data_LACS
#################################
# LACS Output Information #
#################################
############################################################
# LACS Designator Definition #
# #
# Index Value Definition #
# #
# 0 Outliers #
# 1 Normal points #
# #
############################################################
save_LACS_CACB_CA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr5389_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -6.80
_LACS_plot.Line_1_terminator_val_y_1 -2.96
_LACS_plot.Line_1_terminator_val_x_2 1.99
_LACS_plot.Line_1_terminator_val_y_2 0.70
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.63
_LACS_plot.Line_2_terminator_val_x_2 6.69
_LACS_plot.Line_2_terminator_val_y_2 4.86
_LACS_plot.Y_axis_chem_shift_offset 0.13
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
67 HIS 0.70 4.20 0
12 ILE 2.10 -2.10 0
10 MET -2.70 -1.00 1
11 GLU -1.80 -1.30 1
13 THR 0.20 -1.20 1
15 ALA 3.50 2.40 1
16 ILE 4.70 4.20 1
17 ARG 5.60 4.20 1
18 GLN 3.30 2.10 1
19 HIS 3.30 5.10 1
20 VAL 6.50 4.70 1
21 ALA 4.40 3.10 1
22 ASP 3.60 2.60 1
23 ARG 3.10 0.90 1
24 LEU 3.30 1.90 1
25 ALA 3.00 1.60 1
26 LYS 2.10 0.80 1
27 LEU 1.60 -0.40 1
28 GLU 2.60 1.90 1
29 LYS 4.70 0.70 1
30 TRP -0.40 -0.50 1
32 THR 0.70 0.40 1
33 HIS 2.10 3.50 1
34 LEU 0.10 0.70 1
35 ILE 0.50 -0.30 1
36 ASN 1.60 1.10 1
38 HIS -3.30 -1.10 1
39 ILE -3.00 -1.90 1
40 ILE -2.80 -1.30 1
41 LEU -4.60 -2.20 1
42 SER -2.90 -1.30 1
43 LYS -2.10 -0.80 1
44 GLU -0.80 -0.50 1
46 GLN 1.40 -0.10 1
48 PHE -2.40 0.10 1
49 VAL -2.80 -1.30 1
50 ALA -5.20 -3.10 1
51 ASP -5.20 -0.80 1
52 ALA -6.80 -1.40 1
53 THR -1.50 -0.40 1
54 ILE -3.70 -1.20 1
55 ASN 0.50 0.50 1
56 THR -0.10 -0.10 1
58 ASN -2.10 -1.00 1
60 VAL 0.10 0.00 1
61 LEU -2.90 -1.60 1
62 VAL -3.90 -2.30 1
63 ALA -5.90 -1.40 1
64 SER -3.20 -1.30 1
66 LYS -4.20 -1.70 1
68 GLU 3.40 2.90 1
69 ASP -3.50 -1.30 1
70 MET 5.40 4.40 1
71 TYR 6.70 3.50 1
72 THR 6.60 4.70 1
73 ALA 5.70 3.60 1
74 ILE 5.10 4.00 1
75 ASN 4.20 3.00 1
76 GLU 2.20 1.50 1
77 LEU 5.20 3.10 1
78 ILE 6.00 2.80 1
79 ASN 4.20 2.90 1
80 LYS 4.10 3.50 1
81 LEU 3.50 2.80 1
82 GLU 4.20 3.60 1
83 ARG 3.90 3.10 1
84 GLN 3.40 2.90 1
85 LEU 4.80 2.50 1
86 ASN 2.80 2.40 1
87 LYS 2.80 1.90 1
88 LEU 1.80 1.30 1
89 GLN 1.10 0.60 1
90 HIS 0.70 1.30 1
91 LYS 1.20 0.60 1
93 GLU -0.50 -0.30 1
94 ALA 0.50 0.10 1
95 ARG 0.50 0.00 1
96 ARG 0.30 -0.10 1
97 ALA 0.10 -0.10 1
98 ALA 0.00 -0.20 1
99 THR -0.10 -0.40 1
100 SER -0.50 -0.60 1
101 VAL 0.50 -0.10 1
102 LYS 0.40 -0.20 1
103 ASP -0.20 -0.20 1
104 ALA 0.60 0.30 1
105 ASN 0.10 -0.20 1
106 PHE 0.50 0.20 1
107 VAL -0.50 -0.60 1
108 GLU -1.40 -0.50 1
109 GLU -0.70 -0.50 1
110 VAL -0.50 -0.50 1
111 GLU -1.00 -0.50 1
112 GLU -1.10 -0.50 1
113 GLU 0.30 1.20 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr5389_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -6.80
_LACS_plot.Line_1_terminator_val_y_1 3.84
_LACS_plot.Line_1_terminator_val_x_2 1.99
_LACS_plot.Line_1_terminator_val_y_2 -1.29
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.37
_LACS_plot.Line_2_terminator_val_x_2 6.69
_LACS_plot.Line_2_terminator_val_y_2 -1.83
_LACS_plot.Y_axis_chem_shift_offset 0.13
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
67 HIS 0.70 3.50 0
12 ILE 2.10 -4.20 0
10 MET -2.70 1.70 1
11 GLU -1.80 0.50 1
13 THR 0.20 -1.40 1
15 ALA 3.50 -1.10 1
16 ILE 4.70 -0.50 1
17 ARG 5.60 -1.40 1
18 GLN 3.30 -1.20 1
19 HIS 3.30 1.80 1
20 VAL 6.50 -1.80 1
21 ALA 4.40 -1.30 1
22 ASP 3.60 -1.00 1
23 ARG 3.10 -2.20 1
24 LEU 3.30 -1.40 1
25 ALA 3.00 -1.40 1
26 LYS 2.10 -1.30 1
27 LEU 1.60 -2.00 1
28 GLU 2.60 -0.70 1
29 LYS 4.70 -4.00 1
30 TRP -0.40 -0.10 1
32 THR 0.70 -0.30 1
33 HIS 2.10 1.40 1
34 LEU 0.10 0.60 1
35 ILE 0.50 -0.80 1
36 ASN 1.60 -0.50 1
38 HIS -3.30 2.20 1
39 ILE -3.00 1.10 1
40 ILE -2.80 1.50 1
41 LEU -4.60 2.40 1
42 SER -2.90 1.60 1
43 LYS -2.10 1.30 1
44 GLU -0.80 0.30 1
46 GLN 1.40 -1.50 1
48 PHE -2.40 2.50 1
49 VAL -2.80 1.50 1
50 ALA -5.20 2.10 1
51 ASP -5.20 4.40 1
52 ALA -6.80 5.40 1
53 THR -1.50 1.10 1
54 ILE -3.70 2.50 1
55 ASN 0.50 0.00 1
56 THR -0.10 0.00 1
58 ASN -2.10 1.10 1
60 VAL 0.10 -0.10 1
61 LEU -2.90 1.30 1
62 VAL -3.90 1.60 1
63 ALA -5.90 4.50 1
64 SER -3.20 1.90 1
66 LYS -4.20 2.50 1
68 GLU 3.40 -0.50 1
69 ASP -3.50 2.20 1
70 MET 5.40 -1.00 1
71 TYR 6.70 -3.20 1
72 THR 6.60 -1.90 1
73 ALA 5.70 -2.10 1
74 ILE 5.10 -1.10 1
75 ASN 4.20 -1.20 1
76 GLU 2.20 -0.70 1
77 LEU 5.20 -2.10 1
78 ILE 6.00 -3.20 1
79 ASN 4.20 -1.30 1
80 LYS 4.10 -0.60 1
81 LEU 3.50 -0.70 1
82 GLU 4.20 -0.60 1
83 ARG 3.90 -0.80 1
84 GLN 3.40 -0.50 1
85 LEU 4.80 -2.30 1
86 ASN 2.80 -0.40 1
87 LYS 2.80 -0.90 1
88 LEU 1.80 -0.50 1
89 GLN 1.10 -0.50 1
90 HIS 0.70 0.60 1
91 LYS 1.20 -0.60 1
93 GLU -0.50 0.20 1
94 ALA 0.50 -0.40 1
95 ARG 0.50 -0.50 1
96 ARG 0.30 -0.40 1
97 ALA 0.10 -0.20 1
98 ALA 0.00 -0.20 1
99 THR -0.10 -0.30 1
100 SER -0.50 -0.10 1
101 VAL 0.50 -0.60 1
102 LYS 0.40 -0.60 1
103 ASP -0.20 0.00 1
104 ALA 0.60 -0.30 1
105 ASN 0.10 -0.30 1
106 PHE 0.50 -0.30 1
107 VAL -0.50 -0.10 1
108 GLU -1.40 0.90 1
109 GLU -0.70 0.20 1
110 VAL -0.50 0.00 1
111 GLU -1.00 0.50 1
112 GLU -1.10 0.60 1
113 GLU 0.30 0.90 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr5389_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -6.80
_LACS_plot.Line_1_terminator_val_y_1 0.99
_LACS_plot.Line_1_terminator_val_x_2 1.99
_LACS_plot.Line_1_terminator_val_y_2 -0.21
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.32
_LACS_plot.Line_2_terminator_val_x_2 6.69
_LACS_plot.Line_2_terminator_val_y_2 -0.83
_LACS_plot.Y_axis_chem_shift_offset -0.06
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
64 SER -3.20 1.18 0
63 ALA -5.90 0.42 0
70 MET 5.40 -1.38 0
10 MET -2.70 0.22 1
11 GLU -1.80 -0.02 1
12 ILE 2.10 -0.08 1
13 THR 0.20 0.19 1
15 ALA 3.50 -0.20 1
16 ILE 4.70 -0.47 1
17 ARG 5.60 -0.73 1
18 GLN 3.30 -0.45 1
19 HIS 3.30 -0.51 1
20 VAL 6.50 -0.97 1
21 ALA 4.40 -0.47 1
22 ASP 3.60 -0.36 1
23 ARG 3.10 -0.30 1
24 LEU 3.30 -0.40 1
25 ALA 3.00 -0.27 1
26 LYS 2.10 -0.17 1
27 LEU 1.60 0.14 1
28 GLU 2.60 -0.50 1
29 LYS 4.70 -0.34 1
30 TRP -0.40 0.04 1
32 THR 0.70 -0.13 1
33 HIS 2.10 -0.73 1
34 LEU 0.10 0.11 1
35 ILE 0.50 -0.17 1
36 ASN 1.60 -0.35 1
38 HIS -3.30 0.81 1
39 ILE -3.00 0.84 1
40 ILE -2.80 0.76 1
41 LEU -4.60 1.11 1
42 SER -2.90 0.59 1
43 LYS -2.10 0.08 1
44 GLU -0.80 0.11 1
46 GLN 1.40 -0.06 1
48 PHE -2.40 0.38 1
49 VAL -2.80 0.61 1
50 ALA -5.20 1.07 1
51 ASP -5.20 0.88 1
52 ALA -6.80 1.13 1
53 THR -1.50 0.80 1
54 ILE -3.70 0.31 1
55 ASN 0.50 0.17 1
56 THR -0.10 0.65 1
58 ASN -2.10 0.26 1
60 VAL 0.10 0.43 1
61 LEU -2.90 0.33 1
62 VAL -3.90 0.89 1
66 LYS -4.20 1.21 1
67 HIS 0.70 -0.38 1
68 GLU 3.40 -0.09 1
69 ASP -3.50 0.42 1
71 TYR 6.70 -0.79 1
72 THR 6.60 -0.55 1
73 ALA 5.70 -0.72 1
74 ILE 5.10 -0.85 1
75 ASN 4.20 -0.46 1
76 GLU 2.20 -0.20 1
77 LEU 5.20 -0.54 1
78 ILE 6.00 -0.67 1
79 ASN 4.20 -0.24 1
80 LYS 4.10 -0.32 1
81 LEU 3.50 -0.49 1
82 GLU 4.20 -0.79 1
83 ARG 3.90 0.15 1
84 GLN 3.40 -0.32 1
85 LEU 4.80 -0.64 1
86 ASN 2.80 -0.31 1
87 LYS 2.80 -0.17 1
88 LEU 1.80 -0.19 1
89 GLN 1.10 -0.12 1
90 HIS 0.70 -0.09 1
91 LYS 1.20 -0.08 1
93 GLU -0.50 -0.02 1
94 ALA 0.50 -0.06 1
95 ARG 0.50 -0.06 1
96 ARG 0.30 -0.06 1
97 ALA 0.10 -0.07 1
98 ALA 0.00 0.03 1
99 THR -0.10 0.00 1
100 SER -0.50 0.00 1
101 VAL 0.50 -0.03 1
102 LYS 0.40 -0.10 1
103 ASP -0.20 -0.06 1
104 ALA 0.60 -0.10 1
105 ASN 0.10 -0.13 1
106 PHE 0.50 -0.08 1
107 VAL -0.50 -0.10 1
108 GLU -1.40 -0.13 1
109 GLU -0.70 -0.07 1
110 VAL -0.50 0.02 1
111 GLU -1.00 -0.07 1
112 GLU -1.10 -0.05 1
113 GLU 0.30 -0.26 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr5389_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -6.80
_LACS_plot.Line_1_terminator_val_y_1 -3.23
_LACS_plot.Line_1_terminator_val_x_2 1.99
_LACS_plot.Line_1_terminator_val_y_2 0.39
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.28
_LACS_plot.Line_2_terminator_val_x_2 6.69
_LACS_plot.Line_2_terminator_val_y_2 2.20
_LACS_plot.Y_axis_chem_shift_offset 0.46
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
105 ASN 0.10 3.50 0
10 MET -2.70 -2.60 1
11 GLU -1.80 -0.90 1
12 ILE 2.10 -1.10 1
15 ALA 3.50 2.70 1
16 ILE 4.70 0.80 1
17 ARG 5.60 1.80 1
18 GLN 3.30 0.90 1
19 HIS 3.30 3.50 1
20 VAL 6.50 0.50 1
21 ALA 4.40 2.60 1
22 ASP 3.60 2.50 1
23 ARG 3.10 3.20 1
24 LEU 3.30 1.40 1
25 ALA 3.00 1.40 1
26 LYS 2.10 1.00 1
27 LEU 1.60 -0.20 1
29 LYS 4.70 0.30 1
34 LEU 0.10 -2.50 1
35 ILE 0.50 -1.50 1
38 HIS -3.30 0.00 1
39 ILE -3.00 -2.80 1
40 ILE -2.80 -0.50 1
41 LEU -4.60 -1.80 1
42 SER -2.90 -2.80 1
43 LYS -2.10 -2.10 1
46 GLN 1.40 -0.80 1
48 PHE -2.40 -0.70 1
49 VAL -2.80 -2.70 1
50 ALA -5.20 -4.00 1
51 ASP -5.20 -1.50 1
52 ALA -6.80 -1.90 1
53 THR -1.50 -0.60 1
54 ILE -3.70 -2.60 1
55 ASN 0.50 -1.80 1
58 ASN -2.10 -1.60 1
60 VAL 0.10 -1.00 1
61 LEU -2.90 -2.80 1
62 VAL -3.90 -1.10 1
63 ALA -5.90 -3.30 1
64 SER -3.20 -1.20 1
66 LYS -4.20 -1.80 1
67 HIS 0.70 -0.90 1
68 GLU 3.40 -0.70 1
69 ASP -3.50 -0.70 1
70 MET 5.40 0.70 1
71 TYR 6.70 2.30 1
72 THR 6.60 0.80 1
73 ALA 5.70 1.20 1
74 ILE 5.10 0.20 1
75 ASN 4.20 2.80 1
76 GLU 2.20 2.00 1
77 LEU 5.20 -0.10 1
78 ILE 6.00 0.90 1
79 ASN 4.20 3.10 1
80 LYS 4.10 2.90 1
81 LEU 3.50 0.40 1
82 GLU 4.20 1.30 1
83 ARG 3.90 2.90 1
84 GLN 3.40 2.60 1
85 LEU 4.80 0.70 1
86 ASN 2.80 1.70 1
87 LYS 2.80 1.40 1
88 LEU 1.80 0.00 1
89 GLN 1.10 -0.40 1
90 HIS 0.70 0.90 1
91 LYS 1.20 0.10 1
93 GLU -0.50 -0.80 1
94 ALA 0.50 -0.90 1
95 ARG 0.50 -0.50 1
96 ARG 0.30 -0.80 1
97 ALA 0.10 -2.00 1
99 THR -0.10 2.80 1
100 SER -0.50 2.30 1
101 VAL 0.50 -0.80 1
102 LYS 0.40 -0.60 1
103 ASP -0.20 -3.30 1
104 ALA 0.60 -1.40 1
106 PHE 0.50 0.40 1
107 VAL -0.50 -0.80 1
108 GLU -1.40 -1.20 1
109 GLU -0.70 -0.70 1
110 VAL -0.50 -0.70 1
111 GLU -1.00 -0.70 1
112 GLU -1.10 -1.40 1
stop_
save_