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 bmr5204_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -3.70
_LACS_plot.Line_1_terminator_val_y_1 -1.88
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 1.11
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.41
_LACS_plot.Line_2_terminator_val_x_2 3.30
_LACS_plot.Line_2_terminator_val_y_2 2.43
_LACS_plot.Y_axis_chem_shift_offset -0.05
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
37 HIS -3.10 -0.80 0
48 ASP -0.20 -1.30 0
10 ALA -0.10 -0.10 1
11 LYS 0.00 -0.10 1
13 GLU 0.90 0.70 1
14 ASP 0.60 -0.30 1
15 TRP 0.70 0.50 1
16 ASP 0.30 0.10 1
17 GLU 0.80 0.50 1
18 ARG 0.80 0.30 1
19 ALA 0.30 0.20 1
20 LYS 0.00 -0.10 1
21 ILE 0.00 0.00 1
22 ASP -0.10 -0.10 1
23 ASP -0.30 0.00 1
25 THR 0.80 0.70 1
26 ASP -0.10 0.00 1
27 SER -0.60 -0.30 1
28 LYS 0.00 -0.20 1
30 GLU 1.20 1.00 1
31 ASP 0.40 -0.10 1
32 TRP 0.90 1.00 1
33 ASP 0.70 0.10 1
34 LYS -1.20 -0.80 1
36 GLU 1.60 1.50 1
38 ILE -1.50 -0.50 1
40 ASP -1.00 -0.30 1
42 ASP -0.30 0.10 1
43 ALA -0.50 0.20 1
44 LYS -3.10 -1.80 1
47 GLU 2.30 1.90 1
49 TRP 0.90 1.00 1
50 ASP -2.20 -1.50 1
51 GLU 2.60 2.20 1
52 GLU 2.60 2.20 1
53 MET 0.00 0.50 1
54 ASP 0.70 0.80 1
56 GLU -0.20 0.00 1
57 TRP 3.30 1.70 1
58 GLU -3.70 -1.80 1
61 VAL -1.60 -1.10 1
62 ILE -3.50 -1.20 1
63 GLN 0.90 0.50 1
64 ASN -1.70 -0.80 1
66 GLU -0.60 -0.40 1
67 TYR 0.70 0.50 1
68 LYS -0.40 -0.50 1
70 GLU -0.70 -0.20 1
71 TRP 1.00 0.40 1
72 LYS -1.30 -0.80 1
74 ARG 0.90 1.30 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr5204_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -3.70
_LACS_plot.Line_1_terminator_val_y_1 1.82
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.89
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.59
_LACS_plot.Line_2_terminator_val_x_2 3.30
_LACS_plot.Line_2_terminator_val_y_2 -0.87
_LACS_plot.Y_axis_chem_shift_offset -0.05
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
37 HIS -3.10 2.30 0
48 ASP -0.20 -1.10 0
10 ALA -0.10 0.00 1
11 LYS 0.00 -0.10 1
13 GLU 0.90 -0.20 1
14 ASP 0.60 -0.90 1
15 TRP 0.70 -0.20 1
16 ASP 0.30 -0.20 1
17 GLU 0.80 -0.30 1
18 ARG 0.80 -0.50 1
19 ALA 0.30 -0.10 1
20 LYS 0.00 -0.10 1
21 ILE 0.00 0.00 1
22 ASP -0.10 0.00 1
23 ASP -0.30 0.30 1
25 THR 0.80 -0.10 1
26 ASP -0.10 0.10 1
27 SER -0.60 0.30 1
28 LYS 0.00 -0.20 1
30 GLU 1.20 -0.20 1
31 ASP 0.40 -0.50 1
32 TRP 0.90 0.10 1
33 ASP 0.70 -0.60 1
34 LYS -1.20 0.40 1
36 GLU 1.60 -0.10 1
38 ILE -1.50 1.00 1
40 ASP -1.00 0.70 1
42 ASP -0.30 0.40 1
43 ALA -0.50 0.70 1
44 LYS -3.10 1.30 1
47 GLU 2.30 -0.40 1
49 TRP 0.90 0.10 1
50 ASP -2.20 0.70 1
51 GLU 2.60 -0.40 1
52 GLU 2.60 -0.40 1
53 MET 0.00 0.50 1
54 ASP 0.70 0.10 1
56 GLU -0.20 0.20 1
57 TRP 3.30 -1.60 1
58 GLU -3.70 1.90 1
61 VAL -1.60 0.50 1
62 ILE -3.50 2.30 1
63 GLN 0.90 -0.40 1
64 ASN -1.70 0.90 1
66 GLU -0.60 0.20 1
67 TYR 0.70 -0.20 1
68 LYS -0.40 -0.10 1
70 GLU -0.70 0.50 1
71 TRP 1.00 -0.60 1
72 LYS -1.30 0.50 1
74 ARG 0.90 0.40 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr5204_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -3.70
_LACS_plot.Line_1_terminator_val_y_1 0.29
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.33
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.10
_LACS_plot.Line_2_terminator_val_x_2 3.30
_LACS_plot.Line_2_terminator_val_y_2 -0.47
_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
58 GLU -3.70 -0.45 0
10 ALA -0.10 -0.08 1
11 LYS 0.00 -0.11 1
13 GLU 0.90 -0.23 1
14 ASP 0.60 -0.09 1
15 TRP 0.70 -0.18 1
16 ASP 0.30 -0.23 1
17 GLU 0.80 -0.31 1
18 ARG 0.80 -0.18 1
19 ALA 0.30 -0.13 1
20 LYS 0.00 -0.06 1
21 ILE 0.00 -0.04 1
22 ASP -0.10 -0.09 1
23 ASP -0.30 -0.08 1
25 THR 0.80 -0.09 1
26 ASP -0.10 0.02 1
27 SER -0.60 -0.10 1
28 LYS 0.00 -0.82 1
30 GLU 1.20 -0.27 1
31 ASP 0.40 -0.07 1
32 TRP 0.90 -0.31 1
33 ASP 0.70 -0.16 1
34 LYS -1.20 -0.08 1
36 GLU 1.60 -0.89 1
37 HIS -3.10 0.34 1
38 ILE -1.50 0.21 1
40 ASP -1.00 -0.40 1
42 ASP -0.30 0.05 1
43 ALA -0.50 -0.01 1
44 LYS -3.10 -0.03 1
47 GLU 2.30 -0.35 1
48 ASP -0.20 -0.03 1
49 TRP 0.90 -0.53 1
50 ASP -2.20 0.10 1
51 GLU 2.60 -0.07 1
52 GLU 2.60 -0.31 1
53 MET 0.00 -0.07 1
54 ASP 0.70 -0.07 1
56 GLU -0.20 0.06 1
57 TRP 3.30 -0.75 1
61 VAL -1.60 0.30 1
62 ILE -3.50 0.34 1
63 GLN 0.90 -0.16 1
64 ASN -1.70 -0.37 1
66 GLU -0.60 -0.19 1
67 TYR 0.70 -0.27 1
68 LYS -0.40 -0.18 1
70 GLU -0.70 -0.02 1
71 TRP 1.00 -0.37 1
72 LYS -1.30 -0.35 1
74 ARG 0.90 -0.31 1
stop_
save_