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 bmr16233_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -7.44
_LACS_plot.Line_1_terminator_val_y_1 -3.09
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 0.99
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.15
_LACS_plot.Line_2_terminator_val_x_2 9.93
_LACS_plot.Line_2_terminator_val_y_2 6.94
_LACS_plot.Y_axis_chem_shift_offset -0.17
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
24 LEU 1.82 -1.14 0
35 ARG -7.05 -2.12 0
53 GLU 3.18 4.67 0
42 SER 9.93 5.30 0
47 GLU -7.44 -2.19 0
36 TYR -0.44 -2.67 0
10 ARG 4.14 3.38 1
11 LYS 4.97 1.27 1
13 ALA 4.54 2.75 1
14 GLN 5.31 3.45 1
15 PHE 2.62 0.29 1
17 LYS 4.39 3.40 1
18 GLU 3.62 2.87 1
19 SER 6.74 5.24 1
21 ASN 3.53 2.38 1
22 SER 0.89 0.72 1
25 ALA 2.97 2.71 1
26 SER 3.93 2.67 1
27 TYR 1.19 2.10 1
30 ALA -2.30 -1.03 1
31 ALA 0.20 0.04 1
32 ILE -5.02 -1.68 1
33 TYR -4.92 -0.88 1
34 ALA -3.85 -1.15 1
37 ASP -4.52 -1.06 1
38 LYS -0.73 0.50 1
40 ASN -0.84 1.45 1
43 GLN 0.34 -1.07 1
44 GLN 1.02 0.23 1
45 THR -1.06 -1.05 1
46 LYS 0.95 0.89 1
48 TRP 0.95 2.33 1
49 ARG -6.14 -3.23 1
51 TYR -3.80 -0.58 1
52 ILE 1.27 1.05 1
54 LYS 2.80 1.94 1
55 GLU -0.49 -0.13 1
56 LEU -5.32 -2.19 1
57 ASP -1.77 -2.19 1
58 PHE 4.66 2.90 1
59 SER 0.64 1.08 1
60 LYS -4.26 -1.40 1
61 SER -2.41 -1.21 1
63 ASP 1.88 -0.48 1
66 VAL -6.51 -3.72 1
67 ASP -1.84 -2.11 1
68 ASP 2.39 2.42 1
71 SER -0.66 -0.65 1
72 MET 2.99 -0.33 1
73 THR -2.97 -1.72 1
74 SER -1.08 -0.85 1
76 ARG -0.02 0.38 1
78 SER -4.83 -2.87 1
79 VAL 3.12 1.88 1
80 SER -0.71 -0.54 1
83 SER -0.68 -1.04 1
84 THR 0.40 1.30 1
85 SER -0.51 -0.95 1
86 HIS -4.04 -0.47 1
87 LEU -3.71 -2.62 1
88 THR 3.28 2.34 1
89 ARG -2.83 -1.38 1
91 SER 4.76 3.29 1
92 GLU 3.89 3.68 1
93 LEU 4.87 2.69 1
94 GLN 3.44 2.47 1
95 ALA 3.71 2.57 1
96 VAL 5.52 3.92 1
97 ILE 6.52 5.56 1
98 ASP 3.84 3.29 1
99 SER 2.08 2.25 1
100 ASP 1.00 1.10 1
101 LYS 6.43 4.72 1
102 SER 3.41 2.44 1
103 ASN 2.13 1.61 1
104 TYR -1.54 0.90 1
106 THR -0.63 0.01 1
107 ASP 0.53 0.58 1
108 LYS 0.59 0.31 1
109 SER 0.64 0.72 1
110 GLU -0.19 -0.04 1
111 GLN -0.26 0.12 1
112 GLN 0.02 0.18 1
114 SER 0.47 0.44 1
115 GLN -0.17 0.25 1
116 ALA -0.49 -0.11 1
117 THR -0.08 -0.25 1
121 GLU -0.64 -0.22 1
122 ILE -2.89 -2.66 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr16233_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -7.44
_LACS_plot.Line_1_terminator_val_y_1 4.35
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -1.01
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.85
_LACS_plot.Line_2_terminator_val_x_2 9.93
_LACS_plot.Line_2_terminator_val_y_2 -2.99
_LACS_plot.Y_axis_chem_shift_offset -0.17
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
24 LEU 1.82 -2.96 0
35 ARG -7.05 4.93 0
53 GLU 3.18 1.49 0
42 SER 9.93 -4.63 0
47 GLU -7.44 5.25 0
36 TYR -0.44 -2.23 0
10 ARG 4.14 -0.76 1
11 LYS 4.97 -3.70 1
13 ALA 4.54 -1.79 1
14 GLN 5.31 -1.86 1
15 PHE 2.62 -2.33 1
17 LYS 4.39 -0.99 1
18 GLU 3.62 -0.75 1
19 SER 6.74 -1.50 1
21 ASN 3.53 -1.15 1
22 SER 0.89 -0.17 1
25 ALA 2.97 -0.26 1
26 SER 3.93 -1.26 1
27 TYR 1.19 0.91 1
30 ALA -2.30 1.27 1
31 ALA 0.20 -0.16 1
32 ILE -5.02 3.34 1
33 TYR -4.92 4.04 1
34 ALA -3.85 2.70 1
37 ASP -4.52 3.46 1
38 LYS -0.73 1.23 1
40 ASN -0.84 2.29 1
43 GLN 0.34 -1.41 1
44 GLN 1.02 -0.79 1
45 THR -1.06 0.01 1
46 LYS 0.95 -0.06 1
48 TRP 0.95 1.38 1
49 ARG -6.14 2.91 1
51 TYR -3.80 3.22 1
52 ILE 1.27 -0.22 1
54 LYS 2.80 -0.86 1
55 GLU -0.49 0.36 1
56 LEU -5.32 3.13 1
57 ASP -1.77 -0.42 1
58 PHE 4.66 -1.76 1
59 SER 0.64 0.44 1
60 LYS -4.26 2.86 1
61 SER -2.41 1.20 1
63 ASP 1.88 -2.36 1
66 VAL -6.51 2.79 1
67 ASP -1.84 -0.27 1
68 ASP 2.39 0.03 1
71 SER -0.66 0.01 1
72 MET 2.99 -3.32 1
73 THR -2.97 1.25 1
74 SER -1.08 0.23 1
76 ARG -0.02 0.40 1
78 SER -4.83 1.96 1
79 VAL 3.12 -1.24 1
80 SER -0.71 0.17 1
83 SER -0.68 -0.36 1
84 THR 0.40 0.90 1
85 SER -0.51 -0.44 1
86 HIS -4.04 3.57 1
87 LEU -3.71 1.09 1
88 THR 3.28 -0.94 1
89 ARG -2.83 1.45 1
91 SER 4.76 -1.47 1
92 GLU 3.89 -0.21 1
93 LEU 4.87 -2.18 1
94 GLN 3.44 -0.97 1
95 ALA 3.71 -1.14 1
96 VAL 5.52 -1.60 1
97 ILE 6.52 -0.96 1
98 ASP 3.84 -0.55 1
99 SER 2.08 0.17 1
100 ASP 1.00 0.10 1
101 LYS 6.43 -1.71 1
102 SER 3.41 -0.97 1
103 ASN 2.13 -0.52 1
104 TYR -1.54 2.44 1
106 THR -0.63 0.64 1
107 ASP 0.53 0.05 1
108 LYS 0.59 -0.28 1
109 SER 0.64 0.08 1
110 GLU -0.19 0.15 1
111 GLN -0.26 0.38 1
112 GLN 0.02 0.16 1
114 SER 0.47 -0.03 1
115 GLN -0.17 0.42 1
116 ALA -0.49 0.38 1
117 THR -0.08 -0.17 1
121 GLU -0.64 0.42 1
122 ILE -2.89 0.23 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr16233_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -7.44
_LACS_plot.Line_1_terminator_val_y_1 0.66
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.08
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.19
_LACS_plot.Line_2_terminator_val_x_2 9.93
_LACS_plot.Line_2_terminator_val_y_2 -0.60
_LACS_plot.Y_axis_chem_shift_offset -0.07
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
42 SER 9.93 0.15 0
34 ALA -3.85 1.57 0
10 ARG 4.14 -0.26 1
11 LYS 4.97 -0.35 1
13 ALA 4.54 -0.20 1
14 GLN 5.31 -0.26 1
15 PHE 2.62 0.13 1
17 LYS 4.39 -0.20 1
18 GLU 3.62 -0.29 1
19 SER 6.74 -0.36 1
21 ASN 3.53 -0.22 1
22 SER 0.89 0.14 1
24 LEU 1.82 0.47 1
25 ALA 2.97 0.08 1
26 SER 3.93 -0.38 1
27 TYR 1.19 -0.44 1
30 ALA -2.30 0.20 1
31 ALA 0.20 0.03 1
32 ILE -5.02 0.99 1
33 TYR -4.92 0.20 1
35 ARG -7.05 1.03 1
36 TYR -0.44 -0.38 1
37 ASP -4.52 -0.25 1
38 LYS -0.73 -0.17 1
43 GLN 0.34 0.34 1
44 GLN 1.02 -0.15 1
45 THR -1.06 -0.12 1
46 LYS 0.95 -0.78 1
47 GLU -7.44 0.05 1
48 TRP 0.95 0.27 1
49 ARG -6.14 0.71 1
51 TYR -3.80 0.43 1
52 ILE 1.27 0.71 1
53 GLU 3.18 -0.36 1
54 LYS 2.80 0.04 1
55 GLU -0.49 0.32 1
56 LEU -5.32 -0.13 1
57 ASP -1.77 0.26 1
58 PHE 4.66 -0.57 1
59 SER 0.64 0.11 1
60 LYS -4.26 0.27 1
61 SER -2.41 0.53 1
63 ASP 1.88 0.49 1
66 VAL -6.51 1.20 1
67 ASP -1.84 0.02 1
68 ASP 2.39 0.03 1
71 SER -0.66 0.20 1
72 MET 2.99 0.65 1
73 THR -2.97 0.28 1
74 SER -1.08 0.51 1
76 ARG -0.02 0.13 1
78 SER -4.83 -0.09 1
79 VAL 3.12 -0.31 1
80 SER -0.71 0.06 1
83 SER -0.68 0.36 1
84 THR 0.40 0.33 1
85 SER -0.51 0.12 1
86 HIS -4.04 0.58 1
87 LEU -3.71 0.34 1
88 THR 3.28 -0.15 1
89 ARG -2.83 0.36 1
91 SER 4.76 -0.57 1
92 GLU 3.89 -0.28 1
93 LEU 4.87 -0.22 1
94 GLN 3.44 -0.72 1
95 ALA 3.71 -0.08 1
96 VAL 5.52 -0.38 1
97 ILE 6.52 -0.76 1
98 ASP 3.84 -0.35 1
99 SER 2.08 -0.07 1
100 ASP 1.00 0.24 1
101 LYS 6.43 -0.02 1
102 SER 3.41 -0.17 1
103 ASN 2.13 -0.28 1
104 TYR -1.54 0.03 1
106 THR -0.63 0.12 1
107 ASP 0.53 0.00 1
108 LYS 0.59 0.09 1
109 SER 0.64 -0.07 1
110 GLU -0.19 -0.01 1
111 GLN -0.26 -0.03 1
115 GLN -0.17 0.05 1
116 ALA -0.49 0.05 1
121 GLU -0.64 -0.09 1
122 ILE -2.89 0.33 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr16233_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -7.44
_LACS_plot.Line_1_terminator_val_y_1 -2.70
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 0.83
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -0.78
_LACS_plot.Line_2_terminator_val_x_2 6.74
_LACS_plot.Line_2_terminator_val_y_2 2.53
_LACS_plot.Y_axis_chem_shift_offset -0.03
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
15 PHE 2.62 4.36 0
32 ILE -5.02 -4.45 0
66 VAL -6.51 0.47 0
10 ARG 4.14 3.20 1
11 LYS 4.97 1.98 1
13 ALA 4.54 2.92 1
14 GLN 5.31 2.89 1
17 LYS 4.39 2.51 1
18 GLU 3.62 3.52 1
19 SER 6.74 1.90 1
21 ASN 3.53 1.27 1
22 SER 0.89 -0.72 1
24 LEU 1.82 -1.72 1
25 ALA 2.97 2.54 1
26 SER 3.93 2.84 1
27 TYR 1.19 1.54 1
30 ALA -2.30 -0.52 1
31 ALA 0.20 -2.18 1
33 TYR -4.92 -1.18 1
34 ALA -3.85 1.65 1
35 ARG -7.05 -2.23 1
36 TYR -0.44 -3.16 1
37 ASP -4.52 0.51 1
38 LYS -0.73 -0.37 1
40 ASN -0.84 0.58 1
43 GLN 0.34 -0.60 1
44 GLN 1.02 -0.16 1
45 THR -1.06 -1.26 1
46 LYS 0.95 -2.28 1
47 GLU -7.44 -1.74 1
48 TRP 0.95 -0.15 1
49 ARG -6.14 -2.65 1
51 TYR -3.80 0.93 1
52 ILE 1.27 1.13 1
53 GLU 3.18 0.99 1
54 LYS 2.80 0.76 1
55 GLU -0.49 -0.90 1
56 LEU -5.32 -3.08 1
57 ASP -1.77 2.44 1
58 PHE 4.66 -0.46 1
59 SER 0.64 -1.26 1
60 LYS -4.26 -1.60 1
61 SER -2.41 -1.20 1
63 ASP 1.88 -0.37 1
67 ASP -1.84 0.35 1
68 ASP 2.39 -1.34 1
71 SER -0.66 -1.13 1
72 MET 2.99 1.10 1
73 THR -2.97 -3.56 1
74 SER -1.08 0.94 1
76 ARG -0.02 0.36 1
78 SER -4.83 -1.48 1
79 VAL 3.12 0.47 1
80 SER -0.71 -0.54 1
83 SER -0.68 0.34 1
84 THR 0.40 1.39 1
85 SER -0.51 -1.61 1
86 HIS -4.04 0.02 1
87 LEU -3.71 -0.75 1
88 THR 3.28 0.39 1
89 ARG -2.83 -2.55 1
91 SER 4.76 3.16 1
92 GLU 3.89 2.87 1
93 LEU 4.87 0.87 1
94 GLN 3.44 1.44 1
95 ALA 3.71 2.86 1
96 VAL 5.52 1.17 1
97 ILE 6.52 1.16 1
98 ASP 3.84 2.84 1
99 SER 2.08 2.99 1
100 ASP 1.00 2.79 1
101 LYS 6.43 0.99 1
102 SER 3.41 2.12 1
103 ASN 2.13 -0.06 1
104 TYR -1.54 -0.39 1
106 THR -0.63 -0.57 1
107 ASP 0.53 -0.01 1
108 LYS 0.59 0.26 1
109 SER 0.64 0.00 1
110 GLU -0.19 -0.25 1
111 GLN -0.26 -0.28 1
112 GLN 0.02 -0.41 1
114 SER 0.47 0.11 1
115 GLN -0.17 -0.56 1
116 ALA -0.49 -0.29 1
117 THR -0.08 -0.82 1
121 GLU -0.64 -0.57 1
122 ILE -2.89 -2.64 1
stop_
save_