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 bmr17858_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -4.94
_LACS_plot.Line_1_terminator_val_y_1 -3.69
_LACS_plot.Line_1_terminator_val_x_2 1.99
_LACS_plot.Line_1_terminator_val_y_2 1.88
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.36
_LACS_plot.Line_2_terminator_val_x_2 4.11
_LACS_plot.Line_2_terminator_val_y_2 3.17
_LACS_plot.Y_axis_chem_shift_offset -0.20
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
53 GLU -4.94 -1.01 0
10 GLU 1.24 1.15 1
11 GLN -0.81 -0.29 1
13 LYS 3.48 2.57 1
14 PHE 1.52 1.27 1
16 THR 3.06 2.04 1
17 HIS -0.14 0.61 1
19 THR -0.32 -0.51 1
20 ASN -0.75 -0.90 1
21 LYS 3.26 2.45 1
22 ARG 0.18 -1.17 1
24 LYS 0.68 0.85 1
25 TYR -0.46 0.57 1
26 ARG 0.81 2.98 1
27 HIS 0.20 1.91 1
28 ALA 0.14 -0.67 1
29 ARG -0.96 -0.51 1
30 SER -2.73 -1.73 1
31 HIS 1.12 1.95 1
32 ILE 1.27 0.24 1
33 MET 0.30 -0.67 1
35 ARG 4.12 3.47 1
36 GLU 0.44 0.84 1
38 ALA 1.19 1.22 1
39 ASN -0.52 -0.16 1
41 THR 0.17 -0.69 1
42 ARG 0.72 0.42 1
43 ILE 2.26 1.92 1
44 ASP -0.55 -1.47 1
46 LEU -0.56 0.04 1
47 PHE 0.20 0.50 1
49 HIS 0.59 1.11 1
51 ILE -1.49 -0.09 1
52 ASN 1.66 -0.27 1
54 ASP 1.46 1.39 1
56 ARG 3.94 2.61 1
57 PHE 1.22 0.67 1
59 VAL 2.57 1.94 1
60 ASN -0.23 0.22 1
62 LYS -0.66 -0.97 1
63 ASN -0.82 -0.89 1
64 ILE 4.12 3.39 1
65 TYR 0.18 -0.90 1
67 LEU 1.13 0.85 1
68 PHE 1.27 1.54 1
69 ARG 0.01 0.93 1
70 HIS 0.40 2.01 1
74 ARG 0.53 1.02 1
75 VAL -1.17 -0.28 1
76 LEU -1.00 -0.63 1
78 GLU -1.21 -0.08 1
79 LYS 0.20 0.38 1
80 LYS 0.75 1.66 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr17858_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -4.94
_LACS_plot.Line_1_terminator_val_y_1 1.25
_LACS_plot.Line_1_terminator_val_x_2 1.99
_LACS_plot.Line_1_terminator_val_y_2 -0.11
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.64
_LACS_plot.Line_2_terminator_val_x_2 4.11
_LACS_plot.Line_2_terminator_val_y_2 -0.94
_LACS_plot.Y_axis_chem_shift_offset -0.20
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
53 GLU -4.94 3.93 0
10 GLU 1.24 -0.09 1
11 GLN -0.81 0.52 1
13 LYS 3.48 -0.91 1
14 PHE 1.52 -0.25 1
16 THR 3.06 -1.02 1
17 HIS -0.14 0.75 1
19 THR -0.32 -0.19 1
20 ASN -0.75 -0.15 1
21 LYS 3.26 -0.81 1
22 ARG 0.18 -1.35 1
24 LYS 0.68 0.17 1
25 TYR -0.46 1.03 1
26 ARG 0.81 2.17 1
27 HIS 0.20 1.71 1
28 ALA 0.14 -0.81 1
29 ARG -0.96 0.45 1
30 SER -2.73 1.00 1
31 HIS 1.12 0.83 1
32 ILE 1.27 -1.03 1
33 MET 0.30 -0.97 1
35 ARG 4.12 -0.65 1
36 GLU 0.44 0.40 1
38 ALA 1.19 0.03 1
39 ASN -0.52 0.36 1
41 THR 0.17 -0.86 1
42 ARG 0.72 -0.30 1
43 ILE 2.26 -0.34 1
44 ASP -0.55 -0.92 1
46 LEU -0.56 0.60 1
47 PHE 0.20 0.30 1
49 HIS 0.59 0.52 1
51 ILE -1.49 1.40 1
52 ASN 1.66 -1.93 1
54 ASP 1.46 -0.07 1
56 ARG 3.94 -1.33 1
57 PHE 1.22 -0.55 1
59 VAL 2.57 -0.63 1
60 ASN -0.23 0.45 1
62 LYS -0.66 -0.31 1
63 ASN -0.82 -0.07 1
64 ILE 4.12 -0.73 1
65 TYR 0.18 -1.08 1
67 LEU 1.13 -0.28 1
68 PHE 1.27 0.27 1
69 ARG 0.01 0.92 1
70 HIS 0.40 1.61 1
74 ARG 0.53 0.49 1
75 VAL -1.17 0.89 1
76 LEU -1.00 0.37 1
78 GLU -1.21 1.13 1
79 LYS 0.20 0.18 1
80 LYS 0.75 0.91 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr17858_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -4.94
_LACS_plot.Line_1_terminator_val_y_1 0.19
_LACS_plot.Line_1_terminator_val_x_2 1.99
_LACS_plot.Line_1_terminator_val_y_2 -0.27
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -0.01
_LACS_plot.Line_2_terminator_val_x_2 4.11
_LACS_plot.Line_2_terminator_val_y_2 -0.42
_LACS_plot.Y_axis_chem_shift_offset 0.14
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
53 GLU -4.94 -0.03 0
10 GLU 1.24 -0.55 1
11 GLN -0.81 -0.57 1
13 LYS 3.48 -0.51 1
14 PHE 1.52 -0.01 1
16 THR 3.06 -0.35 1
17 HIS -0.14 -0.15 1
19 THR -0.32 0.00 1
20 ASN -0.75 -0.05 1
21 LYS 3.26 -0.40 1
22 ARG 0.18 -0.07 1
24 LYS 0.68 -0.02 1
25 TYR -0.46 0.02 1
26 ARG 0.81 0.09 1
27 HIS 0.20 -0.18 1
28 ALA 0.14 -0.21 1
29 ARG -0.96 -0.06 1
30 SER -2.73 -0.01 1
31 HIS 1.12 -0.45 1
32 ILE 1.27 -0.66 1
33 MET 0.30 -0.43 1
35 ARG 4.12 -0.45 1
36 GLU 0.44 -0.07 1
38 ALA 1.19 -0.14 1
39 ASN -0.52 -0.08 1
41 THR 0.17 0.06 1
42 ARG 0.72 -0.01 1
43 ILE 2.26 -0.56 1
44 ASP -0.55 -0.09 1
46 LEU -0.56 0.32 1
47 PHE 0.20 -0.09 1
49 HIS 0.59 -0.31 1
51 ILE -1.49 -0.38 1
52 ASN 1.66 -0.10 1
54 ASP 1.46 -0.19 1
56 ARG 3.94 -0.46 1
57 PHE 1.22 -0.06 1
59 VAL 2.57 -0.45 1
60 ASN -0.23 -0.07 1
62 LYS -0.66 -0.01 1
63 ASN -0.82 -0.14 1
64 ILE 4.12 -0.63 1
65 TYR 0.18 -0.01 1
67 LEU 1.13 0.01 1
68 PHE 1.27 -0.04 1
69 ARG 0.01 -0.01 1
70 HIS 0.40 -0.04 1
74 ARG 0.53 -0.12 1
75 VAL -1.17 -0.07 1
76 LEU -1.00 -0.22 1
78 GLU -1.21 -0.26 1
79 LYS 0.20 -0.15 1
80 LYS 0.75 -0.28 1
stop_
save_