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 bmr6574_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -8.11
_LACS_plot.Line_1_terminator_val_y_1 -3.12
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 0.79
_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 4.04
_LACS_plot.Line_2_terminator_val_y_2 2.79
_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
23 ILE 2.71 -2.33 0
10 ASN -0.00 0.20 1
11 VAL -0.16 -0.12 1
13 VAL -4.18 -2.61 1
14 GLU -5.84 -2.18 1
15 ALA 2.20 0.80 1
17 LYS -1.24 -0.53 1
18 GLU -4.26 -2.52 1
19 TYR -5.43 -0.91 1
20 GLU -1.27 -0.80 1
21 VAL -6.56 -3.51 1
22 THR -0.91 -0.53 1
24 GLU -2.00 0.24 1
25 ASP -4.79 -1.67 1
26 MET -2.89 -1.72 1
28 LYS 2.27 1.64 1
31 ASP 0.94 -0.14 1
33 ILE -1.82 0.08 1
34 ALA -7.45 -3.20 1
35 ARG -6.57 -1.05 1
36 ILE -1.26 -0.36 1
37 ASP 2.52 0.89 1
39 PHE -2.14 -0.05 1
40 VAL 2.34 2.02 1
41 VAL -3.89 -2.18 1
42 PHE -2.47 -0.67 1
43 VAL -3.35 -1.59 1
45 ASN 3.16 1.77 1
46 ALA -4.14 -1.42 1
47 GLU -3.07 -1.54 1
48 LYS 3.43 2.97 1
50 SER -0.18 0.82 1
51 VAL 0.50 -0.24 1
52 ILE -6.81 -1.80 1
53 ASN -1.72 -0.53 1
54 VAL -6.64 -4.10 1
55 LYS -4.32 -2.03 1
56 VAL 2.90 1.74 1
57 THR 0.98 0.46 1
58 ALA -2.72 0.40 1
59 VAL 0.28 1.06 1
60 LYS -1.38 -2.38 1
61 GLU 4.05 3.62 1
62 LYS -1.35 -0.95 1
63 PHE -2.66 -1.82 1
64 ALA -8.11 -2.88 1
65 PHE -3.58 -0.53 1
66 ALA -7.51 -1.78 1
67 GLU -6.66 -3.28 1
68 ARG 1.76 1.79 1
69 VAL -0.37 -0.19 1
70 LEU 0.07 0.09 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr6574_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -8.11
_LACS_plot.Line_1_terminator_val_y_1 4.99
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -1.21
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.72
_LACS_plot.Line_2_terminator_val_x_2 4.04
_LACS_plot.Line_2_terminator_val_y_2 -1.25
_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
23 ILE 2.71 -5.04 0
10 ASN -0.00 0.20 1
11 VAL -0.16 0.04 1
13 VAL -4.18 1.57 1
14 GLU -5.84 3.66 1
15 ALA 2.20 -1.40 1
17 LYS -1.24 0.71 1
18 GLU -4.26 1.74 1
19 TYR -5.43 4.52 1
20 GLU -1.27 0.47 1
21 VAL -6.56 3.05 1
22 THR -0.91 0.38 1
24 GLU -2.00 2.24 1
25 ASP -4.79 3.12 1
26 MET -2.89 1.17 1
28 LYS 2.27 -0.63 1
31 ASP 0.94 -1.08 1
33 ILE -1.82 1.90 1
34 ALA -7.45 4.25 1
35 ARG -6.57 5.52 1
36 ILE -1.26 0.90 1
37 ASP 2.52 -1.63 1
39 PHE -2.14 2.09 1
40 VAL 2.34 -0.32 1
41 VAL -3.89 1.71 1
42 PHE -2.47 1.80 1
43 VAL -3.35 1.76 1
45 ASN 3.16 -1.39 1
46 ALA -4.14 2.72 1
47 GLU -3.07 1.53 1
48 LYS 3.43 -0.46 1
50 SER -0.18 1.00 1
51 VAL 0.50 -0.74 1
52 ILE -6.81 5.01 1
53 ASN -1.72 1.19 1
54 VAL -6.64 2.54 1
55 LYS -4.32 2.29 1
56 VAL 2.90 -1.16 1
57 THR 0.98 -0.52 1
58 ALA -2.72 3.12 1
59 VAL 0.28 0.78 1
60 LYS -1.38 -1.00 1
61 GLU 4.05 -0.43 1
62 LYS -1.35 0.40 1
63 PHE -2.66 0.84 1
64 ALA -8.11 5.23 1
65 PHE -3.58 3.05 1
66 ALA -7.51 5.73 1
67 GLU -6.66 3.38 1
68 ARG 1.76 0.03 1
69 VAL -0.37 0.18 1
70 LEU 0.07 0.02 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr6574_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -8.11
_LACS_plot.Line_1_terminator_val_y_1 0.95
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.08
_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 4.04
_LACS_plot.Line_2_terminator_val_y_2 -0.26
_LACS_plot.Y_axis_chem_shift_offset -0.12
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
51 VAL 0.50 0.96 0
10 ASN -0.00 -0.02 1
11 VAL -0.16 -0.17 1
13 VAL -4.18 0.26 1
14 GLU -5.84 0.13 1
15 ALA 2.20 -0.43 1
17 LYS -1.24 0.18 1
18 GLU -4.26 1.34 1
19 TYR -5.43 0.12 1
20 GLU -1.27 0.77 1
21 VAL -6.56 0.84 1
22 THR -0.91 0.84 1
23 ILE 2.71 -0.02 1
24 GLU -2.00 0.22 1
25 ASP -4.79 0.22 1
26 MET -2.89 0.85 1
28 LYS 2.27 -0.13 1
31 ASP 0.94 0.18 1
33 ILE -1.82 0.54 1
34 ALA -7.45 0.66 1
35 ARG -6.57 0.88 1
36 ILE -1.26 0.00 1
37 ASP 2.52 -0.35 1
39 PHE -2.14 -0.02 1
40 VAL 2.34 -0.29 1
41 VAL -3.89 0.34 1
42 PHE -2.47 0.75 1
43 VAL -3.35 0.69 1
45 ASN 3.16 -0.35 1
46 ALA -4.14 0.33 1
47 GLU -3.07 0.15 1
48 LYS 3.43 -0.65 1
50 SER -0.18 -0.03 1
52 ILE -6.81 0.71 1
53 ASN -1.72 0.89 1
54 VAL -6.64 1.20 1
55 LYS -4.32 0.85 1
56 VAL 2.90 0.15 1
57 THR 0.98 0.26 1
58 ALA -2.72 0.40 1
59 VAL 0.28 0.23 1
60 LYS -1.38 0.44 1
61 GLU 4.05 -0.33 1
62 LYS -1.35 0.04 1
63 PHE -2.66 0.02 1
64 ALA -8.11 0.94 1
65 PHE -3.58 0.97 1
66 ALA -7.51 1.10 1
67 GLU -6.66 0.74 1
68 ARG 1.76 0.03 1
69 VAL -0.37 0.08 1
70 LEU 0.07 0.08 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr6574_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -8.11
_LACS_plot.Line_1_terminator_val_y_1 -2.67
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 0.05
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.00
_LACS_plot.Line_2_terminator_val_x_2 4.04
_LACS_plot.Line_2_terminator_val_y_2 0.47
_LACS_plot.Y_axis_chem_shift_offset 0.50
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
40 VAL 2.34 -2.86 0
10 ASN -0.00 -0.52 1
11 VAL -0.16 0.50 1
13 VAL -4.18 -2.82 1
14 GLU -5.84 -1.83 1
15 ALA 2.20 0.56 1
17 LYS -1.24 -2.38 1
18 GLU -4.26 -0.63 1
19 TYR -5.43 -1.93 1
20 GLU -1.27 -0.16 1
21 VAL -6.56 -2.56 1
22 THR -0.91 0.37 1
23 ILE 2.71 -0.06 1
24 GLU -2.00 -1.66 1
25 ASP -4.79 -3.30 1
26 MET -2.89 0.40 1
28 LYS 2.27 1.63 1
31 ASP 0.94 -0.36 1
33 ILE -1.82 -1.97 1
34 ALA -7.45 -2.75 1
35 ARG -6.57 0.08 1
36 ILE -1.26 -1.09 1
37 ASP 2.52 -0.30 1
39 PHE -2.14 -0.78 1
41 VAL -3.89 -2.12 1
42 PHE -2.47 0.67 1
43 VAL -3.35 -1.02 1
45 ASN 3.16 -1.70 1
46 ALA -4.14 -2.24 1
47 GLU -3.07 0.50 1
48 LYS 3.43 0.27 1
50 SER -0.18 -2.85 1
51 VAL 0.50 0.84 1
52 ILE -6.81 -2.92 1
53 ASN -1.72 0.36 1
54 VAL -6.64 -3.16 1
55 LYS -4.32 0.32 1
56 VAL 2.90 0.60 1
57 THR 0.98 0.93 1
58 ALA -2.72 -2.70 1
59 VAL 0.28 -1.14 1
60 LYS -1.38 -1.36 1
61 GLU 4.05 1.27 1
62 LYS -1.35 -1.37 1
63 PHE -2.66 -3.07 1
64 ALA -8.11 -3.13 1
65 PHE -3.58 -0.55 1
66 ALA -7.51 -3.31 1
67 GLU -6.66 -0.63 1
68 ARG 1.76 -0.12 1
69 VAL -0.37 -0.45 1
70 LEU 0.07 -0.62 1
stop_
save_