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 bmr17020_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -6.70
_LACS_plot.Line_1_terminator_val_y_1 -2.67
_LACS_plot.Line_1_terminator_val_x_2 1.99
_LACS_plot.Line_1_terminator_val_y_2 1.03
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.19
_LACS_plot.Line_2_terminator_val_x_2 8.09
_LACS_plot.Line_2_terminator_val_y_2 6.17
_LACS_plot.Y_axis_chem_shift_offset -0.23
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
62 PHE -0.50 -2.40 0
60 LEU 0.60 -1.80 0
10 GLN 5.90 4.30 1
11 ASP 5.20 3.70 1
12 MET 3.90 3.60 1
13 PHE 5.80 6.00 1
14 THR 8.10 6.70 1
15 SER 4.80 3.80 1
16 ALA 0.80 1.90 1
17 ILE 5.20 4.90 1
18 GLU 3.80 2.40 1
19 ALA 1.30 2.20 1
20 VAL -1.40 -1.40 1
21 ALA 1.00 1.10 1
22 ARG -0.90 -0.30 1
23 ASP 3.90 2.90 1
24 SER 0.10 0.30 1
26 TRP -2.20 -0.50 1
27 ALA -6.70 -2.90 1
28 GLU 1.10 0.90 1
29 LEU 4.30 3.70 1
30 SER 5.10 3.10 1
31 ALA 3.00 2.30 1
32 VAL 6.00 4.80 1
34 SER 4.40 3.50 1
35 TYR 4.90 4.30 1
36 LEU 3.70 2.60 1
37 ALA 2.90 2.20 1
38 LYS 1.30 1.60 1
39 ASN -0.00 1.80 1
40 ASP -0.80 -0.60 1
42 SER 1.50 1.20 1
43 PHE 1.80 1.20 1
44 ASP -3.30 -1.30 1
46 ARG 3.80 2.70 1
47 ASN 1.40 1.00 1
48 TRP -0.90 -0.30 1
50 HIS 0.20 1.10 1
52 ARG -1.30 -0.20 1
53 LEU 4.40 3.70 1
54 SER 4.70 3.00 1
55 GLN 2.20 2.10 1
56 MET 3.60 3.70 1
57 VAL 4.90 3.00 1
58 LYS 2.90 2.40 1
59 LYS -0.80 -1.30 1
61 ASP 2.70 2.00 1
63 LEU -4.50 -1.80 1
64 THR -0.80 0.30 1
65 VAL -3.10 -1.40 1
66 GLN -3.50 -1.00 1
67 GLU -3.80 -1.60 1
68 SER -2.40 -1.10 1
69 ARG -1.50 -0.60 1
70 ASN -0.90 -0.50 1
72 SER 0.60 0.60 1
73 LYS -1.60 -0.60 1
74 LEU -1.40 -0.30 1
75 HIS -1.90 -0.10 1
76 SER -1.00 -0.20 1
77 GLU -6.30 -2.20 1
78 ILE -6.50 -2.20 1
79 ARG -3.70 -1.60 1
80 LEU 1.10 0.30 1
81 ARG 1.50 1.50 1
82 HIS -0.30 0.00 1
83 ASP 0.00 0.20 1
85 LEU 0.50 0.20 1
86 GLU 0.20 0.10 1
87 HIS 0.60 0.30 1
88 HIS -0.10 0.50 1
89 HIS 0.20 0.20 1
90 HIS 0.00 0.20 1
91 HIS 0.10 0.50 1
92 HIS 1.60 2.20 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr17020_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -6.70
_LACS_plot.Line_1_terminator_val_y_1 4.03
_LACS_plot.Line_1_terminator_val_x_2 1.99
_LACS_plot.Line_1_terminator_val_y_2 -0.96
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.81
_LACS_plot.Line_2_terminator_val_x_2 8.09
_LACS_plot.Line_2_terminator_val_y_2 -1.92
_LACS_plot.Y_axis_chem_shift_offset -0.23
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
62 PHE -0.50 -1.90 0
60 LEU 0.60 -2.40 0
10 GLN 5.90 -1.60 1
11 ASP 5.20 -1.50 1
12 MET 3.90 -0.30 1
13 PHE 5.80 0.20 1
14 THR 8.10 -1.40 1
15 SER 4.80 -1.00 1
16 ALA 0.80 1.10 1
17 ILE 5.20 -0.30 1
18 GLU 3.80 -1.40 1
19 ALA 1.30 0.90 1
20 VAL -1.40 0.00 1
21 ALA 1.00 0.10 1
22 ARG -0.90 0.60 1
23 ASP 3.90 -1.00 1
24 SER 0.10 0.20 1
26 TRP -2.20 1.70 1
27 ALA -6.70 3.80 1
28 GLU 1.10 -0.20 1
29 LEU 4.30 -0.60 1
30 SER 5.10 -2.00 1
31 ALA 3.00 -0.70 1
32 VAL 6.00 -1.20 1
34 SER 4.40 -0.90 1
35 TYR 4.90 -0.60 1
36 LEU 3.70 -1.10 1
37 ALA 2.90 -0.70 1
38 LYS 1.30 0.30 1
39 ASN -0.00 1.80 1
40 ASP -0.80 0.20 1
42 SER 1.50 -0.30 1
43 PHE 1.80 -0.60 1
44 ASP -3.30 2.00 1
46 ARG 3.80 -1.10 1
47 ASN 1.40 -0.40 1
48 TRP -0.90 0.60 1
50 HIS 0.20 0.90 1
52 ARG -1.30 1.10 1
53 LEU 4.40 -0.70 1
54 SER 4.70 -1.70 1
55 GLN 2.20 -0.10 1
56 MET 3.60 0.10 1
57 VAL 4.90 -1.90 1
58 LYS 2.90 -0.50 1
59 LYS -0.80 -0.50 1
61 ASP 2.70 -0.70 1
63 LEU -4.50 2.70 1
64 THR -0.80 1.10 1
65 VAL -3.10 1.70 1
66 GLN -3.50 2.50 1
67 GLU -3.80 2.20 1
68 SER -2.40 1.30 1
69 ARG -1.50 0.90 1
70 ASN -0.90 0.40 1
72 SER 0.60 0.00 1
73 LYS -1.60 1.00 1
74 LEU -1.40 1.10 1
75 HIS -1.90 1.80 1
76 SER -1.00 0.80 1
77 GLU -6.30 4.10 1
78 ILE -6.50 4.30 1
79 ARG -3.70 2.10 1
80 LEU 1.10 -0.80 1
81 ARG 1.50 0.00 1
82 HIS -0.30 0.30 1
83 ASP 0.00 0.20 1
85 LEU 0.50 -0.30 1
86 GLU 0.20 -0.10 1
87 HIS 0.60 -0.30 1
88 HIS -0.10 0.60 1
89 HIS 0.20 0.00 1
90 HIS 0.00 0.20 1
91 HIS 0.10 0.40 1
92 HIS 1.60 0.60 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr17020_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -6.70
_LACS_plot.Line_1_terminator_val_y_1 0.80
_LACS_plot.Line_1_terminator_val_x_2 1.99
_LACS_plot.Line_1_terminator_val_y_2 -0.18
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.26
_LACS_plot.Line_2_terminator_val_x_2 8.09
_LACS_plot.Line_2_terminator_val_y_2 -0.86
_LACS_plot.Y_axis_chem_shift_offset -0.04
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
16 ALA 0.80 -1.54 0
10 GLN 5.90 -1.12 1
11 ASP 5.20 -0.32 1
12 MET 3.90 -0.34 1
13 PHE 5.80 -0.73 1
14 THR 8.10 0.01 1
15 SER 4.80 -0.39 1
17 ILE 5.20 -0.95 1
18 GLU 3.80 -0.42 1
19 ALA 1.30 -0.15 1
20 VAL -1.40 0.52 1
21 ALA 1.00 -0.15 1
22 ARG -0.90 0.23 1
23 ASP 3.90 -0.28 1
24 SER 0.10 -0.15 1
26 TRP -2.20 -0.02 1
27 ALA -6.70 0.65 1
28 GLU 1.10 0.07 1
29 LEU 4.30 -0.39 1
30 SER 5.10 -0.22 1
31 ALA 3.00 0.05 1
32 VAL 6.00 -0.69 1
34 SER 4.40 -0.18 1
35 TYR 4.90 -0.57 1
36 LEU 3.70 -0.45 1
37 ALA 2.90 -0.24 1
38 LYS 1.30 -0.21 1
39 ASN -0.00 -0.15 1
40 ASP -0.80 0.30 1
42 SER 1.50 -0.06 1
43 PHE 1.80 -0.11 1
44 ASP -3.30 -0.17 1
46 ARG 3.80 -0.20 1
47 ASN 1.40 -0.17 1
48 TRP -0.90 0.00 1
50 HIS 0.20 -0.11 1
52 ARG -1.30 0.41 1
53 LEU 4.40 -0.13 1
54 SER 4.70 -0.23 1
55 GLN 2.20 -0.21 1
56 MET 3.60 -0.83 1
57 VAL 4.90 -0.59 1
58 LYS 2.90 -0.42 1
59 LYS -0.80 0.11 1
60 LEU 0.60 0.03 1
61 ASP 2.70 -0.34 1
62 PHE -0.50 0.15 1
63 LEU -4.50 0.78 1
64 THR -0.80 0.21 1
65 VAL -3.10 0.97 1
66 GLN -3.50 0.36 1
67 GLU -3.80 0.72 1
68 SER -2.40 0.09 1
69 ARG -1.50 0.47 1
70 ASN -0.90 0.07 1
72 SER 0.60 -0.06 1
73 LYS -1.60 0.20 1
74 LEU -1.40 0.55 1
75 HIS -1.90 0.29 1
76 SER -1.00 0.69 1
77 GLU -6.30 0.96 1
78 ILE -6.50 1.89 1
79 ARG -3.70 0.30 1
80 LEU 1.10 0.15 1
81 ARG 1.50 -0.43 1
82 HIS -0.30 -0.02 1
83 ASP 0.00 -0.06 1
85 LEU 0.50 -0.12 1
86 GLU 0.20 -0.22 1
87 HIS 0.60 -0.12 1
88 HIS -0.10 -0.07 1
89 HIS 0.20 -0.10 1
90 HIS 0.00 -0.06 1
91 HIS 0.10 -0.08 1
92 HIS 1.60 -0.08 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr17020_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -6.70
_LACS_plot.Line_1_terminator_val_y_1 -2.52
_LACS_plot.Line_1_terminator_val_x_2 1.99
_LACS_plot.Line_1_terminator_val_y_2 0.63
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -0.85
_LACS_plot.Line_2_terminator_val_x_2 8.09
_LACS_plot.Line_2_terminator_val_y_2 2.77
_LACS_plot.Y_axis_chem_shift_offset 0.11
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
14 THR 8.10 0.80 0
10 GLN 5.90 3.20 1
11 ASP 5.20 1.90 1
12 MET 3.90 2.70 1
13 PHE 5.80 1.90 1
15 SER 4.80 1.40 1
16 ALA 0.80 0.20 1
17 ILE 5.20 1.10 1
18 GLU 3.80 1.90 1
19 ALA 1.30 2.20 1
20 VAL -1.40 0.60 1
21 ALA 1.00 0.70 1
22 ARG -0.90 1.70 1
23 ASP 3.90 0.30 1
24 SER 0.10 0.90 1
26 TRP -2.20 -0.60 1
27 ALA -6.70 -1.60 1
28 GLU 1.10 1.30 1
29 LEU 4.30 1.00 1
30 SER 5.10 2.40 1
31 ALA 3.00 3.00 1
32 VAL 6.00 1.40 1
34 SER 4.40 1.80 1
35 TYR 4.90 3.20 1
36 LEU 3.70 1.00 1
37 ALA 2.90 1.50 1
38 LYS 1.30 1.00 1
39 ASN -0.00 -0.70 1
42 SER 1.50 0.20 1
43 PHE 1.80 -2.00 1
46 ARG 3.80 2.60 1
47 ASN 1.40 0.00 1
48 TRP -0.90 -0.10 1
50 HIS 0.20 0.80 1
52 ARG -1.30 1.60 1
53 LEU 4.40 0.30 1
54 SER 4.70 0.70 1
55 GLN 2.20 2.20 1
56 MET 3.60 2.90 1
57 VAL 4.90 0.50 1
58 LYS 2.90 -0.20 1
59 LYS -0.80 -0.70 1
60 LEU 0.60 -0.90 1
61 ASP 2.70 -0.80 1
62 PHE -0.50 -1.20 1
63 LEU -4.50 -1.80 1
64 THR -0.80 -2.00 1
65 VAL -3.10 -0.90 1
66 GLN -3.50 -2.20 1
67 GLU -3.80 -1.10 1
68 SER -2.40 -1.60 1
69 ARG -1.50 -0.60 1
70 ASN -0.90 0.20 1
72 SER 0.60 -0.50 1
73 LYS -1.60 -1.30 1
74 LEU -1.40 -1.20 1
75 HIS -1.90 -0.90 1
76 SER -1.00 -1.50 1
77 GLU -6.30 -2.00 1
78 ILE -6.50 -2.70 1
79 ARG -3.70 -1.90 1
80 LEU 1.10 -0.30 1
81 ARG 1.50 -0.10 1
82 HIS -0.30 -0.40 1
83 ASP 0.00 0.20 1
85 LEU 0.50 -0.20 1
86 GLU 0.20 -0.40 1
87 HIS 0.60 0.10 1
88 HIS -0.10 -0.60 1
89 HIS 0.20 0.10 1
90 HIS 0.00 -0.10 1
91 HIS 0.10 -0.60 1
stop_
save_