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 bmr11139_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -5.77
_LACS_plot.Line_1_terminator_val_y_1 -4.85
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -1.20
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -3.70
_LACS_plot.Line_2_terminator_val_x_2 6.49
_LACS_plot.Line_2_terminator_val_y_2 2.84
_LACS_plot.Y_axis_chem_shift_offset 2.15
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
19 ALA -5.77 -3.61 0
28 HIS 3.89 3.44 0
10 VAL 1.41 -1.47 1
11 ALA 0.62 -1.88 1
12 ARG 0.77 -1.85 1
13 LEU 0.50 -1.96 1
14 GLN 0.29 -2.08 1
15 THR 0.30 -2.03 1
16 GLN -0.85 -2.35 1
17 ALA -2.92 -3.38 1
18 SER -3.94 -3.45 1
20 THR -3.34 -4.06 1
21 VAL -4.43 -4.52 1
22 ALA -1.69 -3.63 1
23 ILE -1.94 -3.52 1
25 LYS 1.80 -0.23 1
26 GLU 3.50 -0.39 1
27 HIS -4.24 -3.15 1
29 ARG 4.71 0.04 1
30 PHE 3.13 -0.18 1
31 VAL 3.62 -0.08 1
32 ILE 2.49 1.30 1
34 LYS 3.20 -0.18 1
35 ASN 0.96 -1.66 1
37 GLU 3.42 0.27 1
38 LYS 4.13 -0.77 1
39 LEU 2.50 0.69 1
40 GLN 3.79 0.90 1
41 ASP 2.50 1.07 1
42 LEU 2.93 0.80 1
43 GLU 3.55 1.70 1
44 LEU 3.09 0.42 1
45 LYS 2.66 0.31 1
46 THR -0.32 -2.12 1
47 ALA 2.77 -1.95 1
48 THR -4.99 -4.33 1
49 LYS -3.14 -4.96 1
50 ILE -0.58 -2.44 1
51 GLN -2.37 -3.32 1
52 ILE -1.49 -3.42 1
54 ARG 1.76 -0.86 1
56 ASP 0.74 -3.30 1
57 ASP -3.96 -4.26 1
59 SER 0.01 -1.77 1
60 ASN -0.03 -3.43 1
61 GLN 0.02 -1.74 1
62 ILE -1.22 -2.55 1
63 LYS -2.90 -3.31 1
64 ILE -2.66 -2.69 1
65 THR -2.70 -3.29 1
67 THR -2.14 -3.17 1
68 LYS 5.34 2.08 1
69 GLU 3.84 0.78 1
71 ILE 5.38 2.20 1
72 GLU 3.34 0.21 1
73 LYS 3.42 0.88 1
74 ALA 3.46 1.05 1
75 ARG 4.89 1.94 1
76 HIS 3.74 2.66 1
77 GLU 2.93 0.16 1
78 VAL 6.49 2.78 1
79 LEU 4.48 0.73 1
80 LEU 3.65 0.71 1
81 ILE 4.55 1.64 1
82 SER 2.09 -0.37 1
83 ALA 3.36 0.05 1
84 GLU 2.48 -0.46 1
85 GLN 3.50 -1.89 1
86 ASP 1.80 -0.58 1
87 LYS 1.62 -1.31 1
88 ARG 0.89 -1.73 1
89 SER 0.02 -2.16 1
92 SER 0.04 -2.26 1
93 SER -0.14 -2.28 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11139_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -5.77
_LACS_plot.Line_1_terminator_val_y_1 0.92
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -3.20
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.70
_LACS_plot.Line_2_terminator_val_x_2 6.49
_LACS_plot.Line_2_terminator_val_y_2 -3.65
_LACS_plot.Y_axis_chem_shift_offset 2.15
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
19 ALA -5.77 2.16 0
28 HIS 3.89 -0.45 0
10 VAL 1.41 -2.88 1
11 ALA 0.62 -2.50 1
12 ARG 0.77 -2.62 1
13 LEU 0.50 -2.46 1
14 GLN 0.29 -2.37 1
15 THR 0.30 -2.33 1
16 GLN -0.85 -1.50 1
17 ALA -2.92 -0.46 1
18 SER -3.94 0.49 1
20 THR -3.34 -0.72 1
21 VAL -4.43 -0.09 1
22 ALA -1.69 -1.94 1
23 ILE -1.94 -1.58 1
25 LYS 1.80 -2.03 1
26 GLU 3.50 -3.89 1
27 HIS -4.24 1.09 1
29 ARG 4.71 -4.67 1
30 PHE 3.13 -3.31 1
31 VAL 3.62 -3.70 1
32 ILE 2.49 -1.19 1
34 LYS 3.20 -3.38 1
35 ASN 0.96 -2.62 1
37 GLU 3.42 -3.15 1
38 LYS 4.13 -4.90 1
39 LEU 2.50 -1.81 1
40 GLN 3.79 -2.89 1
41 ASP 2.50 -1.43 1
42 LEU 2.93 -2.13 1
43 GLU 3.55 -1.85 1
44 LEU 3.09 -2.67 1
45 LYS 2.66 -2.35 1
46 THR -0.32 -1.80 1
47 ALA 2.77 -4.72 1
48 THR -4.99 0.66 1
49 LYS -3.14 -1.82 1
50 ILE -0.58 -1.86 1
51 GLN -2.37 -0.95 1
52 ILE -1.49 -1.93 1
54 ARG 1.76 -2.62 1
56 ASP 0.74 -4.04 1
57 ASP -3.96 -0.30 1
59 SER 0.01 -1.78 1
60 ASN -0.03 -3.40 1
61 GLN 0.02 -1.76 1
62 ILE -1.22 -1.33 1
63 LYS -2.90 -0.41 1
64 ILE -2.66 -0.03 1
65 THR -2.70 -0.59 1
67 THR -2.14 -1.03 1
68 LYS 5.34 -3.26 1
69 GLU 3.84 -3.06 1
71 ILE 5.38 -3.18 1
72 GLU 3.34 -3.13 1
73 LYS 3.42 -2.54 1
74 ALA 3.46 -2.41 1
75 ARG 4.89 -2.95 1
76 HIS 3.74 -1.08 1
77 GLU 2.93 -2.77 1
78 VAL 6.49 -3.71 1
79 LEU 4.48 -3.75 1
80 LEU 3.65 -2.94 1
81 ILE 4.55 -2.91 1
82 SER 2.09 -2.46 1
83 ALA 3.36 -3.31 1
84 GLU 2.48 -2.94 1
85 GLN 3.50 -5.39 1
86 ASP 1.80 -2.38 1
87 LYS 1.62 -2.93 1
88 ARG 0.89 -2.62 1
89 SER 0.02 -2.18 1
92 SER 0.04 -2.30 1
93 SER -0.14 -2.14 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11139_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -5.77
_LACS_plot.Line_1_terminator_val_y_1 0.55
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.29
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.14
_LACS_plot.Line_2_terminator_val_x_2 6.49
_LACS_plot.Line_2_terminator_val_y_2 -0.77
_LACS_plot.Y_axis_chem_shift_offset 0.08
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
25 LYS 1.80 -1.67 0
10 VAL 1.41 -0.25 1
11 ALA 0.62 -0.17 1
12 ARG 0.77 -0.17 1
13 LEU 0.50 -0.12 1
14 GLN 0.29 -0.03 1
15 THR 0.30 -0.16 1
16 GLN -0.85 -0.09 1
17 ALA -2.92 0.18 1
18 SER -3.94 1.06 1
19 ALA -5.77 0.33 1
20 THR -3.34 0.98 1
21 VAL -4.43 0.22 1
22 ALA -1.69 0.42 1
23 ILE -1.94 0.22 1
26 GLU 3.50 -0.25 1
27 HIS -4.24 0.46 1
28 HIS 3.89 -0.71 1
29 ARG 4.71 -0.33 1
30 PHE 3.13 -0.38 1
31 VAL 3.62 -0.55 1
32 ILE 2.49 -0.50 1
34 LYS 3.20 -0.37 1
35 ASN 0.96 -0.21 1
37 GLU 3.42 -0.39 1
38 LYS 4.13 -0.11 1
39 LEU 2.50 -0.47 1
40 GLN 3.79 -0.27 1
41 ASP 2.50 -0.27 1
42 LEU 2.93 -0.43 1
43 GLU 3.55 -0.64 1
44 LEU 3.09 -0.24 1
45 LYS 2.66 -0.30 1
46 THR -0.32 -0.16 1
47 ALA 2.77 -0.20 1
48 THR -4.99 0.57 1
49 LYS -3.14 0.39 1
50 ILE -0.58 0.34 1
51 GLN -2.37 0.11 1
52 ILE -1.49 -0.06 1
54 ARG 1.76 -0.31 1
56 ASP 0.74 -0.35 1
57 ASP -3.96 -0.17 1
59 SER 0.01 -0.38 1
60 ASN -0.03 -0.01 1
61 GLN 0.02 -0.01 1
62 ILE -1.22 -0.06 1
63 LYS -2.90 0.62 1
64 ILE -2.66 0.57 1
65 THR -2.70 0.86 1
67 THR -2.14 0.21 1
68 LYS 5.34 -0.59 1
69 GLU 3.84 -0.40 1
71 ILE 5.38 -0.77 1
72 GLU 3.34 -0.45 1
73 LYS 3.42 -0.26 1
74 ALA 3.46 -0.50 1
75 ARG 4.89 -0.90 1
76 HIS 3.74 -0.61 1
77 GLU 2.93 -0.46 1
78 VAL 6.49 -0.73 1
79 LEU 4.48 -0.47 1
80 LEU 3.65 -0.41 1
81 ILE 4.55 -0.64 1
82 SER 2.09 -0.52 1
83 ALA 3.36 -0.23 1
84 GLU 2.48 -0.51 1
85 GLN 3.50 -0.74 1
86 ASP 1.80 -0.17 1
87 LYS 1.62 -0.24 1
88 ARG 0.89 -0.15 1
89 SER 0.02 -0.08 1
92 SER 0.04 -0.08 1
93 SER -0.14 -0.09 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11139_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -5.77
_LACS_plot.Line_1_terminator_val_y_1 -5.12
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -1.27
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -3.21
_LACS_plot.Line_2_terminator_val_x_2 6.49
_LACS_plot.Line_2_terminator_val_y_2 0.79
_LACS_plot.Y_axis_chem_shift_offset 2.27
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
27 HIS -4.24 2.01 0
10 VAL 1.41 -2.28 1
11 ALA 0.62 -2.01 1
12 ARG 0.77 -1.99 1
13 LEU 0.50 -2.30 1
14 GLN 0.29 -2.22 1
15 THR 0.30 -2.70 1
16 GLN -0.85 -3.44 1
17 ALA -2.92 -5.01 1
18 SER -3.94 -3.52 1
19 ALA -5.77 -4.45 1
20 THR -3.34 -2.71 1
21 VAL -4.43 -6.23 1
22 ALA -1.69 -3.68 1
23 ILE -1.94 -5.03 1
25 LYS 1.80 0.16 1
26 GLU 3.50 -2.09 1
28 HIS 3.89 2.10 1
29 ARG 4.71 -0.85 1
30 PHE 3.13 -2.00 1
31 VAL 3.62 -4.39 1
32 ILE 2.49 0.34 1
34 LYS 3.20 -0.80 1
35 ASN 0.96 -2.06 1
37 GLU 3.42 -0.42 1
38 LYS 4.13 -0.94 1
39 LEU 2.50 -1.90 1
40 GLN 3.79 0.14 1
41 ASP 2.50 -0.66 1
42 LEU 2.93 1.03 1
43 GLU 3.55 0.71 1
44 LEU 3.09 0.68 1
45 LYS 2.66 -0.56 1
46 THR -0.32 -3.33 1
47 ALA 2.77 -3.05 1
48 THR -4.99 -2.43 1
49 LYS -3.14 -2.55 1
50 ILE -0.58 -4.30 1
51 GLN -2.37 -4.00 1
52 ILE -1.49 -3.16 1
54 ARG 1.76 -0.47 1
56 ASP 0.74 -3.58 1
57 ASP -3.96 -2.48 1
59 SER 0.01 -1.82 1
60 ASN -0.03 -2.21 1
61 GLN 0.02 -3.53 1
62 ILE -1.22 -4.38 1
63 LYS -2.90 -4.21 1
64 ILE -2.66 -3.91 1
65 THR -2.70 -3.00 1
67 THR -2.14 -1.86 1
68 LYS 5.34 -0.11 1
69 GLU 3.84 0.36 1
71 ILE 5.38 -0.94 1
72 GLU 3.34 0.61 1
73 LYS 3.42 0.17 1
74 ALA 3.46 -1.52 1
75 ARG 4.89 -1.56 1
76 HIS 3.74 1.15 1
77 GLU 2.93 0.54 1
78 VAL 6.49 -1.24 1
79 LEU 4.48 0.68 1
80 LEU 3.65 -0.31 1
81 ILE 4.55 -0.14 1
82 SER 2.09 -0.26 1
83 ALA 3.36 0.63 1
84 GLU 2.48 -0.28 1
85 GLN 3.50 -0.49 1
86 ASP 1.80 -1.27 1
87 LYS 1.62 -1.64 1
88 ARG 0.89 -2.08 1
89 SER 0.02 -2.37 1
92 SER 0.04 -2.25 1
93 SER -0.14 -3.00 1
stop_
save_