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 bmr7083_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -7.76
_LACS_plot.Line_1_terminator_val_y_1 -4.99
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -1.51
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -3.14
_LACS_plot.Line_2_terminator_val_x_2 4.33
_LACS_plot.Line_2_terminator_val_y_2 -0.31
_LACS_plot.Y_axis_chem_shift_offset 2.23
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
86 TYR -6.88 -7.50 0
52 ASN 2.60 -4.18 0
10 GLN -4.89 -2.81 1
11 LEU 1.79 0.04 1
12 ASP 0.60 -1.35 1
13 SER -2.98 -3.93 1
14 TYR -4.34 -3.82 1
15 ASN -4.63 -2.32 1
16 TYR -3.41 -3.24 1
17 ASP -2.31 -4.17 1
19 SER 0.68 -0.32 1
20 THR 1.47 -1.21 1
21 PHE -6.44 -6.36 1
22 SER -5.31 -4.33 1
24 LYS -4.37 -3.22 1
25 ILE -4.52 -1.94 1
26 TYR -0.66 -2.00 1
27 VAL -3.52 -3.22 1
28 LYS 0.26 -1.22 1
29 ASN 2.54 -2.89 1
30 ILE 0.89 0.04 1
31 ALA -3.64 -3.85 1
32 TYR 2.96 1.02 1
33 SER 1.45 -2.22 1
34 LYS -5.70 -2.68 1
35 LYS -1.99 -1.76 1
36 VAL -1.01 -2.89 1
37 THR -4.34 -3.95 1
38 VAL 0.17 -2.70 1
39 VAL -0.96 -3.28 1
40 TYR -7.76 -4.72 1
41 ALA -4.15 -6.16 1
42 ASP -0.37 -3.35 1
44 SER -0.45 -3.02 1
45 ASP 1.28 -2.44 1
46 ASN -1.21 -3.22 1
47 TRP 1.20 -1.42 1
48 ASN 2.33 -1.56 1
49 ASN 3.09 -0.95 1
50 ASN 4.33 -0.38 1
53 ILE -6.33 -4.44 1
54 ILE -4.81 -3.34 1
55 ALA -0.30 -2.41 1
56 ALA -3.79 -4.28 1
57 SER -3.24 -3.14 1
58 PHE 1.31 -1.58 1
59 SER -0.63 -2.67 1
62 ILE 1.78 -2.11 1
63 SER 2.81 -0.35 1
65 SER -5.56 -3.47 1
66 ASN -0.48 -3.16 1
67 TYR -4.12 -2.04 1
68 GLU -6.70 -5.03 1
69 TYR -2.58 -2.87 1
70 TRP -2.03 -2.66 1
71 THR -4.71 -4.81 1
72 PHE -5.30 -4.68 1
73 SER 0.58 -2.34 1
74 ALA -5.56 -3.13 1
75 SER 0.56 -2.78 1
76 VAL -4.81 -3.86 1
77 LYS 0.74 -2.00 1
79 ILE -0.98 -3.86 1
80 LYS -3.49 -2.82 1
81 GLU -4.79 -4.67 1
82 PHE -2.51 -2.20 1
83 TYR -3.56 -3.49 1
84 ILE -3.12 -3.89 1
85 LYS -5.00 -3.27 1
87 GLU -5.25 -4.51 1
88 VAL -1.77 -3.80 1
89 SER 1.08 -2.36 1
91 LYS -4.07 -4.22 1
92 THR -0.38 -2.32 1
93 TYR -5.32 -4.30 1
94 TYR -5.00 -3.59 1
95 ASP -0.49 -2.01 1
96 ASN -2.07 -5.28 1
97 ASN 3.82 -2.40 1
98 ASN 3.14 -0.87 1
100 ALA -0.20 -1.16 1
101 ASN 1.97 -0.45 1
102 TYR 1.95 -1.07 1
103 GLN -1.36 -3.75 1
104 VAL 1.10 -1.79 1
105 SER -1.20 -2.75 1
106 THR 0.43 -1.09 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr7083_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -7.76
_LACS_plot.Line_1_terminator_val_y_1 2.77
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -3.51
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.14
_LACS_plot.Line_2_terminator_val_x_2 4.33
_LACS_plot.Line_2_terminator_val_y_2 -4.64
_LACS_plot.Y_axis_chem_shift_offset 2.23
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
86 TYR -6.88 -0.62 0
52 ASN 2.60 -6.78 0
10 GLN -4.89 2.08 1
11 LEU 1.79 -1.75 1
12 ASP 0.60 -1.95 1
13 SER -2.98 -0.95 1
14 TYR -4.34 0.52 1
15 ASN -4.63 2.31 1
16 TYR -3.41 0.17 1
17 ASP -2.31 -1.86 1
19 SER 0.68 -1.00 1
20 THR 1.47 -2.68 1
21 PHE -6.44 0.08 1
22 SER -5.31 0.98 1
24 LYS -4.37 1.15 1
25 ILE -4.52 2.58 1
26 TYR -0.66 -1.34 1
27 VAL -3.52 0.30 1
28 LYS 0.26 -1.48 1
29 ASN 2.54 -5.43 1
30 ILE 0.89 -0.85 1
31 ALA -3.64 -0.21 1
32 TYR 2.96 -1.94 1
33 SER 1.45 -3.67 1
34 LYS -5.70 3.02 1
35 LYS -1.99 0.23 1
36 VAL -1.01 -1.88 1
37 THR -4.34 0.39 1
38 VAL 0.17 -2.87 1
39 VAL -0.96 -2.32 1
40 TYR -7.76 3.04 1
41 ALA -4.15 -2.01 1
42 ASP -0.37 -2.98 1
44 SER -0.45 -2.57 1
45 ASP 1.28 -3.72 1
46 ASN -1.21 -2.01 1
47 TRP 1.20 -2.62 1
48 ASN 2.33 -3.89 1
49 ASN 3.09 -4.04 1
50 ASN 4.33 -4.71 1
53 ILE -6.33 1.89 1
54 ILE -4.81 1.47 1
55 ALA -0.30 -2.11 1
56 ALA -3.79 -0.49 1
57 SER -3.24 0.10 1
58 PHE 1.31 -2.89 1
59 SER -0.63 -2.04 1
62 ILE 1.78 -3.89 1
63 SER 2.81 -3.16 1
65 SER -5.56 2.09 1
66 ASN -0.48 -2.68 1
67 TYR -4.12 2.08 1
68 GLU -6.70 1.67 1
69 TYR -2.58 -0.29 1
70 TRP -2.03 -0.63 1
71 THR -4.71 -0.10 1
72 PHE -5.30 0.62 1
73 SER 0.58 -2.92 1
74 ALA -5.56 2.43 1
75 SER 0.56 -3.34 1
76 VAL -4.81 0.95 1
77 LYS 0.74 -2.74 1
79 ILE -0.98 -2.88 1
80 LYS -3.49 0.67 1
81 GLU -4.79 0.12 1
82 PHE -2.51 0.31 1
83 TYR -3.56 0.07 1
84 ILE -3.12 -0.77 1
85 LYS -5.00 1.73 1
87 GLU -5.25 0.74 1
88 VAL -1.77 -2.03 1
89 SER 1.08 -3.44 1
91 LYS -4.07 -0.15 1
92 THR -0.38 -1.94 1
93 TYR -5.32 1.02 1
94 TYR -5.00 1.41 1
95 ASP -0.49 -1.52 1
96 ASN -2.07 -3.21 1
97 ASN 3.82 -6.22 1
98 ASN 3.14 -4.01 1
100 ALA -0.20 -0.96 1
101 ASN 1.97 -2.42 1
102 TYR 1.95 -3.02 1
103 GLN -1.36 -2.39 1
104 VAL 1.10 -2.89 1
105 SER -1.20 -1.55 1
106 THR 0.43 -1.52 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr7083_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -7.76
_LACS_plot.Line_1_terminator_val_y_1 0.76
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.30
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.11
_LACS_plot.Line_2_terminator_val_x_2 4.33
_LACS_plot.Line_2_terminator_val_y_2 -0.51
_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
101 ASN 1.97 -1.20 0
41 ALA -4.15 -0.59 0
28 LYS 0.26 -1.17 0
10 GLN -4.89 0.32 1
11 LEU 1.79 -0.55 1
12 ASP 0.60 0.12 1
13 SER -2.98 0.02 1
14 TYR -4.34 0.73 1
15 ASN -4.63 -0.16 1
16 TYR -3.41 1.02 1
17 ASP -2.31 -0.10 1
19 SER 0.68 0.01 1
20 THR 1.47 0.34 1
21 PHE -6.44 1.14 1
22 SER -5.31 -0.09 1
24 LYS -4.37 0.51 1
25 ILE -4.52 -0.10 1
26 TYR -0.66 0.28 1
27 VAL -3.52 -0.11 1
29 ASN 2.54 -0.37 1
30 ILE 0.89 -0.66 1
31 ALA -3.64 -0.16 1
32 TYR 2.96 -0.40 1
33 SER 1.45 -0.25 1
34 LYS -5.70 0.34 1
35 LYS -1.99 0.05 1
36 VAL -1.01 0.48 1
37 THR -4.34 0.50 1
38 VAL 0.17 0.02 1
39 VAL -0.96 0.45 1
40 TYR -7.76 0.92 1
42 ASP -0.37 -0.26 1
44 SER -0.45 -0.07 1
45 ASP 1.28 -0.84 1
46 ASN -1.21 -0.12 1
47 TRP 1.20 -0.61 1
48 ASN 2.33 -0.58 1
49 ASN 3.09 -0.65 1
50 ASN 4.33 -0.22 1
52 ASN 2.60 -0.19 1
53 ILE -6.33 0.99 1
54 ILE -4.81 -0.11 1
55 ALA -0.30 0.22 1
56 ALA -3.79 0.60 1
57 SER -3.24 0.22 1
58 PHE 1.31 0.05 1
59 SER -0.63 -0.28 1
62 ILE 1.78 -0.11 1
63 SER 2.81 -0.41 1
65 SER -5.56 0.38 1
66 ASN -0.48 0.27 1
67 TYR -4.12 0.24 1
68 GLU -6.70 0.32 1
69 TYR -2.58 0.99 1
70 TRP -2.03 0.33 1
71 THR -4.71 0.79 1
72 PHE -5.30 0.42 1
73 SER 0.58 0.23 1
74 ALA -5.56 0.27 1
75 SER 0.56 0.50 1
76 VAL -4.81 0.11 1
77 LYS 0.74 -0.07 1
79 ILE -0.98 0.16 1
80 LYS -3.49 0.09 1
81 GLU -4.79 1.17 1
82 PHE -2.51 1.07 1
83 TYR -3.56 0.46 1
84 ILE -3.12 0.75 1
85 LYS -5.00 0.53 1
86 TYR -6.88 1.01 1
87 GLU -5.25 0.57 1
88 VAL -1.77 0.12 1
89 SER 1.08 -0.74 1
91 LYS -4.07 -0.08 1
92 THR -0.38 0.15 1
93 TYR -5.32 -0.01 1
94 TYR -5.00 0.94 1
95 ASP -0.49 0.43 1
96 ASN -2.07 0.06 1
97 ASN 3.82 -0.74 1
98 ASN 3.14 -0.55 1
100 ALA -0.20 -0.29 1
102 TYR 1.95 -0.38 1
103 GLN -1.36 -0.01 1
104 VAL 1.10 0.03 1
105 SER -1.20 0.11 1
106 THR 0.43 -0.20 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr7083_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -7.76
_LACS_plot.Line_1_terminator_val_y_1 -4.76
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -2.67
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -3.52
_LACS_plot.Line_2_terminator_val_x_2 4.33
_LACS_plot.Line_2_terminator_val_y_2 -2.17
_LACS_plot.Y_axis_chem_shift_offset 3.10
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
106 THR 0.43 2.09 0
10 GLN -4.89 -3.93 1
11 LEU 1.79 -4.55 1
12 ASP 0.60 -4.05 1
13 SER -2.98 -5.30 1
14 TYR -4.34 -5.39 1
15 ASN -4.63 -4.31 1
16 TYR -3.41 -3.84 1
17 ASP -2.31 -1.92 1
19 SER 0.68 -3.53 1
20 THR 1.47 -3.36 1
21 PHE -6.44 -5.71 1
22 SER -5.31 -5.11 1
24 LYS -4.37 -3.94 1
25 ILE -4.52 -3.62 1
26 TYR -0.66 -2.43 1
27 VAL -3.52 -3.63 1
28 LYS 0.26 -1.67 1
29 ASN 2.54 -2.94 1
30 ILE 0.89 -3.84 1
31 ALA -3.64 -4.39 1
32 TYR 2.96 -1.19 1
33 SER 1.45 -3.23 1
34 LYS -5.70 -3.21 1
35 LYS -1.99 -3.75 1
36 VAL -1.01 -4.77 1
37 THR -4.34 -4.67 1
38 VAL 0.17 -4.67 1
39 VAL -0.96 -2.71 1
40 TYR -7.76 -5.46 1
41 ALA -4.15 -2.22 1
42 ASP -0.37 -1.90 1
44 SER -0.45 -3.00 1
45 ASP 1.28 -5.92 1
46 ASN -1.21 -0.64 1
47 TRP 1.20 -0.10 1
48 ASN 2.33 -1.28 1
49 ASN 3.09 -2.62 1
50 ASN 4.33 -2.53 1
52 ASN 2.60 -5.84 1
53 ILE -6.33 -2.11 1
54 ILE -4.81 -4.00 1
55 ALA -0.30 -3.08 1
56 ALA -3.79 -3.80 1
57 SER -3.24 -4.35 1
58 PHE 1.31 -3.06 1
59 SER -0.63 -2.57 1
62 ILE 1.78 -2.21 1
63 SER 2.81 -1.55 1
65 SER -5.56 -3.63 1
66 ASN -0.48 -3.92 1
67 TYR -4.12 -3.52 1
68 GLU -6.70 -3.63 1
69 TYR -2.58 -1.78 1
70 TRP -2.03 -3.14 1
71 THR -4.71 -4.50 1
72 PHE -5.30 -4.28 1
73 SER 0.58 -3.71 1
74 ALA -5.56 -4.43 1
75 SER 0.56 -2.57 1
76 VAL -4.81 -3.66 1
77 LYS 0.74 -2.63 1
79 ILE -0.98 -6.30 1
80 LYS -3.49 -2.67 1
81 GLU -4.79 -4.14 1
82 PHE -2.51 -5.89 1
83 TYR -3.56 -6.04 1
84 ILE -3.12 -4.57 1
85 LYS -5.00 -5.78 1
86 TYR -6.88 -5.36 1
87 GLU -5.25 -3.88 1
88 VAL -1.77 -5.08 1
89 SER 1.08 -2.36 1
91 LYS -4.07 -3.84 1
92 THR -0.38 -4.67 1
93 TYR -5.32 -4.58 1
94 TYR -5.00 -0.55 1
95 ASP -0.49 -2.03 1
96 ASN -2.07 -1.85 1
97 ASN 3.82 -1.24 1
98 ASN 3.14 -2.83 1
100 ALA -0.20 -0.85 1
101 ASN 1.97 -3.48 1
102 TYR 1.95 -2.67 1
103 GLN -1.36 -2.17 1
104 VAL 1.10 -3.04 1
105 SER -1.20 -3.20 1
stop_
save_