,,SING,CHD,C1D,no,N,15,,264893,946,HEC
16,,SING,CHD,HHD,no,N,16,,264893,946,HEC
17,,SING,NA,C1A,yes,N,17,,264893,946,HEC
18,,SING,NA,C4A,yes,N,18,,264893,946,HEC
19,,SING,C1A,C2A,yes,N,19,,264893,946,HEC
20,,DOUB,C2A,C3A,yes,N,20,,264893,946,HEC
21,,SING,C2A,CAA,no,N,21,,264893,946,HEC
22,,SING,C3A,C4A,yes,N,22,,264893,946,HEC
23,,SING,C3A,CMA,no,N,23,,264893,946,HEC
24,,SING,CMA,HMA1,no,N,24,,264893,946,HEC
25,,SING,CMA,HMA2,no,N,25,,264893,946,HEC
26,,SING,CMA,HMA3,no,N,26,,264893,946,HEC
27,,SING,CAA,CBA,no,N,27,,264893,946,HEC
28,,SING,CAA,HAA1,no,N,28,,264893,946,HEC
29,,SING,CAA,HAA2,no,N,29,,264893,946,HEC
30,,SING,CBA,CGA,no,N,30,,264893,946,HEC
31,,SING,CBA,HBA1,no,N,31,,264893,946,HEC
32,,SING,CBA,HBA2,no,N,32,,264893,946,HEC
33,,DOUB,CGA,O1A,no,N,33,,264893,946,HEC
34,,SING,CGA,O2A,no,N,34,,264893,946,HEC
35,,SING,O2A,H2A,no,N,35,,264893,946,HEC
36,,SING,NB,C1B,yes,N,36,,264893,946,HEC
37,,SING,NB,C4B,yes,N,37,,264893,946,HEC
38,,DOUB,C1B,C2B,yes,N,38,,264893,946,HEC
39,,SING,C2B,C3B,yes,N,39,,264893,946,HEC
40,,SING,C2B,CMB,no,N,40,,264893,946,HEC
41,,SING,C3B,C4B,yes,N,41,,264893,946,HEC
42,,DOUB,C3B,CAB,no,E,42,,264893,946,HEC
43,,SING,CMB,HMB1,no,N,43,,264893,946,HEC
44,,SING,CMB,HMB2,no,N,44,,264893,946,HEC
45,,SING,CMB,HMB3,no,N,45,,264893,946,HEC
46,,SING,CAB,CBB,no,N,46,,264893,946,HEC
47,,SING,CAB,HAB,no,N,47,,264893,946,HEC
48,,SING,CBB,HBB1,no,N,48,,264893,946,HEC
49,,SING,CBB,HBB2,no,N,49,,264893,946,HEC
50,,SING,CBB,HBB3,no,N,50,,264893,946,HEC
51,,SING,NC,C1C,yes,N,51,,264893,946,HEC
52,,SING,NC,C4C,yes,N,52,,264893,946,HEC
53,,DOUB,C1C,C2C,yes,N,53,,264893,946,HEC
54,,SING,C2C,C3C,yes,N,54,,264893,946,HEC
55,,SING,C2C,CMC,no,N,55,,264893,946,HEC
56,,SING,C3C,C4C,yes,N,56,,264893,946,HEC
57,,DOUB,C3C,CAC,no,E,57,,264893,946,HEC
58,,SING,CMC,HMC1,no,N,58,,264893,946,HEC
59,,SING,CMC,HMC2,no,N,59,,264893,946,HEC
60,,SING,CMC,HMC3,no,N,60,,264893,946,HEC
61,,SING,CAC,CBC,no,N,61,,264893,946,HEC
62,,SING,CAC,HAC,no,N,62,,264893,946,HEC
63,,SING,CBC,HBC1,no,N,63,,264893,946,HEC
64,,SING,CBC,HBC2,no,N,64,,264893,946,HEC
65,,SING,CBC,HBC3,no,N,65,,264893,946,HEC
66,,SING,ND,C1D,yes,N,66,,264893,946,HEC
67,,SING,ND,C4D,yes,N,67,,264893,946,HEC
68,,DOUB,C1D,C2D,yes,N,68,,264893,946,HEC
69,,SING,C2D,C3D,yes,N,69,,264893,946,HEC
70,,SING,C2D,CMD,no,N,70,,264893,946,HEC
71,,DOUB,C3D,C4D,yes,N,71,,264893,946,HEC
72,,SING,C3D,CAD,no,N,72,,264893,946,HEC
73,,SING,CMD,HMD1,no,N,73,,264893,946,HEC
74,,SING,CMD,HMD2,no,N,74,,264893,946,HEC
75,,SING,CMD,HMD3,no,N,75,,264893,946,HEC
76,,SING,CAD,CBD,no,N,76,,264893,946,HEC
77,,SING,CAD,HAD1,no,N,77,,264893,946,HEC
78,,SING,CAD,HAD2,no,N,78,,264893,946,HEC
79,,SING,CBD,CGD,no,N,79,,264893,946,HEC
80,,SING,CBD,HBD1,no,N,80,,264893,946,HEC
81,,SING,CBD,HBD2,no,N,81,,264893,946,HEC
82,,DOUB,CGD,O1D,no,N,82,,264893,946,HEC
83,,SING,CGD,O2D,no,N,83,,264893,946,HEC
84,,SING,O2D,H2D,no,N,84,,264893,946,HEC
1,,SING,C1,C2,no,N,1,,264908,947,AAC
2,,SING,C1,O1,no,N,2,,264908,947,AAC
3,,DOUB,C1,O2,no,N,3,,264908,947,AAC
4,,SING,C2,N1,no,N,4,,264908,947,AAC
5,,SING,C2,HC21,no,N,5,,264908,947,AAC
6,,SING,C2,HC22,no,N,6,,264908,947,AAC
7,,SING,C3,C4,no,N,7,,264908,947,AAC
8,,SING,C3,N1,no,N,8,,264908,947,AAC
9,,DOUB,C3,O3,no,N,9,,264908,947,AAC
10,,SING,C4,HC41,no,N,10,,264908,947,AAC
11,,SING,C4,HC42,no,N,11,,264908,947,AAC
12,,SING,C4,HC43,no,N,12,,264908,947,AAC
13,,SING,N1,HN1,no,N,13,,264908,947,AAC
14,,SING,O1,HO1,no,N,14,,264908,947,AAC
1,,SING,FE,NA,no,N,1,,264909,947,HEC
2,,SING,FE,NB,no,N,2,,264909,947,HEC
3,,SING,FE,NC,no,N,3,,264909,947,HEC
4,,SING,FE,ND,no,N,4,,264909,947,HEC
5,,DOUB,CHA,C1A,no,N,5,,264909,947,HEC
6,,SING,CHA,C4D,no,N,6,,264909,947,HEC
7,,SING,CHA,HHA,no,N,7,,264909,947,HEC
8,,DOUB,CHB,C4A,no,N,8,,264909,947,HEC
9,,SING,CHB,C1B,no,N,9,,264909,947,HEC
10,,SING,CHB,HHB,no,N,10,,264909,947,HEC
11,,DOUB,CHC,C4B,no,N,11,,264909,947,HEC
12,,SING,CHC,C1C,no,N,12,,264909,947,HEC
13,,SING,CHC,HHC,no,N,13,,264909,947,HEC
14,,DOUB,CHD,C4C,no,N,14,,264909,947,HEC
15,,SING,CHD,C1D,no,N,15,,264909,947,HEC
16,,SING,CHD,HHD,no,N,16,,264909,947,HEC
17,,SING,NA,C1A,yes,N,17,,264909,947,HEC
18,,SING,NA,C4A,yes,N,18,,264909,947,HEC
19,,SING,C1A,C2A,yes,N,19,,264909,947,HEC
20,,DOUB,C2A,C3A,yes,N,20,,264909,947,HEC
21,,SING,C2A,CAA,no,N,21,,264909,947,HEC
22,,SING,C3A,C4A,yes,N,22,,264909,947,HEC
23,,SING,C3A,CMA,no,N,23,,264909,947,HEC
24,,SING,CMA,HMA1,no,N,24,,264909,947,HEC
25,,SING,CMA,HMA2,no,N,25,,264909,947,HEC
26,,SING,CMA,HMA3,no,N,26,,264909,947,HEC
27,,SING,CAA,CBA,no,N,27,,264909,947,HEC
28,,SING,CAA,HAA1,no,N,28,,264909,947,HEC
29,,SING,CAA,HAA2,no,N,29,,264909,947,HEC
30,,SING,CBA,CGA,no,N,30,,264909,947,HEC
31,,SING,CBA,HBA1,no,N,31,,264909,947,HEC
32,,SING,CBA,HBA2,no,N,32,,264909,947,HEC
33,,DOUB,CGA,O1A,no,N,33,,264909,947,HEC
34,,SING,CGA,O2A,no,N,34,,264909,947,HEC
35,,SING,O2A,H2A,no,N,35,,264909,947,HEC
36,,SING,NB,C1B,yes,N,36,,264909,947,HEC
37,,SING,NB,C4B,yes,N,37,,264909,947,HEC
38,,DOUB,C1B,C2B,yes,N,38,,264909,947,HEC
39,,SING,C2B,C3B,yes,N,39,,264909,947,HEC
40,,SING,C2B,CMB,no,N,40,,264909,947,HEC
41,,SING,C3B,C4B,yes,N,41,,264909,947,HEC
42,,DOUB,C3B,CAB,no,E,42,,264909,947,HEC
43,,SING,CMB,HMB1,no,N,43,,264909,947,HEC
44,,SING,CMB,HMB2,no,N,44,,264909,947,HEC
45,,SING,CMB,HMB3,no,N,45,,264909,947,HEC
46,,SING,CAB,CBB,no,N,46,,264909,947,HEC
47,,SING,CAB,HAB,no,N,47,,264909,947,HEC
48,,SING,CBB,HBB1,no,N,48,,264909,947,HEC
49,,SING,CBB,HBB2,no,N,49,,264909,947,HEC
50,,SING,CBB,HBB3,no,N,50,,264909,947,HEC
51,,SING,NC,C1C,yes,N,51,,264909,947,HEC
52,,SING,NC,C4C,yes,N,52,,264909,947,HEC
53,,DOUB,C1C,C2C,yes,N,53,,264909,947,HEC
54,,SING,C2C,C3C,yes,N,54,,264909,947,HEC
55,,SING,C2C,CMC,no,N,55,,264909,947,HEC
56,,SING,C3C,C4C,yes,N,56,,264909,947,HEC
57,,DOUB,C3C,CAC,no,E,57,,264909,947,HEC
58,,SING,CMC,HMC1,no,N,58,,264909,947,HEC
59,,SING,CMC,HMC2,no,N,59,,264909,947,HEC
60,,SING,CMC,HMC3,no,N,60,,264909,947,HEC
61,,SING,CAC,CBC,no,N,61,,264909,947,HEC
62,,SING,CAC,HAC,no,N,62,,264909,947,HEC
63,,SING,CBC,HBC1,no,N,63,,264909,947,HEC
64,,SING,CBC,HBC2,no,N,64,,264909,947,HEC
65,,SING,CBC,HBC3,no,N,65,,264909,947,HEC
66,,SING,ND,C1D,yes,N,66,,264909,947,HEC
67,,SING,ND,C4D,yes,N,67,,264909,947,HEC
68,,DOUB,C1D,C2D,yes,N,68,,264909,947,HEC
69,,SING,C2D,C3D,yes,N,69,,264909,947,HEC
70,,SING,C2D,CMD,no,N,70,,264909,947,HEC
71,,DOUB,C3D,C4D,yes,N,71,,264909,947,HEC
72,,SING,C3D,CAD,no,N,72,,264909,947,HEC
73,,SING,CMD,HMD1,no,N,73,,264909,947,HEC
74,,SING,CMD,HMD2,no,N,74,,264909,947,HEC
75,,SING,CMD,HMD3,no,N,75,,264909,947,HEC
76,,SING,CAD,CBD,no,N,76,,264909,947,HEC
77,,SING,CAD,HAD1,no,N,77,,264909,947,HEC
78,,SING,CAD,HAD2,no,N,78,,264909,947,HEC
79,,SING,CBD,CGD,no,N,79,,264909,947,HEC
80,,SING,CBD,HBD1,no,N,80,,264909,947,HEC
81,,SING,CBD,HBD2,no,N,81,,264909,947,HEC
82,,DOUB,CGD,O1D,no,N,82,,264909,947,HEC
83,,SING,CGD,O2D,no,N,83,,264909,947,HEC
84,,SING,O2D,H2D,no,N,84,,264909,947,HEC
1,,SING,C1,C2,no,N,1,,264924,948,AAC
2,,SING,C1,O1,no,N,2,,264924,948,AAC
3,,DOUB,C1,O2,no,N,3,,264924,948,AAC
4,,SING,C2,N1,no,N,4,,264924,948,AAC
5,,SING,C2,HC21,no,N,5,,264924,948,AAC
6,,SING,C2,HC22,no,N,6,,264924,948,AAC
7,,SING,C3,C4,no,N,7,,264924,948,AAC
8,,SING,C3,N1,no,N,8,,264924,948,AAC
9,,DOUB,C3,O3,no,N,9,,264924,948,AAC
10,,SING,C4,HC41,no,N,10,,264924,948,AAC
11,,SING,C4,HC42,no,N,11,,264924,948,AAC
12,,SING,C4,HC43,no,N,12,,264924,948,AAC
13,,SING,N1,HN1,no,N,13,,264924,948,AAC
14,,SING,O1,HO1,no,N,14,,264924,948,AAC
1,,SING,FE,NA,no,N,1,,264925,948,HEC
2,,SING,FE,NB,no,N,2,,264925,948,HEC
3,,SING,FE,NC,no,N,3,,264925,948,HEC
4,,SING,FE,ND,no,N,4,,264925,948,HEC
5,,DOUB,CHA,C1A,no,N,5,,264925,948,HEC
6,,SING,CHA,C4D,no,N,6,,264925,948,HEC
7,,SING,CHA,HHA,no,N,7,,264925,948,HEC
8,,DOUB,CHB,C4A,no,N,8,,264925,948,HEC
9,,SING,CHB,C1B,no,N,9,,264925,948,HEC
10,,SING,CHB,HHB,no,N,10,,264925,948,HEC
11,,DOUB,CHC,C4B,no,N,11,,264925,948,HEC
12,,SING,CHC,C1C,no,N,12,,264925,948,HEC
13,,SING,CHC,HHC,no,N,13,,264925,948,HEC
14,,DOUB,CHD,C4C,no,N,14,,264925,948,HEC
15,,SING,CHD,C1D,no,N,15,,264925,948,HEC
16,,SING,CHD,HHD,no,N,16,,264925,948,HEC
17,,SING,NA,C1A,yes,N,17,,264925,948,HEC
18,,SING,NA,C4A,yes,N,18,,264925,948,HEC
19,,SING,C1A,C2A,yes,N,19,,264925,948,HEC
20,,DOUB,C2A,C3A,yes,N,20,,264925,948,HEC
21,,SING,C2A,CAA,no,N,21,,264925,948,HEC
22,,SING,C3A,C4A,yes,N,22,,264925,948,HEC
23,,SING,C3A,CMA,no,N,23,,264925,948,HEC
24,,SING,CMA,HMA1,no,N,24,,264925,948,HEC
25,,SING,CMA,HMA2,no,N,25,,264925,948,HEC
26,,SING,CMA,HMA3,no,N,26,,264925,948,HEC
27,,SING,CAA,CBA,no,N,27,,264925,948,HEC
28,,SING,CAA,HAA1,no,N,28,,264925,948,HEC
29,,SING,CAA,HAA2,no,N,29,,264925,948,HEC
30,,SING,CBA,CGA,no,N,30,,264925,948,HEC
31,,SING,CBA,HBA1,no,N,31,,264925,948,HEC
32,,SING,CBA,HBA2,no,N,32,,264925,948,HEC
33,,DOUB,CGA,O1A,no,N,33,,264925,948,HEC
34,,SING,CGA,O2A,no,N,34,,264925,948,HEC
35,,SING,O2A,H2A,no,N,35,,264925,948,HEC
36,,SING,NB,C1B,yes,N,36,,264925,948,HEC
37,,SING,NB,C4B,yes,N,37,,264925,948,HEC
38,,DOUB,C1B,C2B,yes,N,38,,264925,948,HEC
39,,SING,C2B,C3B,yes,N,39,,264925,948,HEC
40,,SING,C2B,CMB,no,N,40,,264925,948,HEC
41,,SING,C3B,C4B,yes,N,41,,264925,948,HEC
42,,DOUB,C3B,CAB,no,E,42,,264925,948,HEC
43,,SING,CMB,HMB1,no,N,43,,264925,948,HEC
44,,SING,CMB,HMB2,no,N,44,,264925,948,HEC
45,,SING,CMB,HMB3,no,N,45,,264925,948,HEC
46,,SING,CAB,CBB,no,N,46,,264925,948,HEC
47,,SING,CAB,HAB,no,N,47,,264925,948,HEC
48,,SING,CBB,HBB1,no,N,48,,264925,948,HEC
49,,SING,CBB,HBB2,no,N,49,,264925,948,HEC
50,,SING,CBB,HBB3,no,N,50,,264925,948,HEC
51,,SING,NC,C1C,yes,N,51,,264925,948,HEC
52,,SING,NC,C4C,yes,N,52,,264925,948,HEC
53,,DOUB,C1C,C2C,yes,N,53,,264925,948,HEC
54,,SING,C2C,C3C,yes,N,54,,264925,948,HEC
55,,SING,C2C,CMC,no,N,55,,264925,948,HEC
56,,SING,C3C,C4C,yes,N,56,,264925,948,HEC
57,,DOUB,C3C,CAC,no,E,57,,264925,948,HEC
58,,SING,CMC,HMC1,no,N,58,,264925,948,HEC
59,,SING,CMC,HMC2,no,N,59,,264925,948,HEC
60,,SING,CMC,HMC3,no,N,60,,264925,948,HEC
61,,SING,CAC,CBC,no,N,61,,264925,948,HEC
62,,SING,CAC,HAC,no,N,62,,264925,948,HEC
63,,SING,CBC,HBC1,no,N,63,,264925,948,HEC
64,,SING,CBC,HBC2,no,N,64,,264925,948,HEC
65,,SING,CBC,HBC3,no,N,65,,264925,948,HEC
66,,SING,ND,C1D,yes,N,66,,264925,948,HEC
67,,SING,ND,C4D,yes,N,67,,264925,948,HEC
68,,DOUB,C1D,C2D,yes,N,68,,264925,948,HEC
69,,SING,C2D,C3D,yes,N,69,,264925,948,HEC
70,,SING,C2D,CMD,no,N,70,,264925,948,HEC
71,,DOUB,C3D,C4D,yes,N,71,,264925,948,HEC
72,,SING,C3D,CAD,no,N,72,,264925,948,HEC
73,,SING,CMD,HMD1,no,N,73,,264925,948,HEC
74,,SING,CMD,HMD2,no,N,74,,264925,948,HEC
75,,SING,CMD,HMD3,no,N,75,,264925,948,HEC
76,,SING,CAD,CBD,no,N,76,,264925,948,HEC
77,,SING,CAD,HAD1,no,N,77,,264925,948,HEC
78,,SING,CAD,HAD2,no,N,78,,264925,948,HEC
79,,SING,CBD,CGD,no,N,79,,264925,948,HEC
80,,SING,CBD,HBD1,no,N,80,,264925,948,HEC
81,,SING,CBD,HBD2,no,N,81,,264925,948,HEC
82,,DOUB,CGD,O1D,no,N,82,,264925,948,HEC
83,,SING,CGD,O2D,no,N,83,,264925,948,HEC
84,,SING,O2D,H2D,no,N,84,,264925,948,HEC
1,,SING,C1,C2,no,N,1,,264940,949,AAC
2,,SING,C1,O1,no,N,2,,264940,949,AAC
3,,DOUB,C1,O2,no,N,3,,264940,949,AAC
4,,SING,C2,N1,no,N,4,,264940,949,AAC
5,,SING,C2,HC21,no,N,5,,264940,949,AAC
6,,SING,C2,HC22,no,N,6,,264940,949,AAC
7,,SING,C3,C4,no,N,7,,264940,949,AAC
8,,SING,C3,N1,no,N,8,,264940,949,AAC
9,,DOUB,C3,O3,no,N,9,,264940,949,AAC
10,,SING,C4,HC41,no,N,10,,264940,949,AAC
11,,SING,C4,HC42,no,N,11,,264940,949,AAC
12,,SING,C4,HC43,no,N,12,,264940,949,AAC
13,,SING,N1,HN1,no,N,13,,264940,949,AAC
14,,SING,O1,HO1,no,N,14,,264940,949,AAC
1,,SING,FE,NA,no,N,1,,264941,949,HEC
2,,SING,FE,NB,no,N,2,,264941,949,HEC
3,,SING,FE,NC,no,N,3,,264941,949,HEC
4,,SING,FE,ND,no,N,4,,264941,949,HEC
5,,DOUB,CHA,C1A,no,N,5,,264941,949,HEC
6,,SING,CHA,C4D,no,N,6,,264941,949,HEC
7,,SING,CHA,HHA,no,N,7,,264941,949,HEC
8,,DOUB,CHB,C4A,no,N,8,,264941,949,HEC
9,,SING,CHB,C1B,no,N,9,,264941,949,HEC
10,,SING,CHB,HHB,no,N,10,,264941,949,HEC
11,,DOUB,CHC,C4B,no,N,11,,264941,949,HEC
12,,SING,CHC,C1C,no,N,12,,264941,949,HEC
13,,SING,CHC,HHC,no,N,13,,264941,949,HEC
14,,DOUB,CHD,C4C,no,N,14,,264941,949,HEC
15,,SING,CHD,C1D,no,N,15,,264941,949,HEC
16,,SING,CHD,HHD,no,N,16,,264941,949,HEC
17,,SING,NA,C1A,yes,N,17,,264941,949,HEC
18,,SING,NA,C4A,yes,N,18,,264941,949,HEC
19,,SING,C1A,C2A,yes,N,19,,264941,949,HEC
20,,DOUB,C2A,C3A,yes,N,20,,264941,949,HEC
21,,SING,C2A,CAA,no,N,21,,264941,949,HEC
22,,SING,C3A,C4A,yes,N,22,,264941,949,HEC
23,,SING,C3A,CMA,no,N,23,,264941,949,HEC
24,,SING,CMA,HMA1,no,N,24,,264941,949,HEC
25,,SING,CMA,HMA2,no,N,25,,264941,949,HEC
26,,SING,CMA,HMA3,no,N,26,,264941,949,HEC
27,,SING,CAA,CBA,no,N,27,,264941,949,HEC
28,,SING,CAA,HAA1,no,N,28,,264941,949,HEC
29,,SING,CAA,HAA2,no,N,29,,264941,949,HEC
30,,SING,CBA,CGA,no,N,30,,264941,949,HEC
31,,SING,CBA,HBA1,no,N,31,,264941,949,HEC
32,,SING,CBA,HBA2,no,N,32,,264941,949,HEC
33,,DOUB,CGA,O1A,no,N,33,,264941,949,HEC
34,,SING,CGA,O2A,no,N,34,,264941,949,HEC
35,,SING,O2A,H2A,no,N,35,,264941,949,HEC
36,,SING,NB,C1B,yes,N,36,,264941,949,HEC
37,,SING,NB,C4B,yes,N,37,,264941,949,HEC
38,,DOUB,C1B,C2B,yes,N,38,,264941,949,HEC
39,,SING,C2B,C3B,yes,N,39,,264941,949,HEC
40,,SING,C2B,CMB,no,N,40,,264941,949,HEC
41,,SING,C3B,C4B,yes,N,41,,264941,949,HEC
42,,DOUB,C3B,CAB,no,E,42,,264941,949,HEC
43,,SING,CMB,HMB1,no,N,43,,264941,949,HEC
44,,SING,CMB,HMB2,no,N,44,,264941,949,HEC
45,,SING,CMB,HMB3,no,N,45,,264941,949,HEC
46,,SING,CAB,CBB,no,N,46,,264941,949,HEC
47,,SING,CAB,HAB,no,N,47,,264941,949,HEC
48,,SING,CBB,HBB1,no,N,48,,264941,949,HEC
49,,SING,CBB,HBB2,no,N,49,,264941,949,HEC
50,,SING,CBB,HBB3,no,N,50,,264941,949,HEC
51,,SING,NC,C1C,yes,N,51,,264941,949,HEC
52,,SING,NC,C4C,yes,N,52,,264941,949,HEC
53,,DOUB,C1C,C2C,yes,N,53,,264941,949,HEC
54,,SING,C2C,C3C,yes,N,54,,264941,949,HEC
55,,SING,C2C,CMC,no,N,55,,264941,949,HEC
56,,SING,C3C,C4C,yes,N,56,,264941,949,HEC
57,,DOUB,C3C,CAC,no,E,57,,264941,949,HEC
58,,SING,CMC,HMC1,no,N,58,,264941,949,HEC
59,,SING,CMC,HMC2,no,N,59,,264941,949,HEC
60,,SING,CMC,HMC3,no,N,60,,264941,949,HEC
61,,SING,CAC,CBC,no,N,61,,264941,949,HEC
62,,SING,CAC,HAC,no,N,62,,264941,949,HEC
63,,SING,CBC,HBC1,no,N,63,,264941,949,HEC
64,,SING,CBC,HBC2,no,N,64,,264941,949,HEC
65,,SING,CBC,HBC3,no,N,65,,264941,949,HEC
66,,SING,ND,C1D,yes,N,66,,264941,949,HEC
67,,SING,ND,C4D,yes,N,67,,264941,949,HEC
68,,DOUB,C1D,C2D,yes,N,68,,264941,949,HEC
69,,SING,C2D,C3D,yes,N,69,,264941,949,HEC
70,,SING,C2D,CMD,no,N,70,,264941,949,HEC
71,,DOUB,C3D,C4D,yes,N,71,,264941,949,HEC
72,,SING,C3D,CAD,no,N,72,,264941,949,HEC
73,,SING,CMD,HMD1,no,N,73,,264941,949,HEC
74,,SING,CMD,HMD2,no,N,74,,264941,949,HEC
75,,SING,CMD,HMD3,no,N,75,,264941,949,HEC
76,,SING,CAD,CBD,no,N,76,,264941,949,HEC
77,,SING,CAD,HAD1,no,N,77,,264941,949,HEC
78,,SING,CAD,HAD2,no,N,78,,264941,949,HEC
79,,SING,CBD,CGD,no,N,79,,264941,949,HEC
80,,SING,CBD,HBD1,no,N,80,,264941,949,HEC
81,,SING,CBD,HBD2,no,N,81,,264941,949,HEC
82,,DOUB,CGD,O1D,no,N,82,,264941,949,HEC
83,,SING,CGD,O2D,no,N,83,,264941,949,HEC
84,,SING,O2D,H2D,no,N,84,,264941,949,HEC
1,,SING,FE,NA,no,N,1,,265132,968,HEC
2,,SING,FE,NB,no,N,2,,265132,968,HEC
3,,SING,FE,NC,no,N,3,,265132,968,HEC
4,,SING,FE,ND,no,N,4,,265132,968,HEC
5,,DOUB,CHA,C1A,no,N,5,,265132,968,HEC
6,,SING,CHA,C4D,no,N,6,,265132,968,HEC
7,,SING,CHA,HHA,no,N,7,,265132,968,HEC
8,,DOUB,CHB,C4A,no,N,8,,265132,968,HEC
9,,SING,CHB,C1B,no,N,9,,265132,968,HEC
10,,SING,CHB,HHB,no,N,10,,265132,968,HEC
11,,DOUB,CHC,C4B,no,N,11,,265132,968,HEC
12,,SING,CHC,C1C,no,N,12,,265132,968,HEC
13,,SING,CHC,HHC,no,N,13,,265132,968,HEC
14,,DOUB,CHD,C4C,no,N,14,,265132,968,HEC
15,,SING,CHD,C1D,no,N,15,,265132,968,HEC
16,,SING,CHD,HHD,no,N,16,,265132,968,HEC
17,,SING,NA,C1A,yes,N,17,,265132,968,HEC
18,,SING,NA,C4A,yes,N,18,,265132,968,HEC
19,,SING,C1A,C2A,yes,N,19,,265132,968,HEC
20,,DOUB,C2A,C3A,yes,N,20,,265132,968,HEC
21,,SING,C2A,CAA,no,N,21,,265132,968,HEC
22,,SING,C3A,C4A,yes,N,22,,265132,968,HEC
23,,SING,C3A,CMA,no,N,23,,265132,968,HEC
24,,SING,CMA,HMA1,no,N,24,,265132,968,HEC
25,,SING,CMA,HMA2,no,N,25,,265132,968,HEC
26,,SING,CMA,HMA3,no,N,26,,265132,968,HEC
27,,SING,CAA,CBA,no,N,27,,265132,968,HEC
28,,SING,CAA,HAA1,no,N,28,,265132,968,HEC
29,,SING,CAA,HAA2,no,N,29,,265132,968,HEC
30,,SING,CBA,CGA,no,N,30,,265132,968,HEC
31,,SING,CBA,HBA1,no,N,31,,265132,968,HEC
32,,SING,CBA,HBA2,no,N,32,,265132,968,HEC
33,,DOUB,CGA,O1A,no,N,33,,265132,968,HEC
34,,SING,CGA,O2A,no,N,34,,265132,968,HEC
35,,SING,O2A,H2A,no,N,35,,265132,968,HEC
36,,SING,NB,C1B,yes,N,36,,265132,968,HEC
37,,SING,NB,C4B,yes,N,37,,265132,968,HEC
38,,DOUB,C1B,C2B,yes,N,38,,265132,968,HEC
39,,SING,C2B,C3B,yes,N,39,,265132,968,HEC
40,,SING,C2B,CMB,no,N,40,,265132,968,HEC
41,,SING,C3B,C4B,yes,N,41,,265132,968,HEC
42,,DOUB,C3B,CAB,no,E,42,,265132,968,HEC
43,,SING,CMB,HMB1,no,N,43,,265132,968,HEC
44,,SING,CMB,HMB2,no,N,44,,265132,968,HEC
45,,SING,CMB,HMB3,no,N,45,,265132,968,HEC
46,,SING,CAB,CBB,no,N,46,,265132,968,HEC
47,,SING,CAB,HAB,no,N,47,,265132,968,HEC
48,,SING,CBB,HBB1,no,N,48,,265132,968,HEC
49,,SING,CBB,HBB2,no,N,49,,265132,968,HEC
50,,SING,CBB,HBB3,no,N,50,,265132,968,HEC
51,,SING,NC,C1C,yes,N,51,,265132,968,HEC
52,,SING,NC,C4C,yes,N,52,,265132,968,HEC
53,,DOUB,C1C,C2C,yes,N,53,,265132,968,HEC
54,,SING,C2C,C3C,yes,N,54,,265132,968,HEC
55,,SING,C2C,CMC,no,N,55,,265132,968,HEC
56,,SING,C3C,C4C,yes,N,56,,265132,968,HEC
57,,DOUB,C3C,CAC,no,E,57,,265132,968,HEC
58,,SING,CMC,HMC1,no,N,58,,265132,968,HEC
59,,SING,CMC,HMC2,no,N,59,,265132,968,HEC
60,,SING,CMC,HMC3,no,N,60,,265132,968,HEC
61,,SING,CAC,CBC,no,N,61,,265132,968,HEC
62,,SING,CAC,HAC,no,N,62,,265132,968,HEC
63,,SING,CBC,HBC1,no,N,63,,265132,968,HEC
64,,SING,CBC,HBC2,no,N,64,,265132,968,HEC
65,,SING,CBC,HBC3,no,N,65,,265132,968,HEC
66,,SING,ND,C1D,yes,N,66,,265132,968,HEC
67,,SING,ND,C4D,yes,N,67,,265132,968,HEC
68,,DOUB,C1D,C2D,yes,N,68,,265132,968,HEC
69,,SING,C2D,C3D,yes,N,69,,265132,968,HEC
70,,SING,C2D,CMD,no,N,70,,265132,968,HEC
71,,DOUB,C3D,C4D,yes,N,71,,265132,968,HEC
72,,SING,C3D,CAD,no,N,72,,265132,968,HEC
73,,SING,CMD,HMD1,no,N,73,,265132,968,HEC
74,,SING,CMD,HMD2,no,N,74,,265132,968,HEC
75,,SING,CMD,HMD3,no,N,75,,265132,968,HEC
76,,SING,CAD,CBD,no,N,76,,265132,968,HEC
77,,SING,CAD,HAD1,no,N,77,,265132,968,HEC
78,,SING,CAD,HAD2,no,N,78,,265132,968,HEC
79,,SING,CBD,CGD,no,N,79,,265132,968,HEC
80,,SING,CBD,HBD1,no,N,80,,265132,968,HEC
81,,SING,CBD,HBD2,no,N,81,,265132,968,HEC
82,,DOUB,CGD,O1D,no,N,82,,265132,968,HEC
83,,SING,CGD,O2D,no,N,83,,265132,968,HEC
84,,SING,O2D,H2D,no,N,84,,265132,968,HEC
1,,SING,FE,NA,no,N,1,,265147,969,HEC
2,,SING,FE,NB,no,N,2,,265147,969,HEC
3,,SING,FE,NC,no,N,3,,265147,969,HEC
4,,SING,FE,ND,no,N,4,,265147,969,HEC
5,,DOUB,CHA,C1A,no,N,5,,265147,969,HEC
6,,SING,CHA,C4D,no,N,6,,265147,969,HEC
7,,SING,CHA,HHA,no,N,7,,265147,969,HEC
8,,DOUB,CHB,C4A,no,N,8,,265147,969,HEC
9,,SING,CHB,C1B,no,N,9,,265147,969,HEC
10,,SING,CHB,HHB,no,N,10,,265147,969,HEC
11,,DOUB,CHC,C4B,no,N,11,,265147,969,HEC
12,,SING,CHC,C1C,no,N,12,,265147,969,HEC
13,,SING,CHC,HHC,no,N,13,,265147,969,HEC
14,,DOUB,CHD,C4C,no,N,14,,265147,969,HEC
15,,SING,CHD,C1D,no,N,15,,265147,969,HEC
16,,SING,CHD,HHD,no,N,16,,265147,969,HEC
17,,SING,NA,C1A,yes,N,17,,265147,969,HEC
18,,SING,NA,C4A,yes,N,18,,265147,969,HEC
19,,SING,C1A,C2A,yes,N,19,,265147,969,HEC
20,,DOUB,C2A,C3A,yes,N,20,,265147,969,HEC
21,,SING,C2A,CAA,no,N,21,,265147,969,HEC
22,,SING,C3A,C4A,yes,N,22,,265147,969,HEC
23,,SING,C3A,CMA,no,N,23,,265147,969,HEC
24,,SING,CMA,HMA1,no,N,24,,265147,969,HEC
25,,SING,CMA,HMA2,no,N,25,,265147,969,HEC
26,,SING,CMA,HMA3,no,N,26,,265147,969,HEC
27,,SING,CAA,CBA,no,N,27,,265147,969,HEC
28,,SING,CAA,HAA1,no,N,28,,265147,969,HEC
29,,SING,CAA,HAA2,no,N,29,,265147,969,HEC
30,,SING,CBA,CGA,no,N,30,,265147,969,HEC
31,,SING,CBA,HBA1,no,N,31,,265147,969,HEC
32,,SING,CBA,HBA2,no,N,32,,265147,969,HEC
33,,DOUB,CGA,O1A,no,N,33,,265147,969,HEC
34,,SING,CGA,O2A,no,N,34,,265147,969,HEC
35,,SING,O2A,H2A,no,N,35,,265147,969,HEC
36,,SING,NB,C1B,yes,N,36,,265147,969,HEC
37,,SING,NB,C4B,yes,N,37,,265147,969,HEC
38,,DOUB,C1B,C2B,yes,N,38,,265147,969,HEC
39,,SING,C2B,C3B,yes,N,39,,265147,969,HEC
40,,SING,C2B,CMB,no,N,40,,265147,969,HEC
41,,SING,C3B,C4B,yes,N,41,,265147,969,HEC
42,,DOUB,C3B,CAB,no,E,42,,265147,969,HEC
43,,SING,CMB,HMB1,no,N,43,,265147,969,HEC
44,,SING,CMB,HMB2,no,N,44,,265147,969,HEC
45,,SING,CMB,HMB3,no,N,45,,265147,969,HEC
46,,SING,CAB,CBB,no,N,46,,265147,969,HEC
47,,SING,CAB,HAB,no,N,47,,265147,969,HEC
48,,SING,CBB,HBB1,no,N,48,,265147,969,HEC
49,,SING,CBB,HBB2,no,N,49,,265147,969,HEC
50,,SING,CBB,HBB3,no,N,50,,265147,969,HEC
51,,SING,NC,C1C,yes,N,51,,265147,969,HEC
52,,SING,NC,C4C,yes,N,52,,265147,969,HEC
53,,DOUB,C1C,C2C,yes,N,53,,265147,969,HEC
54,,SING,C2C,C3C,yes,N,54,,265147,969,HEC
55,,SING,C2C,CMC,no,N,55,,265147,969,HEC
56,,SING,C3C,C4C,yes,N,56,,265147,969,HEC
57,,DOUB,C3C,CAC,no,E,57,,265147,969,HEC
58,,SING,CMC,HMC1,no,N,58,,265147,969,HEC
59,,SING,CMC,HMC2,no,N,59,,265147,969,HEC
60,,SING,CMC,HMC3,no,N,60,,265147,969,HEC
61,,SING,CAC,CBC,no,N,61,,265147,969,HEC
62,,SING,CAC,HAC,no,N,62,,265147,969,HEC
63,,SING,CBC,HBC1,no,N,63,,265147,969,HEC
64,,SING,CBC,HBC2,no,N,64,,265147,969,HEC
65,,SING,CBC,HBC3,no,N,65,,265147,969,HEC
66,,SING,ND,C1D,yes,N,66,,265147,969,HEC
67,,SING,ND,C4D,yes,N,67,,265147,969,HEC
68,,DOUB,C1D,C2D,yes,N,68,,265147,969,HEC
69,,SING,C2D,C3D,yes,N,69,,265147,969,HEC
70,,SING,C2D,CMD,no,N,70,,265147,969,HEC
71,,DOUB,C3D,C4D,yes,N,71,,265147,969,HEC
72,,SING,C3D,CAD,no,N,72,,265147,969,HEC
73,,SING,CMD,HMD1,no,N,73,,265147,969,HEC
74,,SING,CMD,HMD2,no,N,74,,265147,969,HEC
75,,SING,CMD,HMD3,no,N,75,,265147,969,HEC
76,,SING,CAD,CBD,no,N,76,,265147,969,HEC
77,,SING,CAD,HAD1,no,N,77,,265147,969,HEC
78,,SING,CAD,HAD2,no,N,78,,265147,969,HEC
79,,SING,CBD,CGD,no,N,79,,265147,969,HEC
80,,SING,CBD,HBD1,no,N,80,,265147,969,HEC
81,,SING,CBD,HBD2,no,N,81,,265147,969,HEC
82,,DOUB,CGD,O1D,no,N,82,,265147,969,HEC
83,,SING,CGD,O2D,no,N,83,,265147,969,HEC
84,,SING,O2D,H2D,no,N,84,,265147,969,HEC
1,,DOUB,C,O,no,N,1,,265161,97,ACE
2,,SING,C,CH3,no,N,2,,265161,97,ACE
3,,SING,C,H,no,N,3,,265161,97,ACE
4,,SING,CH3,H1,no,N,4,,265161,97,ACE
5,,SING,CH3,H2,no,N,5,,265161,97,ACE
6,,SING,CH3,H3,no,N,6,,265161,97,ACE
1,,SING,FE,NA,no,N,1,,265176,970,HEC
2,,SING,FE,NB,no,N,2,,265176,970,HEC
3,,SING,FE,NC,no,N,3,,265176,970,HEC
4,,SING,FE,ND,no,N,4,,265176,970,HEC
5,,DOUB,CHA,C1A,no,N,5,,265176,970,HEC
6,,SING,CHA,C4D,no,N,6,,265176,970,HEC
7,,SING,CHA,HHA,no,N,7,,265176,970,HEC
8,,DOUB,CHB,C4A,no,N,8,,265176,970,HEC
9,,SING,CHB,C1B,no,N,9,,265176,970,HEC
10,,SING,CHB,HHB,no,N,10,,265176,970,HEC
11,,DOUB,CHC,C4B,no,N,11,,265176,970,HEC
12,,SING,CHC,C1C,no,N,12,,265176,970,HEC
13,,SING,CHC,HHC,no,N,13,,265176,970,HEC
14,,DOUB,CHD,C4C,no,N,14,,265176,970,HEC
15,,SING,CHD,C1D,no,N,15,,265176,970,HEC
16,,SING,CHD,HHD,no,N,16,,265176,970,HEC
17,,SING,NA,C1A,yes,N,17,,265176,970,HEC
18,,SING,NA,C4A,yes,N,18,,265176,970,HEC
19,,SING,C1A,C2A,yes,N,19,,265176,970,HEC
20,,DOUB,C2A,C3A,yes,N,20,,265176,970,HEC
21,,SING,C2A,CAA,no,N,21,,265176,970,HEC
22,,SING,C3A,C4A,yes,N,22,,265176,970,HEC
23,,SING,C3A,CMA,no,N,23,,265176,970,HEC
24,,SING,CMA,HMA1,no,N,24,,265176,970,HEC
25,,SING,CMA,HMA2,no,N,25,,265176,970,HEC
26,,SING,CMA,HMA3,no,N,26,,265176,970,HEC
27,,SING,CAA,CBA,no,N,27,,265176,970,HEC
28,,SING,CAA,HAA1,no,N,28,,265176,970,HEC
29,,SING,CAA,HAA2,no,N,29,,265176,970,HEC
30,,SING,CBA,CGA,no,N,30,,265176,970,HEC
31,,SING,CBA,HBA1,no,N,31,,265176,970,HEC
32,,SING,CBA,HBA2,no,N,32,,265176,970,HEC
33,,DOUB,CGA,O1A,no,N,33,,265176,970,HEC
34,,SING,CGA,O2A,no,N,34,,265176,970,HEC
35,,SING,O2A,H2A,no,N,35,,265176,970,HEC
36,,SING,NB,C1B,yes,N,36,,265176,970,HEC
37,,SING,NB,C4B,yes,N,37,,265176,970,HEC
38,,DOUB,C1B,C2B,yes,N,38,,265176,970,HEC
39,,SING,C2B,C3B,yes,N,39,,265176,970,HEC
40,,SING,C2B,CMB,no,N,40,,265176,970,HEC
41,,SING,C3B,C4B,yes,N,41,,265176,970,HEC
42,,DOUB,C3B,CAB,no,E,42,,265176,970,HEC
43,,SING,CMB,HMB1,no,N,43,,265176,970,HEC
44,,SING,CMB,HMB2,no,N,44,,265176,970,HEC
45,,SING,CMB,HMB3,no,N,45,,265176,970,HEC
46,,SING,CAB,CBB,no,N,46,,265176,970,HEC
47,,SING,CAB,HAB,no,N,47,,265176,970,HEC
48,,SING,CBB,HBB1,no,N,48,,265176,970,HEC
49,,SING,CBB,HBB2,no,N,49,,265176,970,HEC
50,,SING,CBB,HBB3,no,N,50,,265176,970,HEC
51,,SING,NC,C1C,yes,N,51,,265176,970,HEC
52,,SING,NC,C4C,yes,N,52,,265176,970,HEC
53,,DOUB,C1C,C2C,yes,N,53,,265176,970,HEC
54,,SING,C2C,C3C,yes,N,54,,265176,970,HEC
55,,SING,C2C,CMC,no,N,55,,265176,970,HEC
56,,SING,C3C,C4C,yes,N,56,,265176,970,HEC
57,,DOUB,C3C,CAC,no,E,57,,265176,970,HEC
58,,SING,CMC,HMC1,no,N,58,,265176,970,HEC
59,,SING,CMC,HMC2,no,N,59,,265176,970,HEC
60,,SING,CMC,HMC3,no,N,60,,265176,970,HEC
61,,SING,CAC,CBC,no,N,61,,265176,970,HEC
62,,SING,CAC,HAC,no,N,62,,265176,970,HEC
63,,SING,CBC,HBC1,no,N,63,,265176,970,HEC
64,,SING,CBC,HBC2,no,N,64,,265176,970,HEC
65,,SING,CBC,HBC3,no,N,65,,265176,970,HEC
66,,SING,ND,C1D,yes,N,66,,265176,970,HEC
67,,SING,ND,C4D,yes,N,67,,265176,970,HEC
68,,DOUB,C1D,C2D,yes,N,68,,265176,970,HEC
69,,SING,C2D,C3D,yes,N,69,,265176,970,HEC
70,,SING,C2D,CMD,no,N,70,,265176,970,HEC
71,,DOUB,C3D,C4D,yes,N,71,,265176,970,HEC
72,,SING,C3D,CAD,no,N,72,,265176,970,HEC
73,,SING,CMD,HMD1,no,N,73,,265176,970,HEC
74,,SING,CMD,HMD2,no,N,74,,265176,970,HEC
75,,SING,CMD,HMD3,no,N,75,,265176,970,HEC
76,,SING,CAD,CBD,no,N,76,,265176,970,HEC
77,,SING,CAD,HAD1,no,N,77,,265176,970,HEC
78,,SING,CAD,HAD2,no,N,78,,265176,970,HEC
79,,SING,CBD,CGD,no,N,79,,265176,970,HEC
80,,SING,CBD,HBD1,no,N,80,,265176,970,HEC
81,,SING,CBD,HBD2,no,N,81,,265176,970,HEC
82,,DOUB,CGD,O1D,no,N,82,,265176,970,HEC
83,,SING,CGD,O2D,no,N,83,,265176,970,HEC
84,,SING,O2D,H2D,no,N,84,,265176,970,HEC
1,,SING,FE,NA,no,N,1,,265192,971,HEC
2,,SING,FE,NB,no,N,2,,265192,971,HEC
3,,SING,FE,NC,no,N,3,,265192,971,HEC
4,,SING,FE,ND,no,N,4,,265192,971,HEC
5,,DOUB,CHA,C1A,no,N,5,,265192,971,HEC
6,,SING,CHA,C4D,no,N,6,,265192,971,HEC
7,,SING,CHA,HHA,no,N,7,,265192,971,HEC
8,,DOUB,CHB,C4A,no,N,8,,265192,971,HEC
9,,SING,CHB,C1B,no,N,9,,265192,971,HEC
10,,SING,CHB,HHB,no,N,10,,265192,971,HEC
11,,DOUB,CHC,C4B,no,N,11,,265192,971,HEC
12,,SING,CHC,C1C,no,N,12,,265192,971,HEC
13,,SING,CHC,HHC,no,N,13,,265192,971,HEC
14,,DOUB,CHD,C4C,no,N,14,,265192,971,HEC
15,,SING,CHD,C1D,no,N,15,,265192,971,HEC
16,,SING,CHD,HHD,no,N,16,,265192,971,HEC
17,,SING,NA,C1A,yes,N,17,,265192,971,HEC
18,,SING,NA,C4A,yes,N,18,,265192,971,HEC
19,,SING,C1A,C2A,yes,N,19,,265192,971,HEC
20,,DOUB,C2A,C3A,yes,N,20,,265192,971,HEC
21,,SING,C2A,CAA,no,N,21,,265192,971,HEC
22,,SING,C3A,C4A,yes,N,22,,265192,971,HEC
23,,SING,C3A,CMA,no,N,23,,265192,971,HEC
24,,SING,CMA,HMA1,no,N,24,,265192,971,HEC
25,,SING,CMA,HMA2,no,N,25,,265192,971,HEC
26,,SING,CMA,HMA3,no,N,26,,265192,971,HEC
27,,SING,CAA,CBA,no,N,27,,265192,971,HEC
28,,SING,CAA,HAA1,no,N,28,,265192,971,HEC
29,,SING,CAA,HAA2,no,N,29,,265192,971,HEC
30,,SING,CBA,CGA,no,N,30,,265192,971,HEC
31,,SING,CBA,HBA1,no,N,31,,265192,971,HEC
32,,SING,CBA,HBA2,no,N,32,,265192,971,HEC
33,,DOUB,CGA,O1A,no,N,33,,265192,971,HEC
34,,SING,CGA,O2A,no,N,34,,265192,971,HEC
35,,SING,O2A,H2A,no,N,35,,265192,971,HEC
36,,SING,NB,C1B,yes,N,36,,265192,971,HEC
37,,SING,NB,C4B,yes,N,37,,265192,971,HEC
38,,DOUB,C1B,C2B,yes,N,38,,265192,971,HEC
39,,SING,C2B,C3B,yes,N,39,,265192,971,HEC
40,,SING,C2B,CMB,no,N,40,,265192,971,HEC
41,,SING,C3B,C4B,yes,N,41,,265192,971,HEC
42,,DOUB,C3B,CAB,no,E,42,,265192,971,HEC
43,,SING,CMB,HMB1,no,N,43,,265192,971,HEC
44,,SING,CMB,HMB2,no,N,44,,265192,971,HEC
45,,SING,CMB,HMB3,no,N,45,,265192,971,HEC
46,,SING,CAB,CBB,no,N,46,,265192,971,HEC
47,,SING,CAB,HAB,no,N,47,,265192,971,HEC
48,,SING,CBB,HBB1,no,N,48,,265192,971,HEC
49,,SING,CBB,HBB2,no,N,49,,265192,971,HEC
50,,SING,CBB,HBB3,no,N,50,,265192,971,HEC
51,,SING,NC,C1C,yes,N,51,,265192,971,HEC
52,,SING,NC,C4C,yes,N,52,,265192,971,HEC
53,,DOUB,C1C,C2C,yes,N,53,,265192,971,HEC
54,,SING,C2C,C3C,yes,N,54,,265192,971,HEC
55,,SING,C2C,CMC,no,N,55,,265192,971,HEC
56,,SING,C3C,C4C,yes,N,56,,265192,971,HEC
57,,DOUB,C3C,CAC,no,E,57,,265192,971,HEC
58,,SING,CMC,HMC1,no,N,58,,265192,971,HEC
59,,SING,CMC,HMC2,no,N,59,,265192,971,HEC
60,,SING,CMC,HMC3,no,N,60,,265192,971,HEC
61,,SING,CAC,CBC,no,N,61,,265192,971,HEC
62,,SING,CAC,HAC,no,N,62,,265192,971,HEC
63,,SING,CBC,HBC1,no,N,63,,265192,971,HEC
64,,SING,CBC,HBC2,no,N,64,,265192,971,HEC
65,,SING,CBC,HBC3,no,N,65,,265192,971,HEC
66,,SING,ND,C1D,yes,N,66,,265192,971,HEC
67,,SING,ND,C4D,yes,N,67,,265192,971,HEC
68,,DOUB,C1D,C2D,yes,N,68,,265192,971,HEC
69,,SING,C2D,C3D,yes,N,69,,265192,971,HEC
70,,SING,C2D,CMD,no,N,70,,265192,971,HEC
71,,DOUB,C3D,C4D,yes,N,71,,265192,971,HEC
72,,SING,C3D,CAD,no,N,72,,265192,971,HEC
73,,SING,CMD,HMD1,no,N,73,,265192,971,HEC
74,,SING,CMD,HMD2,no,N,74,,265192,971,HEC
75,,SING,CMD,HMD3,no,N,75,,265192,971,HEC
76,,SING,CAD,CBD,no,N,76,,265192,971,HEC
77,,SING,CAD,HAD1,no,N,77,,265192,971,HEC
78,,SING,CAD,HAD2,no,N,78,,265192,971,HEC
79,,SING,CBD,CGD,no,N,79,,265192,971,HEC
80,,SING,CBD,HBD1,no,N,80,,265192,971,HEC
81,,SING,CBD,HBD2,no,N,81,,265192,971,HEC
82,,DOUB,CGD,O1D,no,N,82,,265192,971,HEC
83,,SING,CGD,O2D,no,N,83,,265192,971,HEC
84,,SING,O2D,H2D,no,N,84,,265192,971,HEC