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 bmr11487_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -5.87
_LACS_plot.Line_1_terminator_val_y_1 -2.55
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 1.13
_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 6.31
_LACS_plot.Line_2_terminator_val_y_2 4.79
_LACS_plot.Y_axis_chem_shift_offset -0.27
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
74 TYR -4.32 0.37 0
10 TYR 1.66 -0.28 1
11 LYS -2.78 -1.32 1
14 GLN -0.95 0.44 1
16 SER 1.25 1.29 1
17 TYR 2.19 2.98 1
18 ALA -5.87 -1.92 1
19 SER -3.35 -1.82 1
20 ALA 0.26 0.80 1
21 ILE -2.49 -1.60 1
22 LYS 5.88 4.21 1
23 ALA 3.36 2.67 1
24 ASN 4.10 2.12 1
25 LEU 5.02 2.85 1
26 ASN 4.86 3.55 1
27 VAL 4.90 4.22 1
28 HIS 6.31 5.13 1
29 LEU 3.15 3.08 1
30 ARG 3.26 2.26 1
31 LYS 3.08 1.56 1
32 HIS 0.76 0.49 1
33 THR 0.98 0.90 1
35 GLU -0.67 -0.11 1
36 LYS -1.89 -0.69 1
37 PHE -0.97 -0.03 1
38 ALA -4.19 -1.83 1
40 ASP 1.65 1.83 1
41 TYR 0.35 -0.15 1
43 SER 1.46 1.38 1
44 PHE 1.12 2.87 1
45 THR -5.44 -2.57 1
47 LEU -0.19 0.41 1
48 SER -3.85 -1.72 1
49 LYS 4.06 2.96 1
51 HIS 0.66 3.36 1
52 LEU 4.01 2.99 1
53 LYS 4.54 3.97 1
54 VAL 4.79 3.89 1
55 HIS 5.88 4.98 1
56 ILE 5.99 5.60 1
57 GLU 2.57 2.40 1
58 ARG 2.13 2.50 1
59 VAL 2.19 1.89 1
60 HIS -0.17 -0.90 1
61 LYS 1.95 1.22 1
62 LYS 0.56 -0.16 1
63 ILE -0.22 -0.17 1
64 LYS -0.33 -0.09 1
65 GLN -1.52 -0.78 1
66 HIS -3.46 -0.03 1
68 ARG 3.39 1.85 1
69 PHE 3.62 1.98 1
71 LYS 5.28 2.00 1
72 LYS 1.28 2.27 1
73 LYS -2.14 -0.44 1
75 SER 1.63 1.60 1
76 ASP -3.73 -1.37 1
77 VAL 4.26 3.36 1
78 LYS 5.27 3.80 1
79 ASN 2.82 2.23 1
80 LEU 4.52 3.09 1
81 ILE 5.08 3.99 1
82 LYS 3.73 3.29 1
83 HIS 5.76 4.29 1
84 ILE 6.10 5.53 1
85 ARG 3.55 2.63 1
86 ASP 2.14 2.26 1
87 ALA -0.31 0.33 1
88 HIS -1.94 -1.01 1
89 ASP 0.66 0.82 1
91 GLN -0.70 -0.31 1
92 ASP 0.45 1.65 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11487_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -5.87
_LACS_plot.Line_1_terminator_val_y_1 3.32
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.87
_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 6.31
_LACS_plot.Line_2_terminator_val_y_2 -1.52
_LACS_plot.Y_axis_chem_shift_offset -0.27
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
74 TYR -4.32 4.69 0
10 TYR 1.66 -1.94 1
11 LYS -2.78 1.46 1
14 GLN -0.95 1.39 1
16 SER 1.25 0.04 1
17 TYR 2.19 0.79 1
18 ALA -5.87 3.95 1
19 SER -3.35 1.53 1
20 ALA 0.26 0.54 1
21 ILE -2.49 0.89 1
22 LYS 5.88 -1.67 1
23 ALA 3.36 -0.69 1
24 ASN 4.10 -1.98 1
25 LEU 5.02 -2.17 1
26 ASN 4.86 -1.31 1
27 VAL 4.90 -0.68 1
28 HIS 6.31 -1.18 1
29 LEU 3.15 -0.07 1
30 ARG 3.26 -1.00 1
31 LYS 3.08 -1.52 1
32 HIS 0.76 -0.27 1
33 THR 0.98 -0.08 1
35 GLU -0.67 0.56 1
36 LYS -1.89 1.20 1
37 PHE -0.97 0.94 1
38 ALA -4.19 2.36 1
40 ASP 1.65 0.18 1
41 TYR 0.35 -0.50 1
43 SER 1.46 -0.08 1
44 PHE 1.12 1.75 1
45 THR -5.44 2.87 1
47 LEU -0.19 0.60 1
48 SER -3.85 2.13 1
49 LYS 4.06 -1.10 1
51 HIS 0.66 2.70 1
52 LEU 4.01 -1.02 1
53 LYS 4.54 -0.57 1
54 VAL 4.79 -0.90 1
55 HIS 5.88 -0.90 1
56 ILE 5.99 -0.39 1
57 GLU 2.57 -0.17 1
58 ARG 2.13 0.37 1
59 VAL 2.19 -0.30 1
60 HIS -0.17 -0.73 1
61 LYS 1.95 -0.73 1
62 LYS 0.56 -0.72 1
63 ILE -0.22 0.05 1
64 LYS -0.33 0.24 1
65 GLN -1.52 0.74 1
66 HIS -3.46 3.43 1
68 ARG 3.39 -1.54 1
69 PHE 3.62 -1.64 1
71 LYS 5.28 -3.28 1
72 LYS 1.28 0.99 1
73 LYS -2.14 1.70 1
75 SER 1.63 -0.03 1
76 ASP -3.73 2.36 1
77 VAL 4.26 -0.90 1
78 LYS 5.27 -1.47 1
79 ASN 2.82 -0.59 1
80 LEU 4.52 -1.43 1
81 ILE 5.08 -1.09 1
82 LYS 3.73 -0.44 1
83 HIS 5.76 -1.47 1
84 ILE 6.10 -0.57 1
85 ARG 3.55 -0.92 1
86 ASP 2.14 0.12 1
87 ALA -0.31 0.64 1
88 HIS -1.94 0.93 1
89 ASP 0.66 0.16 1
91 GLN -0.70 0.39 1
92 ASP 0.45 1.20 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11487_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -5.87
_LACS_plot.Line_1_terminator_val_y_1 0.49
_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 0.17
_LACS_plot.Line_2_terminator_val_x_2 6.31
_LACS_plot.Line_2_terminator_val_y_2 -0.58
_LACS_plot.Y_axis_chem_shift_offset 0.01
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
22 LYS 5.88 -1.30 0
10 TYR 1.66 0.06 1
11 LYS -2.78 0.37 1
14 GLN -0.95 0.10 1
16 SER 1.25 -0.06 1
17 TYR 2.19 -0.59 1
18 ALA -5.87 0.57 1
19 SER -3.35 0.04 1
20 ALA 0.26 0.28 1
21 ILE -2.49 0.29 1
23 ALA 3.36 -0.24 1
24 ASN 4.10 -0.22 1
25 LEU 5.02 0.06 1
26 ASN 4.86 -0.34 1
27 VAL 4.90 -0.51 1
28 HIS 6.31 -0.91 1
29 LEU 3.15 -0.51 1
30 ARG 3.26 -0.26 1
31 LYS 3.08 -0.37 1
32 HIS 0.76 0.01 1
33 THR 0.98 -0.04 1
35 GLU -0.67 -0.25 1
36 LYS -1.89 0.06 1
37 PHE -0.97 -0.10 1
38 ALA -4.19 0.58 1
40 ASP 1.65 -0.22 1
41 TYR 0.35 -0.03 1
43 SER 1.46 0.09 1
44 PHE 1.12 -0.31 1
45 THR -5.44 0.64 1
47 LEU -0.19 0.48 1
48 SER -3.85 0.18 1
49 LYS 4.06 -1.08 1
51 HIS 0.66 -0.18 1
52 LEU 4.01 0.03 1
53 LYS 4.54 -0.31 1
54 VAL 4.79 -0.35 1
55 HIS 5.88 -0.68 1
56 ILE 5.99 -0.71 1
57 GLU 2.57 -0.46 1
58 ARG 2.13 -0.25 1
59 VAL 2.19 -0.41 1
60 HIS -0.17 0.21 1
61 LYS 1.95 -0.15 1
62 LYS 0.56 0.01 1
63 ILE -0.22 -0.05 1
64 LYS -0.33 0.07 1
65 GLN -1.52 0.14 1
66 HIS -3.46 0.40 1
68 ARG 3.39 -0.18 1
69 PHE 3.62 -0.18 1
71 LYS 5.28 -0.10 1
72 LYS 1.28 -0.23 1
73 LYS -2.14 0.31 1
74 TYR -4.32 -0.04 1
75 SER 1.63 -0.03 1
76 ASP -3.73 0.31 1
77 VAL 4.26 -0.35 1
78 LYS 5.27 -0.35 1
79 ASN 2.82 -0.23 1
80 LEU 4.52 -0.91 1
81 ILE 5.08 -0.53 1
82 LYS 3.73 -0.38 1
83 HIS 5.76 -0.38 1
84 ILE 6.10 -0.79 1
85 ARG 3.55 -0.29 1
86 ASP 2.14 -0.29 1
87 ALA -0.31 -0.13 1
88 HIS -1.94 0.16 1
89 ASP 0.66 -0.16 1
91 GLN -0.70 -0.03 1
92 ASP 0.45 -0.28 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11487_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -5.87
_LACS_plot.Line_1_terminator_val_y_1 -2.30
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 0.50
_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 6.31
_LACS_plot.Line_2_terminator_val_y_2 2.06
_LACS_plot.Y_axis_chem_shift_offset 0.21
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
51 HIS 0.66 4.34 0
92 ASP 0.45 4.59 0
10 TYR 1.66 -1.93 1
11 LYS -2.78 -0.86 1
14 GLN -0.95 -1.16 1
16 SER 1.25 -0.35 1
17 TYR 2.19 -2.71 1
18 ALA -5.87 -2.76 1
19 SER -3.35 -1.16 1
20 ALA 0.26 -0.94 1
21 ILE -2.49 0.22 1
22 LYS 5.88 1.95 1
23 ALA 3.36 1.91 1
24 ASN 4.10 3.70 1
25 LEU 5.02 0.03 1
26 ASN 4.86 2.83 1
27 VAL 4.90 2.10 1
28 HIS 6.31 2.53 1
29 LEU 3.15 1.77 1
30 ARG 3.26 2.06 1
31 LYS 3.08 1.22 1
32 HIS 0.76 1.49 1
33 THR 0.98 0.47 1
35 GLU -0.67 -1.47 1
36 LYS -1.89 -1.25 1
37 PHE -0.97 -2.00 1
38 ALA -4.19 -1.91 1
40 ASP 1.65 0.31 1
41 TYR 0.35 -0.99 1
43 SER 1.46 -0.57 1
44 PHE 1.12 -1.27 1
45 THR -5.44 -2.83 1
47 LEU -0.19 -0.66 1
48 SER -3.85 -0.80 1
49 LYS 4.06 2.65 1
52 LEU 4.01 -0.05 1
53 LYS 4.54 2.39 1
54 VAL 4.79 1.25 1
55 HIS 5.88 2.38 1
56 ILE 5.99 2.03 1
57 GLU 2.57 1.20 1
58 ARG 2.13 1.85 1
59 VAL 2.19 0.09 1
60 HIS -0.17 0.53 1
61 LYS 1.95 0.15 1
62 LYS 0.56 -0.28 1
63 ILE -0.22 -0.31 1
64 LYS -0.33 -0.63 1
65 GLN -1.52 -1.30 1
66 HIS -3.46 0.37 1
68 ARG 3.39 -0.18 1
69 PHE 3.62 0.67 1
71 LYS 5.28 -0.70 1
72 LYS 1.28 -1.29 1
73 LYS -2.14 -1.12 1
74 TYR -4.32 -0.89 1
75 SER 1.63 -1.20 1
76 ASP -3.73 0.21 1
77 VAL 4.26 0.27 1
78 LYS 5.27 3.42 1
79 ASN 2.82 2.30 1
80 LEU 4.52 -0.28 1
81 ILE 5.08 2.19 1
82 LYS 3.73 0.68 1
83 HIS 5.76 2.30 1
84 ILE 6.10 2.00 1
85 ARG 3.55 1.46 1
86 ASP 2.14 1.71 1
87 ALA -0.31 0.44 1
88 HIS -1.94 -0.32 1
89 ASP 0.66 -1.32 1
91 GLN -0.70 -1.09 1
stop_
save_