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 bmr17343_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -8.27
_LACS_plot.Line_1_terminator_val_y_1 -4.01
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.06
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -2.38
_LACS_plot.Line_2_terminator_val_x_2 6.61
_LACS_plot.Line_2_terminator_val_y_2 4.21
_LACS_plot.Y_axis_chem_shift_offset 0.84
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
45 ARG -8.27 -4.21 0
10 ARG 0.06 -0.77 1
11 TYR -2.63 -4.29 1
13 VAL -1.39 -1.49 1
14 SER -0.74 -1.14 1
15 VAL -4.73 -2.35 1
16 GLN -3.90 -2.03 1
20 LEU -2.95 -1.75 1
21 VAL -0.12 -1.65 1
22 GLN -2.95 -2.13 1
23 ILE -0.30 -0.75 1
24 LYS 6.48 2.04 1
25 ARG 2.65 0.49 1
26 LEU -0.03 -0.79 1
27 GLN -1.73 -1.50 1
28 THR -4.23 -2.38 1
29 PHE -1.82 -0.82 1
30 ALA -4.41 -3.38 1
31 PHE -3.54 -1.43 1
32 SER -1.79 -2.09 1
33 VAL -1.72 -1.77 1
34 ARG -1.43 -2.88 1
35 TRP -2.90 -1.24 1
36 SER 4.53 1.96 1
37 ASP -0.27 -1.81 1
39 SER -0.64 -0.33 1
40 ASP -4.13 -1.28 1
41 THR -4.41 -2.49 1
42 PHE -2.50 -1.22 1
43 VAL -6.00 -3.97 1
44 ARG -2.40 -1.63 1
46 SER -3.58 -1.83 1
47 TRP 4.59 3.80 1
48 ASP 4.27 3.04 1
49 GLU 4.66 3.05 1
50 PHE 6.06 4.36 1
51 ARG 6.13 3.44 1
52 GLN 4.20 1.86 1
53 LEU 5.69 2.42 1
54 LYS 6.11 3.21 1
55 LYS 4.54 2.91 1
56 THR 6.24 4.03 1
57 LEU 4.59 2.97 1
58 LYS 4.85 2.75 1
59 GLU 1.19 0.49 1
60 THR 3.27 2.65 1
61 PHE 1.21 -0.52 1
65 ALA -0.03 -0.39 1
68 LEU 2.77 0.33 1
69 ARG -3.96 -4.22 1
72 ASP 0.53 -0.10 1
75 LEU 0.28 -0.79 1
78 LEU 0.02 -1.47 1
79 LEU -1.38 -1.69 1
80 ASP -2.47 -2.61 1
86 ARG 1.05 -0.77 1
87 VAL 0.49 -0.66 1
91 SER 4.58 2.65 1
92 ARG 4.94 3.01 1
94 LEU 4.38 2.02 1
95 ALA 4.05 1.96 1
96 ARG 4.53 3.88 1
97 LEU 6.20 4.54 1
98 GLN 3.93 2.32 1
99 LEU 4.59 2.61 1
100 LEU 2.53 1.38 1
101 GLU 4.18 3.74 1
102 THR 6.61 4.68 1
105 ARG 5.64 3.60 1
106 ARG 4.70 2.57 1
107 LEU 3.40 1.97 1
108 LEU 4.23 0.58 1
109 ALA -0.96 -1.56 1
110 THR 0.52 0.20 1
111 ALA -0.20 -0.78 1
112 GLU 4.98 3.53 1
113 ARG 4.08 1.59 1
114 VAL 3.15 1.27 1
115 ALA 2.85 2.73 1
116 ARG 0.08 -2.46 1
117 SER 0.98 0.65 1
119 THR 6.06 4.54 1
120 ILE 4.90 1.45 1
123 PHE 4.52 3.18 1
124 PHE 2.45 1.82 1
125 ALA 0.40 -2.18 1
127 GLN 1.14 -0.56 1
129 LEU 4.77 1.98 1
130 ASP 1.53 1.29 1
131 LEU 0.61 -0.90 1
132 GLU -0.17 -0.51 1
134 ALA -2.58 -1.75 1
135 LEU 1.22 -0.88 1
139 SER 1.41 0.99 1
140 ARG -2.44 -1.60 1
141 VAL 0.21 -0.86 1
142 ILE -0.94 -1.18 1
143 LEU 0.76 -1.17 1
145 THR -0.09 -0.80 1
147 GLU -0.17 -0.54 1
148 GLU -0.22 -0.69 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr17343_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -8.27
_LACS_plot.Line_1_terminator_val_y_1 4.26
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -2.06
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -0.38
_LACS_plot.Line_2_terminator_val_x_2 6.61
_LACS_plot.Line_2_terminator_val_y_2 -2.40
_LACS_plot.Y_axis_chem_shift_offset 0.84
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
45 ARG -8.27 4.06 0
10 ARG 0.06 -0.83 1
11 TYR -2.63 -1.66 1
13 VAL -1.39 -0.10 1
14 SER -0.74 -0.40 1
15 VAL -4.73 2.38 1
16 GLN -3.90 1.87 1
20 LEU -2.95 1.20 1
21 VAL -0.12 -1.53 1
22 GLN -2.95 0.82 1
23 ILE -0.30 -0.45 1
24 LYS 6.48 -4.44 1
25 ARG 2.65 -2.16 1
26 LEU -0.03 -0.76 1
27 GLN -1.73 0.23 1
28 THR -4.23 1.85 1
29 PHE -1.82 1.00 1
30 ALA -4.41 1.03 1
31 PHE -3.54 2.11 1
32 SER -1.79 -0.30 1
33 VAL -1.72 -0.05 1
34 ARG -1.43 -1.45 1
35 TRP -2.90 1.66 1
36 SER 4.53 -2.57 1
37 ASP -0.27 -1.54 1
39 SER -0.64 0.31 1
40 ASP -4.13 2.85 1
41 THR -4.41 1.92 1
42 PHE -2.50 1.28 1
43 VAL -6.00 2.03 1
44 ARG -2.40 0.77 1
46 SER -3.58 1.75 1
47 TRP 4.59 -0.79 1
48 ASP 4.27 -1.23 1
49 GLU 4.66 -1.61 1
50 PHE 6.06 -1.70 1
51 ARG 6.13 -2.69 1
52 GLN 4.20 -2.34 1
53 LEU 5.69 -3.27 1
54 LYS 6.11 -2.90 1
55 LYS 4.54 -1.63 1
56 THR 6.24 -2.21 1
57 LEU 4.59 -1.62 1
58 LYS 4.85 -2.10 1
59 GLU 1.19 -0.70 1
60 THR 3.27 -0.62 1
61 PHE 1.21 -1.73 1
65 ALA -0.03 -0.36 1
68 LEU 2.77 -2.44 1
69 ARG -3.96 -0.26 1
72 ASP 0.53 -0.63 1
75 LEU 0.28 -1.07 1
78 LEU 0.02 -1.49 1
79 LEU -1.38 -0.31 1
80 ASP -2.47 -0.14 1
86 ARG 1.05 -1.82 1
87 VAL 0.49 -1.15 1
91 SER 4.58 -1.93 1
92 ARG 4.94 -1.93 1
94 LEU 4.38 -2.36 1
95 ALA 4.05 -2.09 1
96 ARG 4.53 -0.65 1
97 LEU 6.20 -1.66 1
98 GLN 3.93 -1.61 1
99 LEU 4.59 -1.98 1
100 LEU 2.53 -1.15 1
101 GLU 4.18 -0.44 1
102 THR 6.61 -1.93 1
105 ARG 5.64 -2.04 1
106 ARG 4.70 -2.13 1
107 LEU 3.40 -1.43 1
108 LEU 4.23 -3.65 1
109 ALA -0.96 -0.60 1
110 THR 0.52 -0.32 1
111 ALA -0.20 -0.58 1
112 GLU 4.98 -1.45 1
113 ARG 4.08 -2.49 1
114 VAL 3.15 -1.88 1
115 ALA 2.85 -0.12 1
116 ARG 0.08 -2.54 1
117 SER 0.98 -0.33 1
119 THR 6.06 -1.52 1
120 ILE 4.90 -3.45 1
123 PHE 4.52 -1.34 1
124 PHE 2.45 -0.63 1
125 ALA 0.40 -2.58 1
127 GLN 1.14 -1.70 1
129 LEU 4.77 -2.79 1
130 ASP 1.53 -0.24 1
131 LEU 0.61 -1.51 1
132 GLU -0.17 -0.34 1
134 ALA -2.58 0.83 1
135 LEU 1.22 -2.10 1
139 SER 1.41 -0.42 1
140 ARG -2.44 0.84 1
141 VAL 0.21 -1.07 1
142 ILE -0.94 -0.24 1
143 LEU 0.76 -1.93 1
145 THR -0.09 -0.71 1
147 GLU -0.17 -0.37 1
148 GLU -0.22 -0.47 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr17343_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -8.27
_LACS_plot.Line_1_terminator_val_y_1 -2.87
_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 -1.03
_LACS_plot.Line_2_terminator_val_x_2 6.61
_LACS_plot.Line_2_terminator_val_y_2 1.75
_LACS_plot.Y_axis_chem_shift_offset 0.36
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
35 TRP -2.90 2.96 0
45 ARG -8.27 -0.86 0
10 ARG 0.06 -1.93 1
11 TYR -2.63 -3.71 1
13 VAL -1.39 -0.15 1
14 SER -0.74 -2.91 1
15 VAL -4.73 -2.96 1
16 GLN -3.90 0.02 1
20 LEU -2.95 -3.84 1
21 VAL -0.12 -2.14 1
22 GLN -2.95 -1.05 1
23 ILE -0.30 -0.97 1
24 LYS 6.48 -0.25 1
25 ARG 2.65 -0.52 1
26 LEU -0.03 -1.60 1
27 GLN -1.73 -0.67 1
28 THR -4.23 0.59 1
29 PHE -1.82 -2.86 1
30 ALA -4.41 -1.63 1
31 PHE -3.54 -1.02 1
32 SER -1.79 -0.65 1
33 VAL -1.72 -2.27 1
34 ARG -1.43 -0.15 1
36 SER 4.53 -0.95 1
37 ASP -0.27 0.38 1
39 SER -0.64 -2.61 1
40 ASP -4.13 0.43 1
41 THR -4.41 -2.14 1
42 PHE -2.50 0.67 1
43 VAL -6.00 -2.01 1
44 ARG -2.40 0.12 1
46 SER -3.58 0.90 1
47 TRP 4.59 2.30 1
48 ASP 4.27 2.76 1
49 GLU 4.66 3.73 1
50 PHE 6.06 1.64 1
51 ARG 6.13 2.91 1
52 GLN 4.20 1.81 1
53 LEU 5.69 -0.15 1
54 LYS 6.11 2.44 1
55 LYS 4.54 1.75 1
56 THR 6.24 3.58 1
57 LEU 4.59 0.05 1
58 LYS 4.85 0.37 1
59 GLU 1.19 1.66 1
60 THR 3.27 -1.51 1
61 PHE 1.21 -2.88 1
65 ALA -0.03 -0.38 1
68 LEU 2.77 -0.14 1
69 ARG -3.96 0.16 1
72 ASP 0.53 -0.59 1
78 LEU 0.02 -3.22 1
79 LEU -1.38 -2.59 1
80 ASP -2.47 -0.28 1
86 ARG 1.05 -0.27 1
87 VAL 0.49 -0.18 1
91 SER 4.58 2.83 1
92 ARG 4.94 2.04 1
94 LEU 4.38 2.38 1
95 ALA 4.05 3.35 1
96 ARG 4.53 0.78 1
97 LEU 6.20 0.04 1
98 GLN 3.93 2.85 1
99 LEU 4.59 3.24 1
100 LEU 2.53 2.77 1
101 GLU 4.18 0.82 1
102 THR 6.61 0.51 1
105 ARG 5.64 3.59 1
106 ARG 4.70 3.83 1
107 LEU 3.40 1.03 1
108 LEU 4.23 -1.21 1
109 ALA -0.96 -0.06 1
110 THR 0.52 -2.07 1
111 ALA -0.20 0.10 1
112 GLU 4.98 0.60 1
113 ARG 4.08 -0.20 1
114 VAL 3.15 2.16 1
115 ALA 2.85 -1.09 1
116 ARG 0.08 0.20 1
117 SER 0.98 3.46 1
119 THR 6.06 0.84 1
120 ILE 4.90 1.50 1
123 PHE 4.52 1.02 1
124 PHE 2.45 -3.14 1
125 ALA 0.40 -3.53 1
127 GLN 1.14 1.17 1
129 LEU 4.77 0.75 1
130 ASP 1.53 0.92 1
131 LEU 0.61 -0.36 1
132 GLU -0.17 0.41 1
134 ALA -2.58 -1.08 1
135 LEU 1.22 0.62 1
139 SER 1.41 -1.36 1
140 ARG -2.44 -2.38 1
141 VAL 0.21 -1.21 1
142 ILE -0.94 -2.12 1
143 LEU 0.76 -0.74 1
145 THR -0.09 -0.36 1
147 GLU -0.17 -0.25 1
148 GLU -0.22 -1.26 1
stop_
save_