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 bmr11269_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -1.43
_LACS_plot.Line_1_terminator_val_y_1 -0.05
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 0.36
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.45
_LACS_plot.Line_2_terminator_val_x_2 7.98
_LACS_plot.Line_2_terminator_val_y_2 6.21
_LACS_plot.Y_axis_chem_shift_offset -0.10
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
48 SER 7.99 5.18 0
47 LEU 5.17 2.21 0
10 ASP -1.43 -1.08 1
11 PHE 4.84 4.01 1
12 GLN 4.36 3.19 1
13 VAL 5.28 4.47 1
14 LEU 4.32 3.72 1
15 HIS 4.35 4.81 1
16 ASP 3.89 3.35 1
17 LEU 2.20 2.91 1
18 ARG 5.11 3.14 1
19 GLN 2.52 1.92 1
20 LYS 0.78 2.09 1
21 PHE 0.42 -0.42 1
23 GLU 0.67 -0.07 1
24 VAL 0.66 0.32 1
26 GLU 4.83 4.54 1
27 VAL 4.32 2.81 1
28 VAL 4.99 3.53 1
29 VAL 6.66 5.38 1
30 SER 5.22 3.94 1
31 ARG 4.68 3.74 1
33 MET 4.97 5.25 1
34 LEU 3.47 2.70 1
35 GLN 2.19 1.92 1
36 ASN -1.01 0.20 1
37 ASN 3.05 1.67 1
38 ASN 3.00 2.20 1
39 ASN 0.17 0.93 1
40 LEU 4.85 4.74 1
41 ASP 4.98 3.99 1
42 ALA 3.03 2.45 1
45 ALA 3.84 2.77 1
46 VAL 3.72 3.41 1
49 GLN 1.05 0.87 1
50 GLU 1.37 1.59 1
51 SER 3.00 2.21 1
52 THR 2.83 1.88 1
53 ARG 2.38 1.77 1
54 TYR 1.16 0.68 1
55 LEU 0.80 0.77 1
56 TYR -0.07 -0.20 1
58 GLU -0.46 0.14 1
60 ASP 0.09 0.29 1
61 LEU 0.52 0.24 1
62 ASN -0.00 0.02 1
63 PHE 0.08 0.14 1
64 SER -0.34 -0.22 1
65 ASP 0.10 0.22 1
66 ASP 0.33 0.12 1
67 SER 1.17 1.12 1
69 ILE 0.25 0.22 1
70 SER 1.11 1.89 1
73 SER 0.18 0.13 1
74 SER -0.31 0.06 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11269_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -1.43
_LACS_plot.Line_1_terminator_val_y_1 1.38
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -1.64
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.55
_LACS_plot.Line_2_terminator_val_x_2 7.98
_LACS_plot.Line_2_terminator_val_y_2 -1.77
_LACS_plot.Y_axis_chem_shift_offset -0.10
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
48 SER 7.99 -2.81 0
47 LEU 5.17 -2.96 0
10 ASP -1.43 0.35 1
11 PHE 4.84 -0.83 1
12 GLN 4.36 -1.17 1
13 VAL 5.28 -0.81 1
14 LEU 4.32 -0.60 1
15 HIS 4.35 0.46 1
16 ASP 3.89 -0.54 1
17 LEU 2.20 0.71 1
18 ARG 5.11 -1.97 1
19 GLN 2.52 -0.60 1
20 LYS 0.78 1.31 1
21 PHE 0.42 -0.84 1
23 GLU 0.67 -0.74 1
24 VAL 0.66 -0.34 1
26 GLU 4.83 -0.29 1
27 VAL 4.32 -1.51 1
28 VAL 4.99 -1.46 1
29 VAL 6.66 -1.28 1
30 SER 5.22 -1.28 1
31 ARG 4.68 -0.94 1
33 MET 4.97 0.28 1
34 LEU 3.47 -0.77 1
35 GLN 2.19 -0.27 1
36 ASN -1.01 1.21 1
37 ASN 3.05 -1.38 1
38 ASN 3.00 -0.80 1
39 ASN 0.17 0.76 1
40 LEU 4.85 -0.11 1
41 ASP 4.98 -0.99 1
42 ALA 3.03 -0.58 1
45 ALA 3.84 -1.07 1
46 VAL 3.72 -0.31 1
49 GLN 1.05 -0.18 1
50 GLU 1.37 0.22 1
51 SER 3.00 -0.79 1
52 THR 2.83 -0.95 1
53 ARG 2.38 -0.61 1
54 TYR 1.16 -0.48 1
55 LEU 0.80 -0.03 1
56 TYR -0.07 -0.13 1
58 GLU -0.46 0.60 1
60 ASP 0.09 0.20 1
61 LEU 0.52 -0.28 1
62 ASN -0.00 0.02 1
63 PHE 0.08 0.06 1
64 SER -0.34 0.12 1
65 ASP 0.10 0.12 1
66 ASP 0.33 -0.21 1
67 SER 1.17 -0.05 1
69 ILE 0.25 -0.03 1
70 SER 1.11 0.78 1
73 SER 0.18 -0.05 1
74 SER -0.31 0.37 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11269_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -1.43
_LACS_plot.Line_1_terminator_val_y_1 0.09
_LACS_plot.Line_1_terminator_val_x_2 2.00
_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 0.13
_LACS_plot.Line_2_terminator_val_x_2 7.98
_LACS_plot.Line_2_terminator_val_y_2 -0.65
_LACS_plot.Y_axis_chem_shift_offset 0.02
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
38 ASN 3.00 -0.95 0
10 ASP -1.43 -0.02 1
11 PHE 4.84 -0.51 1
12 GLN 4.36 -0.24 1
13 VAL 5.28 -0.39 1
14 LEU 4.32 -0.21 1
15 HIS 4.35 -0.61 1
16 ASP 3.89 -0.32 1
17 LEU 2.20 -0.21 1
18 ARG 5.11 -0.38 1
19 GLN 2.52 -0.39 1
20 LYS 0.78 -0.50 1
21 PHE 0.42 0.15 1
23 GLU 0.67 -0.02 1
24 VAL 0.66 -0.35 1
26 GLU 4.83 -0.70 1
27 VAL 4.32 -0.10 1
28 VAL 4.99 -0.54 1
29 VAL 6.66 -0.84 1
30 SER 5.22 -0.30 1
31 ARG 4.68 -0.34 1
33 MET 4.97 -0.63 1
34 LEU 3.47 -0.22 1
35 GLN 2.19 -0.19 1
36 ASN -1.01 0.21 1
37 ASN 3.05 -0.25 1
39 ASN 0.17 -0.06 1
40 LEU 4.85 -0.53 1
41 ASP 4.98 -0.32 1
42 ALA 3.03 -0.16 1
45 ALA 3.84 -0.19 1
46 VAL 3.72 -0.34 1
47 LEU 5.17 -0.60 1
48 SER 7.99 -0.35 1
49 GLN 1.05 0.03 1
50 GLU 1.37 -0.18 1
51 SER 3.00 -0.23 1
52 THR 2.83 -0.18 1
53 ARG 2.38 -0.27 1
54 TYR 1.16 -0.06 1
55 LEU 0.80 -0.18 1
56 TYR -0.07 0.06 1
58 GLU -0.46 -0.08 1
60 ASP 0.09 -0.05 1
61 LEU 0.52 -0.09 1
62 ASN -0.00 -0.11 1
63 PHE 0.08 -0.02 1
64 SER -0.34 -0.05 1
65 ASP 0.10 -0.05 1
66 ASP 0.33 -0.01 1
67 SER 1.17 -0.13 1
69 ILE 0.25 0.05 1
73 SER 0.18 0.02 1
74 SER -0.31 0.01 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11269_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -1.43
_LACS_plot.Line_1_terminator_val_y_1 -0.64
_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 -0.71
_LACS_plot.Line_2_terminator_val_x_2 7.98
_LACS_plot.Line_2_terminator_val_y_2 2.89
_LACS_plot.Y_axis_chem_shift_offset 0.02
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
38 ASN 3.00 -2.09 0
48 SER 7.99 0.78 0
10 ASP -1.43 -0.04 1
11 PHE 4.84 1.91 1
12 GLN 4.36 2.03 1
13 VAL 5.28 1.17 1
14 LEU 4.32 0.16 1
15 HIS 4.35 3.78 1
16 ASP 3.89 3.40 1
17 LEU 2.20 1.66 1
18 ARG 5.11 2.38 1
19 GLN 2.52 1.90 1
20 LYS 0.78 -0.32 1
21 PHE 0.42 -0.64 1
23 GLU 0.67 -0.03 1
24 VAL 0.66 -0.97 1
26 GLU 4.83 1.50 1
27 VAL 4.32 1.02 1
28 VAL 4.99 1.94 1
29 VAL 6.66 1.63 1
30 SER 5.22 1.66 1
31 ARG 4.68 1.85 1
33 MET 4.97 2.50 1
34 LEU 3.47 3.02 1
35 GLN 2.19 0.62 1
36 ASN -1.01 -0.69 1
37 ASN 3.05 -0.98 1
39 ASN 0.17 -0.08 1
40 LEU 4.85 0.67 1
41 ASP 4.98 3.13 1
42 ALA 3.03 3.11 1
45 ALA 3.84 2.11 1
46 VAL 3.72 2.79 1
47 LEU 5.17 0.52 1
49 GLN 1.05 1.18 1
50 GLU 1.37 1.23 1
51 SER 3.00 1.24 1
52 THR 2.83 0.61 1
53 ARG 2.38 0.54 1
54 TYR 1.16 0.36 1
55 LEU 0.80 -0.37 1
56 TYR -0.07 0.38 1
58 GLU -0.46 0.41 1
60 ASP 0.09 0.10 1
61 LEU 0.52 -0.69 1
62 ASN -0.00 -0.47 1
63 PHE 0.08 -0.20 1
64 SER -0.34 -0.62 1
65 ASP 0.10 -0.19 1
66 ASP 0.33 0.44 1
67 SER 1.17 0.86 1
69 ILE 0.25 0.00 1
70 SER 1.11 1.41 1
73 SER 0.18 0.13 1
74 SER -0.31 -0.62 1
stop_
save_