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 bmr11274_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -1.67
_LACS_plot.Line_1_terminator_val_y_1 -1.14
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 2.24
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.07
_LACS_plot.Line_2_terminator_val_x_2 7.19
_LACS_plot.Line_2_terminator_val_y_2 5.69
_LACS_plot.Y_axis_chem_shift_offset -0.40
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
46 TRP 7.10 2.12 0
10 GLU 0.09 0.21 1
11 GLU -0.49 -0.11 1
12 ARG -0.21 0.00 1
13 ASP 0.27 0.22 1
14 LEU -1.41 -0.54 1
15 THR -1.67 -0.70 1
16 GLN 5.60 3.85 1
17 GLU 3.20 2.88 1
18 GLN 4.37 3.36 1
19 THR 7.20 6.02 1
20 GLU 3.92 3.31 1
21 LYS 3.18 4.16 1
22 LEU 4.40 4.28 1
23 LEU 3.99 3.05 1
24 GLN 4.10 3.40 1
25 PHE 3.60 4.56 1
26 GLN 5.27 4.98 1
27 ASP 3.18 3.38 1
28 LEU 0.85 2.13 1
29 THR -0.80 0.85 1
31 ILE 1.88 1.50 1
32 GLU 1.47 2.18 1
33 SER -1.05 -1.64 1
34 MET 4.29 3.48 1
35 ASP 3.83 3.35 1
36 GLN 4.00 3.08 1
38 ARG 5.25 4.15 1
39 HIS 4.01 4.59 1
40 THR 5.97 4.86 1
41 LEU 6.00 3.34 1
42 GLU 4.16 3.31 1
43 GLN 3.38 2.24 1
44 HIS 0.30 1.25 1
45 ASN 3.79 1.99 1
47 ASN -0.69 -0.79 1
48 ILE 4.49 4.05 1
49 GLU 4.78 3.80 1
50 ALA 2.36 1.78 1
51 ALA 1.93 2.09 1
52 VAL 5.01 4.04 1
53 GLN 3.53 2.52 1
54 ASP 1.70 1.98 1
55 ARG 2.24 1.37 1
56 LEU 2.26 1.49 1
57 ASN 1.50 1.18 1
58 GLU 0.46 0.84 1
59 GLN 0.51 0.69 1
60 GLU 0.22 0.60 1
62 SER 1.29 2.10 1
65 SER -0.10 0.09 1
66 SER -0.10 0.09 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11274_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -1.67
_LACS_plot.Line_1_terminator_val_y_1 0.53
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 0.24
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.93
_LACS_plot.Line_2_terminator_val_x_2 7.19
_LACS_plot.Line_2_terminator_val_y_2 -1.50
_LACS_plot.Y_axis_chem_shift_offset -0.40
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
46 TRP 7.10 -4.98 0
10 GLU 0.09 0.12 1
11 GLU -0.49 0.38 1
12 ARG -0.21 0.21 1
13 ASP 0.27 -0.05 1
14 LEU -1.41 0.87 1
15 THR -1.67 0.97 1
16 GLN 5.60 -1.75 1
17 GLU 3.20 -0.32 1
18 GLN 4.37 -1.01 1
19 THR 7.20 -1.18 1
20 GLU 3.92 -0.61 1
21 LYS 3.18 0.98 1
22 LEU 4.40 -0.12 1
23 LEU 3.99 -0.94 1
24 GLN 4.10 -0.70 1
25 PHE 3.60 0.96 1
26 GLN 5.27 -0.29 1
27 ASP 3.18 0.20 1
28 LEU 0.85 1.28 1
29 THR -0.80 1.65 1
31 ILE 1.88 -0.38 1
32 GLU 1.47 0.71 1
33 SER -1.05 -0.59 1
34 MET 4.29 -0.81 1
35 ASP 3.83 -0.48 1
36 GLN 4.00 -0.92 1
38 ARG 5.25 -1.10 1
39 HIS 4.01 0.58 1
40 THR 5.97 -1.11 1
41 LEU 6.00 -2.66 1
42 GLU 4.16 -0.85 1
43 GLN 3.38 -1.14 1
44 HIS 0.30 0.95 1
45 ASN 3.79 -1.80 1
47 ASN -0.69 -0.10 1
48 ILE 4.49 -0.44 1
49 GLU 4.78 -0.98 1
50 ALA 2.36 -0.58 1
51 ALA 1.93 0.16 1
52 VAL 5.01 -0.97 1
53 GLN 3.53 -1.01 1
54 ASP 1.70 0.28 1
55 ARG 2.24 -0.87 1
56 LEU 2.26 -0.77 1
57 ASN 1.50 -0.32 1
58 GLU 0.46 0.38 1
59 GLN 0.51 0.18 1
60 GLU 0.22 0.38 1
62 SER 1.29 0.81 1
65 SER -0.10 0.19 1
66 SER -0.10 0.19 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11274_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -1.67
_LACS_plot.Line_1_terminator_val_y_1 0.07
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.22
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.09
_LACS_plot.Line_2_terminator_val_x_2 7.19
_LACS_plot.Line_2_terminator_val_y_2 -0.62
_LACS_plot.Y_axis_chem_shift_offset 0.06
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
51 ALA 1.93 -1.45 0
10 GLU 0.09 -0.11 1
11 GLU -0.49 -0.06 1
12 ARG -0.21 0.01 1
13 ASP 0.27 -0.07 1
14 LEU -1.41 0.11 1
15 THR -1.67 -0.05 1
16 GLN 5.60 -0.32 1
17 GLU 3.20 -0.31 1
18 GLN 4.37 -0.83 1
19 THR 7.20 -0.56 1
20 GLU 3.92 -0.32 1
21 LYS 3.18 -0.10 1
22 LEU 4.40 -0.38 1
23 LEU 3.99 -0.20 1
24 GLN 4.10 -0.15 1
25 PHE 3.60 -0.58 1
26 GLN 5.27 -0.55 1
27 ASP 3.18 -0.30 1
28 LEU 0.85 -0.23 1
29 THR -0.80 -0.18 1
31 ILE 1.88 -0.43 1
32 GLU 1.47 -0.43 1
33 SER -1.05 0.12 1
34 MET 4.29 -0.30 1
35 ASP 3.83 -0.32 1
36 GLN 4.00 -0.20 1
38 ARG 5.25 -0.81 1
39 HIS 4.01 -0.44 1
40 THR 5.97 -0.41 1
41 LEU 6.00 -1.14 1
42 GLU 4.16 -1.06 1
43 GLN 3.38 -0.47 1
44 HIS 0.30 -0.19 1
45 ASN 3.79 -0.25 1
46 TRP 7.10 -1.56 1
47 ASN -0.69 0.19 1
48 ILE 4.49 -0.67 1
49 GLU 4.78 -0.45 1
50 ALA 2.36 -0.30 1
52 VAL 5.01 -0.56 1
53 GLN 3.53 -0.37 1
54 ASP 1.70 -0.13 1
55 ARG 2.24 -0.07 1
56 LEU 2.26 -0.14 1
57 ASN 1.50 -0.11 1
58 GLU 0.46 -0.13 1
59 GLN 0.51 -0.05 1
60 GLU 0.22 -0.08 1
65 SER -0.10 0.05 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11274_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -1.67
_LACS_plot.Line_1_terminator_val_y_1 0.23
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 1.30
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.24
_LACS_plot.Line_2_terminator_val_x_2 7.19
_LACS_plot.Line_2_terminator_val_y_2 2.63
_LACS_plot.Y_axis_chem_shift_offset -0.74
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
46 TRP 7.10 -3.24 0
10 GLU 0.09 -0.01 1
11 GLU -0.49 -0.18 1
12 ARG -0.21 -0.36 1
13 ASP 0.27 -0.10 1
14 LEU -1.41 0.93 1
15 THR -1.67 1.36 1
16 GLN 5.60 2.14 1
17 GLU 3.20 2.61 1
18 GLN 4.37 1.97 1
19 THR 7.20 1.40 1
20 GLU 3.92 3.40 1
21 LYS 3.18 1.61 1
22 LEU 4.40 1.17 1
23 LEU 3.99 2.62 1
24 GLN 4.10 2.65 1
25 PHE 3.60 2.90 1
26 GLN 5.27 2.28 1
27 ASP 3.18 2.16 1
28 LEU 0.85 1.53 1
29 THR -0.80 1.79 1
31 ILE 1.88 -0.15 1
32 GLU 1.47 0.43 1
33 SER -1.05 1.65 1
34 MET 4.29 2.25 1
35 ASP 3.83 2.13 1
36 GLN 4.00 3.69 1
38 ARG 5.25 0.65 1
39 HIS 4.01 3.70 1
40 THR 5.97 1.94 1
41 LEU 6.00 2.04 1
42 GLU 4.16 4.06 1
43 GLN 3.38 0.54 1
44 HIS 0.30 1.06 1
45 ASN 3.79 -1.08 1
47 ASN -0.69 -0.28 1
48 ILE 4.49 -0.15 1
49 GLU 4.78 2.53 1
50 ALA 2.36 1.94 1
51 ALA 1.93 1.65 1
52 VAL 5.01 1.57 1
53 GLN 3.53 1.51 1
54 ASP 1.70 1.19 1
55 ARG 2.24 1.57 1
56 LEU 2.26 0.81 1
57 ASN 1.50 1.03 1
58 GLU 0.46 0.62 1
59 GLN 0.51 0.54 1
60 GLU 0.22 0.72 1
62 SER 1.29 1.70 1
65 SER -0.10 0.15 1
66 SER -0.10 -0.53 1
stop_
save_