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 bmr15663_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -7.15
_LACS_plot.Line_1_terminator_val_y_1 -1.96
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 1.37
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -0.73
_LACS_plot.Line_2_terminator_val_x_2 8.19
_LACS_plot.Line_2_terminator_val_y_2 7.16
_LACS_plot.Y_axis_chem_shift_offset -0.73
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
113 LEU 2.37 -2.73 0
10 ALA 4.15 3.82 1
11 GLU 4.48 4.36 1
12 GLU 1.56 2.85 1
13 GLN 5.30 5.38 1
14 GLN 4.61 4.11 1
15 GLU 3.33 3.48 1
16 TYR 2.85 1.02 1
17 LYS 5.54 5.66 1
18 GLU 3.67 3.81 1
19 ALA 3.41 3.67 1
20 PHE 4.91 5.13 1
21 GLN 3.44 3.49 1
22 LEU 2.47 3.10 1
23 PHE 3.04 2.86 1
24 ASP 0.88 -0.64 1
25 LYS 3.00 3.12 1
26 ASP 0.36 -1.14 1
27 ASN 3.17 2.46 1
28 ASP -0.45 -0.52 1
29 ASN 2.23 2.08 1
30 LYS -7.15 -1.26 1
31 LEU -4.22 -1.68 1
32 THR -2.66 -0.23 1
33 ALA 4.67 4.37 1
34 GLU 3.27 3.71 1
35 GLU 1.05 2.96 1
36 LEU 3.54 3.36 1
38 THR 6.17 5.41 1
39 VAL 5.04 3.62 1
40 MET 5.52 6.42 1
41 ARG 3.76 3.71 1
42 ALA 3.15 3.18 1
43 LEU -0.52 0.14 1
45 ALA -1.85 -0.44 1
46 ASN 0.16 1.27 1
48 THR -3.13 -0.71 1
49 LYS 5.09 4.59 1
50 GLN 4.77 4.10 1
51 LYS 3.32 2.87 1
52 ILE 5.07 3.23 1
53 SER 5.20 4.65 1
54 GLU 3.04 3.47 1
55 ILE 5.04 5.24 1
56 VAL 5.52 5.26 1
57 LYS 3.79 3.64 1
58 ASP 1.93 2.99 1
59 TYR 1.37 2.42 1
60 ASP -0.08 -0.18 1
61 LYS 2.38 2.74 1
62 ASP -0.32 -0.14 1
63 ASN 3.23 2.46 1
64 SER 0.31 2.11 1
66 LYS -6.31 -1.28 1
67 PHE -3.07 -0.16 1
68 ASP -2.33 -1.02 1
69 GLN 4.18 5.38 1
70 GLU 4.08 4.22 1
71 THR 7.23 6.17 1
72 PHE 3.97 4.25 1
73 LEU 5.55 4.48 1
74 THR 6.66 6.16 1
75 ILE 5.87 5.48 1
76 MET 3.19 0.54 1
77 LEU 3.51 3.84 1
78 GLU 1.90 2.47 1
79 TYR 2.15 3.18 1
81 GLN 0.07 0.99 1
82 GLU 0.01 0.98 1
83 VAL 0.55 1.14 1
84 ASP -0.10 0.99 1
85 SER 0.83 1.52 1
86 THR 3.70 3.77 1
87 GLU 2.40 3.13 1
88 ASP 0.61 1.36 1
89 ILE 0.40 1.23 1
90 LYS 0.19 0.72 1
91 LYS -4.29 -1.69 1
92 ALA 1.42 1.78 1
95 ILE 8.20 6.46 1
96 PHE -0.40 2.62 1
97 ASP 3.28 4.37 1
98 LYS 5.31 4.87 1
99 GLU 7.05 4.34 1
100 LYS 3.39 3.36 1
101 ASN 1.93 4.34 1
105 SER -1.62 0.13 1
106 ALA 0.41 3.82 1
107 SER 4.22 3.65 1
108 GLU 1.83 2.34 1
109 LEU 3.37 3.50 1
110 LYS 2.70 4.32 1
111 HIS 5.39 5.01 1
112 VAL 0.46 -0.08 1
114 THR 0.86 1.46 1
115 THR 0.74 0.96 1
116 LEU -0.40 0.34 1
118 GLU 0.46 0.26 1
119 LYS -3.13 -0.16 1
120 LEU -2.36 -0.22 1
121 THR 4.37 4.50 1
122 GLU 4.03 3.80 1
123 GLN 1.92 3.22 1
124 GLU 6.87 6.01 1
125 VAL 4.39 4.49 1
126 ASP 2.73 4.68 1
127 ASP 4.29 3.47 1
128 LEU 2.63 1.09 1
129 LEU 6.15 5.57 1
130 LYS 3.00 5.62 1
131 GLU 0.72 2.13 1
132 ILE 0.72 0.50 1
134 VAL 0.22 0.84 1
135 GLU 0.52 0.64 1
136 GLU 0.51 -0.16 1
138 LEU 0.39 0.97 1
139 ILE 3.46 3.84 1
140 ASN 4.52 4.43 1
142 ASP 4.04 4.07 1
143 ASP 2.41 -0.32 1
144 PHE -0.02 0.88 1
145 VAL 2.59 0.99 1
146 LYS 0.70 0.17 1
147 LEU 3.06 1.32 1
148 ILE -0.73 1.37 1
149 THR 0.72 1.65 1
150 SER 1.03 2.13 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr15663_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -7.15
_LACS_plot.Line_1_terminator_val_y_1 5.19
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.63
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 1.27
_LACS_plot.Line_2_terminator_val_x_2 8.19
_LACS_plot.Line_2_terminator_val_y_2 -1.03
_LACS_plot.Y_axis_chem_shift_offset -0.73
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
113 LEU 2.37 -5.10 0
10 ALA 4.15 -0.33 1
11 GLU 4.48 -0.12 1
12 GLU 1.56 1.29 1
13 GLN 5.30 0.08 1
14 GLN 4.61 -0.50 1
15 GLU 3.33 0.15 1
16 TYR 2.85 -1.83 1
17 LYS 5.54 0.12 1
18 GLU 3.67 0.14 1
19 ALA 3.41 0.26 1
20 PHE 4.91 0.22 1
21 GLN 3.44 0.05 1
22 LEU 2.47 0.63 1
23 PHE 3.04 -0.18 1
24 ASP 0.88 -1.52 1
25 LYS 3.00 0.12 1
26 ASP 0.36 -1.50 1
27 ASN 3.17 -0.71 1
28 ASP -0.45 -0.07 1
29 ASN 2.23 -0.15 1
30 LYS -7.15 5.89 1
31 LEU -4.22 2.54 1
32 THR -2.66 2.43 1
33 ALA 4.67 -0.30 1
34 GLU 3.27 0.44 1
35 GLU 1.05 1.91 1
36 LEU 3.54 -0.18 1
38 THR 6.17 -0.76 1
39 VAL 5.04 -1.42 1
40 MET 5.52 0.90 1
41 ARG 3.76 -0.05 1
42 ALA 3.15 0.03 1
43 LEU -0.52 0.66 1
45 ALA -1.85 1.41 1
46 ASN 0.16 1.11 1
48 THR -3.13 2.42 1
49 LYS 5.09 -0.50 1
50 GLN 4.77 -0.67 1
51 LYS 3.32 -0.45 1
52 ILE 5.07 -1.84 1
53 SER 5.20 -0.55 1
54 GLU 3.04 0.43 1
55 ILE 5.04 0.20 1
56 VAL 5.52 -0.26 1
57 LYS 3.79 -0.15 1
58 ASP 1.93 1.06 1
59 TYR 1.37 1.05 1
60 ASP -0.08 -0.10 1
61 LYS 2.38 0.36 1
62 ASP -0.32 0.18 1
63 ASN 3.23 -0.77 1
64 SER 0.31 1.80 1
66 LYS -6.31 5.03 1
67 PHE -3.07 2.91 1
68 ASP -2.33 1.31 1
69 GLN 4.18 1.20 1
70 GLU 4.08 0.14 1
71 THR 7.23 -1.06 1
72 PHE 3.97 0.28 1
73 LEU 5.55 -1.07 1
74 THR 6.66 -0.50 1
75 ILE 5.87 -0.39 1
76 MET 3.19 -2.65 1
77 LEU 3.51 0.33 1
78 GLU 1.90 0.57 1
79 TYR 2.15 1.03 1
81 GLN 0.07 0.92 1
82 GLU 0.01 0.97 1
83 VAL 0.55 0.59 1
84 ASP -0.10 1.09 1
85 SER 0.83 0.69 1
86 THR 3.70 0.07 1
87 GLU 2.40 0.73 1
88 ASP 0.61 0.75 1
89 ILE 0.40 0.83 1
90 LYS 0.19 0.53 1
91 LYS -4.29 2.60 1
92 ALA 1.42 0.36 1
95 ILE 8.20 -1.74 1
96 PHE -0.40 3.02 1
97 ASP 3.28 1.09 1
98 LYS 5.31 -0.44 1
99 GLU 7.05 -2.71 1
100 LYS 3.39 -0.03 1
101 ASN 1.93 2.41 1
105 SER -1.62 1.75 1
106 ALA 0.41 3.41 1
107 SER 4.22 -0.57 1
108 GLU 1.83 0.51 1
109 LEU 3.37 0.13 1
110 LYS 2.70 1.62 1
111 HIS 5.39 -0.38 1
112 VAL 0.46 -0.54 1
114 THR 0.86 0.60 1
115 THR 0.74 0.22 1
116 LEU -0.40 0.74 1
118 GLU 0.46 -0.20 1
119 LYS -3.13 2.97 1
120 LEU -2.36 2.14 1
121 THR 4.37 0.13 1
122 GLU 4.03 -0.23 1
123 GLN 1.92 1.30 1
124 GLU 6.87 -0.86 1
125 VAL 4.39 0.10 1
126 ASP 2.73 1.95 1
127 ASP 4.29 -0.82 1
128 LEU 2.63 -1.54 1
129 LEU 6.15 -0.58 1
130 LYS 3.00 2.62 1
131 GLU 0.72 1.41 1
132 ILE 0.72 -0.22 1
134 VAL 0.22 0.62 1
135 GLU 0.52 0.12 1
136 GLU 0.51 -0.67 1
138 LEU 0.39 0.58 1
139 ILE 3.46 0.38 1
140 ASN 4.52 -0.09 1
142 ASP 4.04 0.03 1
143 ASP 2.41 -2.73 1
144 PHE -0.02 0.90 1
145 VAL 2.59 -1.60 1
146 LYS 0.70 -0.53 1
147 LEU 3.06 -1.74 1
148 ILE -0.73 2.10 1
149 THR 0.72 0.93 1
150 SER 1.03 1.10 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr15663_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -7.15
_LACS_plot.Line_1_terminator_val_y_1 0.71
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.21
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.18
_LACS_plot.Line_2_terminator_val_x_2 8.19
_LACS_plot.Line_2_terminator_val_y_2 -0.81
_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
96 PHE -0.40 -1.43 0
10 ALA 4.15 -0.42 1
11 GLU 4.48 -0.45 1
12 GLU 1.56 -0.78 1
13 GLN 5.30 -0.78 1
14 GLN 4.61 -0.43 1
15 GLU 3.33 -0.34 1
16 TYR 2.85 0.20 1
17 LYS 5.54 -0.36 1
18 GLU 3.67 -0.28 1
19 ALA 3.41 -0.01 1
20 PHE 4.91 -1.15 1
21 GLN 3.44 -0.27 1
22 LEU 2.47 -0.43 1
23 PHE 3.04 -0.55 1
24 ASP 0.88 0.03 1
25 LYS 3.00 -0.36 1
26 ASP 0.36 -0.14 1
27 ASN 3.17 -0.29 1
28 ASP -0.45 0.03 1
29 ASN 2.23 -0.40 1
30 LYS -7.15 0.79 1
31 LEU -4.22 0.99 1
32 THR -2.66 0.48 1
33 ALA 4.67 -0.37 1
34 GLU 3.27 -0.34 1
35 GLU 1.05 -0.34 1
36 LEU 3.54 -0.60 1
38 THR 6.17 -0.18 1
39 VAL 5.04 -0.17 1
40 MET 5.52 -0.90 1
41 ARG 3.76 0.00 1
42 ALA 3.15 -0.04 1
43 LEU -0.52 0.00 1
45 ALA -1.85 0.10 1
46 ASN 0.16 -0.40 1
48 THR -3.13 0.42 1
49 LYS 5.09 -0.47 1
50 GLN 4.77 -0.33 1
51 LYS 3.32 -0.25 1
52 ILE 5.07 -0.59 1
53 SER 5.20 -0.46 1
54 GLU 3.04 -0.39 1
55 ILE 5.04 -0.38 1
56 VAL 5.52 -0.39 1
57 LYS 3.79 -0.25 1
58 ASP 1.93 -0.30 1
59 TYR 1.37 0.10 1
60 ASP -0.08 0.36 1
61 LYS 2.38 -0.20 1
62 ASP -0.32 0.00 1
63 ASN 3.23 -0.45 1
64 SER 0.31 -0.24 1
66 LYS -6.31 0.52 1
67 PHE -3.07 0.27 1
68 ASP -2.33 0.41 1
69 GLN 4.18 -1.31 1
70 GLU 4.08 -0.45 1
71 THR 7.23 0.10 1
72 PHE 3.97 -0.66 1
73 LEU 5.55 -0.98 1
74 THR 6.66 0.04 1
75 ILE 5.87 -1.14 1
76 MET 3.19 -0.36 1
77 LEU 3.51 -0.33 1
78 GLU 1.90 -0.37 1
79 TYR 2.15 -0.26 1
81 GLN 0.07 -0.11 1
82 GLU 0.01 -0.12 1
83 VAL 0.55 -0.11 1
84 ASP -0.10 -0.03 1
85 SER 0.83 0.00 1
86 THR 3.70 -0.11 1
87 GLU 2.40 0.32 1
89 ILE 0.40 -0.11 1
91 LYS -4.29 0.43 1
92 ALA 1.42 -0.14 1
95 ILE 8.20 -0.92 1
97 ASP 3.28 -0.57 1
99 GLU 7.05 -0.56 1
100 LYS 3.39 -0.47 1
101 ASN 1.93 -0.09 1
105 SER -1.62 -0.29 1
106 ALA 0.41 -0.15 1
107 SER 4.22 -0.35 1
108 GLU 1.83 -0.28 1
109 LEU 3.37 0.15 1
110 LYS 2.70 -0.88 1
111 HIS 0.46 0.27 1
113 LEU 2.37 0.12 1
114 THR 0.74 0.48 1
116 LEU -0.40 -0.51 1
118 GLU 0.46 -0.11 1
119 LYS -3.13 0.38 1
120 LEU -2.36 0.27 1
121 THR 4.37 -0.58 1
122 GLU 4.03 -0.38 1
123 GLN 1.92 -0.34 1
124 GLU 6.87 -0.66 1
125 VAL 4.39 -0.30 1
126 ASP 2.73 -0.52 1
127 ASP 2.63 -0.49 1
129 LEU 0.72 0.00 1
132 ILE 0.72 -0.03 1
134 VAL 0.52 -0.23 1
136 GLU 0.39 -0.10 1
139 ILE 4.52 -0.34 1
142 ASP 4.04 -0.79 1
143 ASP 2.41 -0.39 1
144 PHE -0.02 0.04 1
145 VAL 2.59 -0.10 1
146 LYS 3.06 0.31 1
148 ILE -0.73 -0.06 1
149 THR 0.72 -0.08 1
150 SER 1.03 -0.19 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr15663_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -7.15
_LACS_plot.Line_1_terminator_val_y_1 -4.66
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -1.76
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -2.95
_LACS_plot.Line_2_terminator_val_x_2 8.19
_LACS_plot.Line_2_terminator_val_y_2 -0.07
_LACS_plot.Y_axis_chem_shift_offset 2.39
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
138 LEU 0.39 4.16 0
10 ALA 4.15 0.03 1
11 GLU 4.48 -0.20 1
12 GLU 1.56 -1.75 1
13 GLN 5.30 -1.02 1
14 GLN 4.61 -0.91 1
15 GLU 3.33 0.89 1
16 TYR 2.85 -0.15 1
17 LYS 5.54 -0.33 1
18 GLU 3.67 -0.17 1
19 ALA 3.41 -2.16 1
20 PHE 4.91 -2.78 1
21 GLN 3.44 0.27 1
22 LEU 2.47 -1.82 1
23 PHE 3.04 -3.87 1
24 ASP 0.88 -1.32 1
25 LYS 3.00 -2.30 1
26 ASP 0.36 -3.38 1
27 ASN 3.17 -3.84 1
28 ASP -0.45 -2.19 1
29 ASN 2.23 -4.04 1
30 LYS -7.15 -4.10 1
31 LEU -4.22 -2.43 1
32 THR -2.66 -2.23 1
33 ALA 4.67 -0.74 1
34 GLU 3.27 0.24 1
35 GLU 1.05 -0.97 1
36 LEU 3.54 -1.95 1
38 THR 6.17 -0.43 1
39 VAL 5.04 -2.64 1
40 MET 5.52 -0.67 1
41 ARG 3.76 1.30 1
42 ALA 3.15 -1.27 1
43 LEU -0.52 -3.26 1
45 ALA -1.85 -5.12 1
46 ASN 0.16 -4.20 1
48 THR -3.13 -2.72 1
49 LYS 5.09 0.01 1
50 GLN 4.77 -0.70 1
51 LYS 3.32 -0.75 1
52 ILE 5.07 -1.86 1
53 SER 5.20 -0.22 1
54 GLU 3.04 -1.41 1
55 ILE 5.04 -0.87 1
56 VAL 5.52 -1.11 1
57 LYS 3.79 -0.64 1
58 ASP 1.93 -0.78 1
59 TYR 1.37 -2.68 1
60 ASP -0.08 -1.91 1
61 LYS 2.38 -2.06 1
62 ASP -0.32 -3.11 1
63 ASN 3.23 -3.18 1
64 SER 0.31 -0.65 1
66 LYS -6.31 -4.57 1
67 PHE -3.07 -3.12 1
68 ASP -2.33 -4.23 1
69 GLN 4.18 -1.35 1
70 GLU 4.08 0.24 1
71 THR 7.23 -1.58 1
72 PHE 3.97 -2.92 1
73 LEU 5.55 -1.54 1
74 THR 6.66 -1.37 1
75 ILE 5.87 -0.76 1
76 MET 3.19 0.76 1
77 LEU 3.51 -2.08 1
78 GLU 1.90 -1.20 1
79 TYR 2.15 -1.85 1
81 GLN 0.07 -2.59 1
82 GLU 0.01 -2.70 1
83 VAL 0.55 -3.10 1
84 ASP -0.10 -2.44 1
85 SER 0.83 -1.94 1
86 THR 3.70 -1.95 1
87 GLU 2.40 -2.83 1
88 ASP 0.61 -0.71 1
89 ILE 0.40 -4.14 1
90 LYS 0.19 -3.14 1
91 LYS -4.29 -3.77 1
92 ALA 1.42 -2.62 1
95 ILE 8.20 -0.27 1
96 PHE -0.40 -0.38 1
97 ASP 3.28 -1.10 1
98 LYS 5.31 0.78 1
99 GLU 7.05 -0.24 1
100 LYS 3.39 -1.51 1
101 ASN 1.93 0.47 1
105 SER -1.62 -1.75 1
106 ALA 0.41 -1.21 1
107 SER 4.22 -0.73 1
108 GLU 1.83 -1.01 1
109 LEU 3.37 -0.53 1
110 LYS 2.70 1.22 1
111 HIS 5.39 0.10 1
112 VAL 0.46 -3.07 1
113 LEU 2.37 -2.45 1
114 THR 0.86 -2.68 1
115 THR 0.74 -3.27 1
116 LEU -0.40 -3.27 1
118 GLU 0.46 -3.63 1
119 LYS -3.13 -2.91 1
120 LEU -2.36 -2.85 1
121 THR 4.37 -1.01 1
122 GLU 4.03 -1.02 1
123 GLN 1.92 0.67 1
124 GLU 6.87 -2.09 1
125 VAL 4.39 0.22 1
126 ASP 2.73 -0.12 1
127 ASP 4.29 -0.76 1
128 LEU 2.63 -4.02 1
129 LEU 6.15 -3.74 1
130 LYS 3.00 -3.37 1
131 GLU 0.72 -3.29 1
132 ILE 0.72 -2.22 1
134 VAL 0.22 -1.34 1
135 GLU 0.52 -5.46 1
136 GLU 0.51 -7.00 1
139 ILE 3.46 -2.62 1
140 ASN 4.52 0.16 1
142 ASP 4.04 0.00 1
143 ASP 2.41 -0.21 1
144 PHE -0.02 -3.28 1
145 VAL 2.59 -2.01 1
146 LYS 0.70 -4.94 1
147 LEU 3.06 -3.24 1
148 ILE -0.73 -0.18 1
149 THR 0.72 -3.99 1
150 SER 1.03 1.88 1
stop_
save_