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 bmr4593_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -2.11
_LACS_plot.Line_1_terminator_val_y_1 -0.50
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 0.67
_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 9.12
_LACS_plot.Line_2_terminator_val_y_2 7.30
_LACS_plot.Y_axis_chem_shift_offset -0.13
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
48 ILE 4.29 0.87 0
10 SER -0.56 -0.17 1
11 PHE 5.70 5.23 1
12 VAL 5.20 4.16 1
13 ASP 4.80 3.45 1
14 PHE 2.16 1.82 1
15 ALA 4.51 2.79 1
16 ASN 3.69 3.29 1
17 ARG 3.67 3.92 1
18 LEU 3.59 2.82 1
19 ILE 6.32 5.40 1
20 LYS 3.93 3.22 1
21 ALA 3.18 2.42 1
22 VAL 5.58 4.49 1
23 GLU 3.69 2.94 1
25 SER -1.27 0.38 1
26 ASP 0.51 -0.42 1
27 LEU -0.30 0.67 1
30 SER 3.26 2.20 1
31 ALA -2.11 -0.46 1
32 ARG 4.99 4.88 1
33 ALA 9.12 6.76 1
35 VAL 5.17 4.19 1
36 ILE 5.52 4.96 1
37 ILE 6.03 4.68 1
38 ASP 3.56 3.88 1
40 PHE 3.97 2.25 1
41 ARG 3.50 4.16 1
42 GLN -1.08 1.39 1
43 LYS -1.04 -1.08 1
44 SER -1.92 -0.56 1
45 GLN 2.35 1.84 1
47 ASP 4.77 2.59 1
49 GLN 5.21 4.81 1
50 GLN 4.39 3.18 1
51 LEU 2.14 2.62 1
52 ILE 5.41 4.48 1
53 ARG 3.58 3.29 1
54 THR -0.88 -0.59 1
55 ALA 1.38 0.50 1
57 SER 1.58 1.25 1
58 THR 1.67 0.44 1
59 LEU 1.10 -0.72 1
60 THR -0.45 0.37 1
61 THR -1.17 -1.38 1
64 GLU 1.43 2.39 1
65 ILE 4.93 3.38 1
66 ILE 5.49 5.60 1
67 LYS 3.97 3.56 1
68 TYR 3.47 3.80 1
69 VAL 5.97 4.70 1
70 LEU 4.26 3.07 1
71 ASP 3.19 2.68 1
72 ARG 1.30 0.65 1
73 GLN 1.68 1.59 1
74 LYS 1.16 0.92 1
75 THR -0.17 0.01 1
76 ALA 0.23 0.50 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr4593_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -2.11
_LACS_plot.Line_1_terminator_val_y_1 1.61
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -1.33
_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 9.12
_LACS_plot.Line_2_terminator_val_y_2 -1.82
_LACS_plot.Y_axis_chem_shift_offset -0.13
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
48 ILE 4.29 -3.42 0
10 SER -0.56 0.39 1
11 PHE 5.70 -0.47 1
12 VAL 5.20 -1.04 1
13 ASP 4.80 -1.35 1
14 PHE 2.16 -0.34 1
15 ALA 4.51 -1.72 1
16 ASN 3.69 -0.40 1
17 ARG 3.67 0.25 1
18 LEU 3.59 -0.77 1
19 ILE 6.32 -0.92 1
20 LYS 3.93 -0.71 1
21 ALA 3.18 -0.76 1
22 VAL 5.58 -1.09 1
23 GLU 3.69 -0.75 1
25 SER -1.27 1.65 1
26 ASP 0.51 -0.93 1
27 LEU -0.30 0.97 1
30 SER 3.26 -1.06 1
31 ALA -2.11 1.65 1
32 ARG 4.99 -0.11 1
33 ALA 9.12 -2.36 1
35 VAL 5.17 -0.98 1
36 ILE 5.52 -0.56 1
37 ILE 6.03 -1.35 1
38 ASP 3.56 0.32 1
40 PHE 3.97 -1.72 1
41 ARG 3.50 0.66 1
42 GLN -1.08 2.47 1
43 LYS -1.04 -0.04 1
44 SER -1.92 1.36 1
45 GLN 2.35 -0.51 1
47 ASP 4.77 -2.18 1
49 GLN 5.21 -0.40 1
50 GLN 4.39 -1.21 1
51 LEU 2.14 0.48 1
52 ILE 5.41 -0.93 1
53 ARG 3.58 -0.29 1
54 THR -0.88 0.29 1
55 ALA 1.38 -0.88 1
57 SER 1.58 -0.33 1
58 THR 1.67 -1.23 1
59 LEU 1.10 -1.82 1
60 THR -0.45 0.82 1
61 THR -1.17 -0.21 1
64 GLU 1.43 0.96 1
65 ILE 4.93 -1.55 1
66 ILE 5.49 0.11 1
67 LYS 3.97 -0.41 1
68 TYR 3.47 0.33 1
69 VAL 5.97 -1.27 1
70 LEU 4.26 -1.19 1
71 ASP 3.19 -0.51 1
72 ARG 1.30 -0.65 1
73 GLN 1.68 -0.09 1
74 LYS 1.16 -0.24 1
75 THR -0.17 0.18 1
76 ALA 0.23 0.27 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr4593_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -2.11
_LACS_plot.Line_1_terminator_val_y_1 0.24
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.17
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.23
_LACS_plot.Line_2_terminator_val_x_2 9.12
_LACS_plot.Line_2_terminator_val_y_2 -0.90
_LACS_plot.Y_axis_chem_shift_offset -0.03
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
33 ALA 9.12 -0.47 0
10 SER -0.56 0.00 1
11 PHE 5.70 -0.29 1
12 VAL 5.20 -0.64 1
13 ASP 4.80 -0.13 1
14 PHE 2.16 -0.11 1
15 ALA 4.51 -0.95 1
16 ASN 3.69 -0.36 1
17 ARG 3.67 -0.30 1
18 LEU 3.59 -0.49 1
19 ILE 6.32 -0.86 1
20 LYS 3.93 -0.31 1
21 ALA 3.18 -0.22 1
22 VAL 5.58 -0.54 1
23 GLU 3.69 -0.40 1
25 SER -1.27 0.17 1
26 ASP 0.51 0.03 1
27 LEU -0.30 -0.26 1
30 SER 3.26 -0.25 1
31 ALA -2.11 0.20 1
32 ARG 4.99 -0.65 1
35 VAL 5.17 -0.31 1
36 ILE 5.52 -1.02 1
37 ILE 6.03 -0.69 1
38 ASP 3.56 -0.15 1
40 PHE 3.97 0.14 1
41 ARG 3.50 -0.27 1
42 GLN -1.08 0.31 1
43 LYS -1.04 0.56 1
44 SER -1.92 0.03 1
45 GLN 2.35 -0.40 1
47 ASP 4.77 -0.31 1
48 ILE 4.29 -0.43 1
49 GLN 5.21 -0.59 1
50 GLN 4.39 -0.30 1
51 LEU 2.14 -0.16 1
52 ILE 5.41 -0.63 1
53 ARG 3.58 -0.17 1
54 THR -0.88 0.11 1
55 ALA 1.38 -0.60 1
57 SER 1.58 -0.19 1
58 THR 1.67 -0.30 1
59 LEU 1.10 0.22 1
60 THR -0.45 0.11 1
61 THR -1.17 0.45 1
64 GLU 1.43 -0.25 1
65 ILE 4.93 -0.38 1
66 ILE 5.49 -0.59 1
67 LYS 3.97 -0.42 1
68 TYR 3.47 -0.43 1
69 VAL 5.97 -1.01 1
70 LEU 4.26 -0.34 1
71 ASP 3.19 -0.24 1
72 ARG 1.30 -0.23 1
73 GLN 1.68 -0.16 1
74 LYS 1.16 -0.01 1
75 THR -0.17 -0.02 1
76 ALA 0.23 -0.01 1
stop_
save_