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 bmr16476_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -8.29
_LACS_plot.Line_1_terminator_val_y_1 -3.35
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 0.79
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.39
_LACS_plot.Line_2_terminator_val_x_2 6.94
_LACS_plot.Line_2_terminator_val_y_2 5.02
_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
50 GLU -7.29 -1.54 0
26 ALA -8.29 -2.24 0
10 MET 2.10 1.96 1
11 PHE 5.15 4.14 1
12 VAL 6.81 5.15 1
13 SER 4.79 3.47 1
14 ALA 3.77 2.31 1
15 LEU 3.74 2.69 1
16 ILE 5.87 4.77 1
17 ARG 4.82 3.92 1
18 ARG 4.18 3.61 1
19 VAL 6.95 4.47 1
20 PHE 5.34 4.29 1
21 ALA 3.57 2.22 1
22 ALA -0.32 -0.87 1
25 PHE -4.49 -1.27 1
27 ALA -4.82 -0.95 1
28 VAL 2.90 1.95 1
29 GLU 0.47 1.09 1
30 LYS -3.87 -0.83 1
31 LYS 0.60 -0.11 1
33 ALA 0.25 0.17 1
34 GLU 4.56 4.61 1
35 ALA 3.53 2.62 1
36 ALA -1.66 -1.31 1
38 ALA -0.79 0.18 1
39 ILE -1.14 0.33 1
40 PHE -3.51 -1.32 1
41 VAL -4.13 -1.91 1
42 ARG -4.46 -1.93 1
43 GLN -5.22 -2.92 1
44 ARG -0.01 0.32 1
45 LEU -0.94 -1.13 1
46 ARG 3.98 2.77 1
47 ASP 0.17 -0.94 1
49 ARG -0.42 -0.09 1
51 ASN -5.66 -2.74 1
52 LEU -6.11 -2.21 1
53 TYR -3.25 -1.97 1
56 ALA -0.99 -0.99 1
58 GLN -0.60 -0.07 1
59 SER -0.58 -0.63 1
60 PHE -0.00 -0.08 1
61 ALA -0.37 -0.03 1
62 ASP 0.05 0.16 1
63 ASP 0.81 0.51 1
64 GLU 0.49 0.70 1
65 ASP 0.65 0.45 1
66 ILE 2.22 1.65 1
67 MET 1.61 0.54 1
68 ARG 0.17 0.03 1
69 ALA -1.51 -0.59 1
70 GLU -1.54 -0.67 1
71 ARG 0.97 0.96 1
72 ARG -4.35 -1.70 1
73 PHE -4.17 -0.34 1
74 GLU -7.12 -3.62 1
75 THR 4.66 2.50 1
76 ARG -0.17 -0.14 1
77 LEU -5.79 -0.88 1
78 ALA -4.15 -2.18 1
80 VAL -4.24 -2.91 1
81 GLU -1.61 -0.97 1
83 GLU 3.70 2.80 1
84 GLU 3.04 2.61 1
85 ILE 4.92 2.96 1
86 ALA 3.77 2.60 1
87 ALA 3.42 2.27 1
88 LEU 3.98 3.19 1
89 LEU 3.30 2.38 1
90 GLU 3.95 2.91 1
91 ARG 4.72 3.54 1
92 GLU 3.89 2.06 1
93 ARG 2.32 1.74 1
94 ARG 3.79 2.46 1
95 PHE 0.39 0.51 1
96 ASP -1.63 -1.10 1
97 SER 2.14 1.75 1
98 ASP -0.99 0.18 1
99 LEU 0.72 0.59 1
100 TRP -4.06 -1.87 1
101 VAL -1.48 -0.20 1
102 VAL -2.96 -1.21 1
103 GLU -4.38 -2.44 1
104 ILE -5.26 -1.87 1
105 GLU -2.50 -1.24 1
106 THR 1.17 -1.03 1
107 ASP 1.21 1.57 1
108 GLU -3.09 -2.04 1
109 ILE -1.10 -0.95 1
111 THR 0.63 -0.51 1
112 LEU 0.65 1.56 1
113 LEU -5.21 -2.72 1
114 THR 2.59 1.04 1
115 LEU -3.07 -2.15 1
116 VAL 0.13 -0.64 1
117 ASP -0.64 -0.61 1
118 GLN -0.58 -0.24 1
120 GLN -0.30 -0.17 1
121 ALA 0.19 1.18 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr16476_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -8.29
_LACS_plot.Line_1_terminator_val_y_1 4.94
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -1.21
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.61
_LACS_plot.Line_2_terminator_val_x_2 6.94
_LACS_plot.Line_2_terminator_val_y_2 -1.92
_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
50 GLU -7.29 5.75 0
26 ALA -8.29 6.05 0
10 MET 2.10 -0.14 1
11 PHE 5.15 -1.01 1
12 VAL 6.81 -1.66 1
13 SER 4.79 -1.32 1
14 ALA 3.77 -1.46 1
15 LEU 3.74 -1.05 1
16 ILE 5.87 -1.10 1
17 ARG 4.82 -0.90 1
18 ARG 4.18 -0.57 1
19 VAL 6.95 -2.48 1
20 PHE 5.34 -1.05 1
21 ALA 3.57 -1.35 1
22 ALA -0.32 -0.55 1
25 PHE -4.49 3.22 1
27 ALA -4.82 3.87 1
28 VAL 2.90 -0.95 1
29 GLU 0.47 0.62 1
30 LYS -3.87 3.04 1
31 LYS 0.60 -0.71 1
33 ALA 0.25 -0.08 1
34 GLU 4.56 0.05 1
35 ALA 3.53 -0.91 1
36 ALA -1.66 0.35 1
38 ALA -0.79 0.97 1
39 ILE -1.14 1.47 1
40 PHE -3.51 2.19 1
41 VAL -4.13 2.22 1
42 ARG -4.46 2.53 1
43 GLN -5.22 2.30 1
44 ARG -0.01 0.33 1
45 LEU -0.94 -0.19 1
46 ARG 3.98 -1.21 1
47 ASP 0.17 -1.11 1
49 ARG -0.42 0.33 1
51 ASN -5.66 2.92 1
52 LEU -6.11 3.90 1
53 TYR -3.25 1.28 1
56 ALA -0.99 0.00 1
58 GLN -0.60 0.53 1
59 SER -0.58 -0.05 1
60 PHE -0.00 -0.08 1
61 ALA -0.37 0.34 1
62 ASP 0.05 0.11 1
63 ASP 0.81 -0.30 1
64 GLU 0.49 0.21 1
65 ASP 0.65 -0.20 1
66 ILE 2.22 -0.57 1
67 MET 1.61 -1.07 1
68 ARG 0.17 -0.14 1
69 ALA -1.51 0.92 1
70 GLU -1.54 0.87 1
71 ARG 0.97 -0.01 1
72 ARG -4.35 2.65 1
73 PHE -4.17 3.83 1
74 GLU -7.12 3.50 1
75 THR 4.66 -2.16 1
76 ARG -0.17 0.03 1
77 LEU -5.79 4.91 1
78 ALA -4.15 1.97 1
80 VAL -4.24 1.33 1
81 GLU -1.61 0.64 1
83 GLU 3.70 -0.90 1
84 GLU 3.04 -0.43 1
85 ILE 4.92 -1.96 1
86 ALA 3.77 -1.17 1
87 ALA 3.42 -1.15 1
88 LEU 3.98 -0.79 1
89 LEU 3.30 -0.92 1
90 GLU 3.95 -1.04 1
91 ARG 4.72 -1.18 1
92 GLU 3.89 -1.83 1
93 ARG 2.32 -0.58 1
94 ARG 3.79 -1.33 1
95 PHE 0.39 0.12 1
96 ASP -1.63 0.53 1
97 SER 2.14 -0.39 1
98 ASP -0.99 1.17 1
99 LEU 0.72 -0.13 1
100 TRP -4.06 2.19 1
101 VAL -1.48 1.28 1
102 VAL -2.96 1.75 1
103 GLU -4.38 1.94 1
104 ILE -5.26 3.39 1
105 GLU -2.50 1.26 1
106 THR 1.17 -2.20 1
107 ASP 1.21 0.36 1
108 GLU -3.09 1.05 1
109 ILE -1.10 0.15 1
111 THR 0.63 -1.14 1
112 LEU 0.65 0.91 1
113 LEU -5.21 2.49 1
114 THR 2.59 -1.55 1
115 LEU -3.07 0.92 1
116 VAL 0.13 -0.77 1
117 ASP -0.64 0.03 1
118 GLN -0.58 0.34 1
120 GLN -0.30 0.13 1
121 ALA 0.19 0.99 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr16476_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -8.29
_LACS_plot.Line_1_terminator_val_y_1 0.87
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.28
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.16
_LACS_plot.Line_2_terminator_val_x_2 6.94
_LACS_plot.Line_2_terminator_val_y_2 -0.84
_LACS_plot.Y_axis_chem_shift_offset 0.06
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
25 PHE -4.49 -0.84 0
10 MET 2.10 -0.28 1
11 PHE 5.15 -0.90 1
12 VAL 6.81 -1.10 1
13 SER 4.79 -0.57 1
14 ALA 3.77 -0.46 1
15 LEU 3.74 -0.70 1
16 ILE 5.87 -1.11 1
17 ARG 4.82 -0.36 1
18 ARG 4.18 -0.47 1
19 VAL 6.95 -0.82 1
20 PHE 5.34 -0.40 1
21 ALA 3.57 -0.22 1
22 ALA -0.32 0.04 1
26 ALA -8.29 0.62 1
27 ALA -4.82 0.01 1
28 VAL 2.90 -0.15 1
29 GLU 0.47 -0.07 1
30 LYS -3.87 0.03 1
31 LYS 0.60 -1.05 1
33 ALA 0.25 -0.15 1
34 GLU 4.56 -0.22 1
35 ALA 3.53 0.06 1
36 ALA -1.66 0.29 1
38 ALA -0.79 -0.27 1
39 ILE -1.14 0.36 1
40 PHE -3.51 0.62 1
41 VAL -4.13 0.86 1
42 ARG -4.46 0.75 1
43 GLN -5.22 1.03 1
44 ARG -0.01 0.15 1
45 LEU -0.94 0.14 1
46 ARG 3.98 -0.41 1
47 ASP 0.17 -0.27 1
49 ARG -0.42 -0.03 1
50 GLU -7.29 1.03 1
51 ASN -5.66 0.41 1
52 LEU -6.11 0.93 1
53 TYR -3.25 0.97 1
56 ALA -0.99 -0.38 1
58 GLN -0.60 -0.26 1
59 SER -0.58 -0.22 1
60 PHE -0.00 -0.13 1
61 ALA -0.37 -0.15 1
62 ASP 0.05 -0.23 1
63 ASP 0.81 -0.29 1
64 GLU 0.49 -0.34 1
65 ASP 0.65 -0.27 1
66 ILE 2.22 -0.46 1
67 MET 1.61 -0.25 1
68 ARG 0.17 -0.14 1
69 ALA -1.51 -0.07 1
70 GLU -1.54 -0.12 1
71 ARG 0.97 -0.64 1
72 ARG -4.35 0.30 1
73 PHE -4.17 0.40 1
74 GLU -7.12 0.65 1
75 THR 4.66 -0.24 1
76 ARG -0.17 -0.06 1
77 LEU -5.79 0.14 1
78 ALA -4.15 0.68 1
80 VAL -4.24 0.52 1
81 GLU -1.61 0.10 1
83 GLU 3.70 -0.38 1
84 GLU 3.04 -0.35 1
85 ILE 4.92 -0.81 1
86 ALA 3.77 -0.53 1
87 ALA 3.42 -0.31 1
88 LEU 3.98 -0.30 1
89 LEU 3.30 -0.85 1
90 GLU 3.95 -0.62 1
91 ARG 4.72 -0.58 1
92 GLU 3.89 -0.33 1
93 ARG 2.32 -0.34 1
94 ARG 3.79 -0.55 1
95 PHE 0.39 -0.15 1
96 ASP -1.63 0.06 1
97 SER 2.14 -0.27 1
98 ASP -0.99 0.04 1
99 LEU 0.72 0.46 1
100 TRP -4.06 0.10 1
101 VAL -1.48 0.90 1
102 VAL -2.96 0.43 1
103 GLU -4.38 1.03 1
104 ILE -5.26 0.85 1
105 GLU -2.50 0.45 1
106 THR 1.17 0.07 1
107 ASP 1.21 -0.01 1
108 GLU -3.09 0.17 1
109 ILE -1.10 -0.32 1
111 THR 0.63 -0.10 1
112 LEU 0.65 -0.45 1
113 LEU -5.21 -0.01 1
114 THR 2.59 -0.27 1
115 LEU -3.07 0.65 1
116 VAL 0.13 0.02 1
117 ASP -0.64 -0.08 1
118 GLN -0.58 -0.11 1
120 GLN -0.30 -0.17 1
121 ALA 0.19 -0.34 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr16476_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -8.29
_LACS_plot.Line_1_terminator_val_y_1 -3.23
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 0.64
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -0.90
_LACS_plot.Line_2_terminator_val_x_2 6.94
_LACS_plot.Line_2_terminator_val_y_2 2.34
_LACS_plot.Y_axis_chem_shift_offset 0.14
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
96 ASP -1.63 3.17 0
20 PHE 5.34 5.17 0
88 LEU 3.98 -2.68 0
10 MET 2.10 1.87 1
11 PHE 5.15 1.80 1
12 VAL 6.81 0.37 1
13 SER 4.79 2.35 1
14 ALA 3.77 1.35 1
15 LEU 3.74 0.02 1
16 ILE 5.87 1.31 1
17 ARG 4.82 3.58 1
18 ARG 4.18 0.33 1
19 VAL 6.95 1.01 1
21 ALA 3.57 0.63 1
22 ALA -0.32 -0.14 1
25 PHE -4.49 -3.38 1
26 ALA -8.29 -3.96 1
27 ALA -4.82 -2.26 1
28 VAL 2.90 -0.75 1
29 GLU 0.47 -0.42 1
30 LYS -3.87 -2.37 1
31 LYS 0.60 -1.43 1
33 ALA 0.25 3.23 1
34 GLU 4.56 0.54 1
35 ALA 3.53 2.46 1
36 ALA -1.66 -0.33 1
39 ILE -1.14 -3.65 1
40 PHE -3.51 -0.24 1
41 VAL -4.13 -2.07 1
42 ARG -4.46 -3.10 1
43 GLN -5.22 -1.72 1
44 ARG -0.01 -0.88 1
45 LEU -0.94 2.29 1
46 ARG 3.98 0.81 1
47 ASP 0.17 0.82 1
49 ARG -0.42 -2.10 1
50 GLU -7.29 -1.01 1
51 ASN -5.66 -1.64 1
52 LEU -6.11 -3.39 1
53 TYR -3.25 -0.43 1
58 GLN -0.60 -0.63 1
59 SER -0.58 -0.53 1
60 PHE -0.00 -0.36 1
61 ALA -0.37 1.49 1
62 ASP 0.05 -0.23 1
63 ASP 0.81 0.32 1
64 GLU 0.49 0.05 1
65 ASP 0.65 1.16 1
66 ILE 2.22 0.40 1
67 MET 1.61 0.42 1
68 ARG 0.17 -0.77 1
69 ALA -1.51 -0.95 1
70 GLU -1.54 -0.27 1
71 ARG 0.97 -0.88 1
72 ARG -4.35 -1.25 1
73 PHE -4.17 -2.64 1
74 GLU -7.12 -1.04 1
75 THR 4.66 0.36 1
76 ARG -0.17 0.27 1
77 LEU -5.79 -3.09 1
78 ALA -4.15 -1.46 1
80 VAL -4.24 -1.09 1
81 GLU -1.61 2.36 1
83 GLU 3.70 2.45 1
84 GLU 3.04 3.08 1
85 ILE 4.92 0.91 1
86 ALA 3.77 2.54 1
87 ALA 3.42 2.47 1
89 LEU 3.30 1.25 1
90 GLU 3.95 2.14 1
91 ARG 4.72 2.62 1
92 GLU 3.89 3.65 1
93 ARG 2.32 1.29 1
94 ARG 3.79 1.69 1
95 PHE 0.39 -0.07 1
97 SER 2.14 0.95 1
98 ASP -0.99 -0.75 1
99 LEU 0.72 -1.38 1
100 TRP -4.06 0.64 1
101 VAL -1.48 -0.48 1
102 VAL -2.96 -2.91 1
103 GLU -4.38 -1.54 1
104 ILE -5.26 -2.67 1
105 GLU -2.50 -1.77 1
106 THR 1.17 -2.52 1
107 ASP 1.21 -0.09 1
108 GLU -3.09 -1.26 1
109 ILE -1.10 -0.08 1
111 THR 0.63 0.72 1
112 LEU 0.65 -1.88 1
113 LEU -5.21 -2.04 1
114 THR 2.59 -1.58 1
115 LEU -3.07 0.89 1
116 VAL 0.13 -0.66 1
117 ASP -0.64 -0.69 1
120 GLN -0.30 -1.25 1
stop_
save_