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 bmr18053_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -6.80
_LACS_plot.Line_1_terminator_val_y_1 -2.72
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 0.68
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.71
_LACS_plot.Line_2_terminator_val_x_2 4.73
_LACS_plot.Line_2_terminator_val_y_2 3.54
_LACS_plot.Y_axis_chem_shift_offset 0.12
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
98 TRP -2.85 -4.20 0
90 HIS 0.37 3.65 0
19 SER -1.49 -0.30 1
20 ALA -1.05 0.26 1
21 SER -0.14 0.22 1
23 SER 0.91 1.44 1
24 VAL -0.75 -1.15 1
25 SER -4.39 -3.03 1
26 ILE 1.07 0.23 1
27 GLU -1.41 -1.17 1
28 GLU -1.64 0.31 1
29 ILE -3.08 -1.57 1
30 ASP -1.98 -0.27 1
31 LEU 3.18 2.02 1
32 GLU -0.51 -0.84 1
34 LYS 3.75 3.76 1
35 PHE -2.07 -1.07 1
36 VAL -2.83 0.49 1
37 GLN -6.80 -1.58 1
38 LEU -5.05 -2.40 1
39 LYS -6.36 -1.21 1
40 ASN -0.64 -1.98 1
41 ASN 0.18 0.88 1
42 SER -3.45 -1.01 1
43 ASP 0.10 -0.68 1
44 LYS -4.47 -2.19 1
45 ASP 1.53 0.79 1
46 GLN -4.63 -2.56 1
47 SER 1.24 0.41 1
48 LEU -2.94 -3.00 1
50 ASN 4.74 3.26 1
51 TRP 2.82 1.26 1
52 ARG -6.10 -1.88 1
53 ILE -2.13 -0.70 1
54 LYS -3.53 -1.59 1
56 GLN -2.93 -0.87 1
57 VAL -0.28 -0.38 1
58 LEU 2.84 1.81 1
59 GLU 2.17 0.42 1
61 GLU -1.36 -0.40 1
62 GLU -3.36 -0.95 1
63 ILE -3.30 -0.92 1
64 ALA -4.11 -0.97 1
65 TYR -2.46 -0.99 1
66 LYS -4.14 -2.46 1
67 PHE -0.07 1.31 1
68 THR 2.83 1.05 1
70 LYS 0.10 -1.21 1
71 TYR 4.43 4.41 1
72 ILE -3.90 -1.79 1
73 LEU -3.28 -3.13 1
74 ARG 1.46 0.85 1
75 ALA 1.48 1.29 1
77 GLN -1.81 -1.14 1
78 MET -5.63 -1.33 1
79 VAL -3.51 -2.73 1
80 THR 0.71 0.32 1
81 VAL 1.13 -0.82 1
82 TRP -2.16 -1.06 1
83 ALA 0.06 -0.29 1
84 ALA 2.82 2.30 1
86 ALA -0.81 0.64 1
88 VAL -1.41 -0.93 1
89 ALA -1.41 -1.22 1
91 SER 0.37 -0.56 1
94 SER 3.31 3.57 1
95 THR 0.03 0.51 1
96 LEU -4.41 -3.02 1
97 VAL -1.48 -0.68 1
99 LYS 3.26 2.34 1
101 GLN -1.27 -3.08 1
102 SER 4.68 3.68 1
103 SER -2.53 -1.67 1
104 TRP 3.47 2.63 1
106 THR -2.90 -2.17 1
108 GLU 1.49 1.75 1
109 SER -1.82 -1.18 1
110 PHE -2.07 -0.91 1
112 THR -1.17 0.02 1
113 VAL -5.63 -2.10 1
114 LEU -5.39 -1.91 1
115 VAL -4.46 -2.87 1
116 ASN -0.43 -2.69 1
117 ALA 2.90 2.00 1
118 ASP -0.70 -0.13 1
120 GLU -1.81 -1.77 1
121 GLU 1.15 0.20 1
122 VAL -0.69 -0.54 1
123 ALA -2.91 0.26 1
124 MET -2.74 -0.30 1
125 ARG -3.09 0.39 1
126 THR -1.06 -0.42 1
127 VAL -1.95 -1.09 1
128 LYS -2.88 -1.31 1
129 LYS 0.28 0.54 1
130 SER 0.12 0.13 1
131 SER 0.18 0.19 1
132 VAL 0.76 0.25 1
133 MET 0.35 -0.05 1
134 ARG 0.29 0.09 1
135 GLU 0.44 0.31 1
136 ASN 0.15 0.09 1
137 GLU 0.22 0.31 1
138 ASN -0.34 0.09 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr18053_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -6.80
_LACS_plot.Line_1_terminator_val_y_1 4.08
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -1.32
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.29
_LACS_plot.Line_2_terminator_val_x_2 4.73
_LACS_plot.Line_2_terminator_val_y_2 -1.19
_LACS_plot.Y_axis_chem_shift_offset 0.12
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
98 TRP -2.85 -1.35 0
90 HIS 0.37 3.28 0
19 SER -1.49 1.19 1
20 ALA -1.05 1.31 1
21 SER -0.14 0.36 1
23 SER 0.91 0.53 1
24 VAL -0.75 -0.40 1
25 SER -4.39 1.36 1
26 ILE 1.07 -0.84 1
27 GLU -1.41 0.24 1
28 GLU -1.64 1.95 1
29 ILE -3.08 1.51 1
30 ASP -1.98 1.71 1
31 LEU 3.18 -1.16 1
32 GLU -0.51 -0.33 1
34 LYS 3.75 0.01 1
35 PHE -2.07 1.00 1
36 VAL -2.83 3.32 1
37 GLN -6.80 5.22 1
38 LEU -5.05 2.65 1
39 LYS -6.36 5.15 1
40 ASN -0.64 -1.34 1
41 ASN 0.18 0.70 1
42 SER -3.45 2.44 1
43 ASP 0.10 -0.78 1
44 LYS -4.47 2.28 1
45 ASP 1.53 -0.74 1
46 GLN -4.63 2.07 1
47 SER 1.24 -0.83 1
48 LEU -2.94 -0.06 1
50 ASN 4.74 -1.48 1
51 TRP 2.82 -1.56 1
52 ARG -6.10 4.22 1
53 ILE -2.13 1.43 1
54 LYS -3.53 1.94 1
56 GLN -2.93 2.06 1
57 VAL -0.28 -0.10 1
58 LEU 2.84 -1.03 1
59 GLU 2.17 -1.75 1
61 GLU -1.36 0.96 1
62 GLU -3.36 2.41 1
63 ILE -3.30 2.38 1
64 ALA -4.11 3.14 1
65 TYR -2.46 1.47 1
66 LYS -4.14 1.68 1
67 PHE -0.07 1.38 1
68 THR 2.83 -1.78 1
70 LYS 0.10 -1.31 1
71 TYR 4.43 -0.02 1
72 ILE -3.90 2.11 1
73 LEU -3.28 0.15 1
74 ARG 1.46 -0.61 1
75 ALA 1.48 -0.19 1
77 GLN -1.81 0.67 1
78 MET -5.63 4.30 1
79 VAL -3.51 0.78 1
80 THR 0.71 -0.39 1
81 VAL 1.13 -1.95 1
82 TRP -2.16 1.10 1
83 ALA 0.06 -0.35 1
84 ALA 2.82 -0.52 1
86 ALA -0.81 1.45 1
88 VAL -1.41 0.48 1
89 ALA -1.41 0.19 1
91 SER 0.37 -0.93 1
94 SER 3.31 0.26 1
95 THR 0.03 0.48 1
96 LEU -4.41 1.39 1
97 VAL -1.48 0.80 1
99 LYS 3.26 -0.92 1
101 GLN -1.27 -1.81 1
102 SER 4.68 -1.00 1
103 SER -2.53 0.86 1
104 TRP 3.47 -0.84 1
106 THR -2.90 0.73 1
108 GLU 1.49 0.26 1
109 SER -1.82 0.64 1
110 PHE -2.07 1.16 1
112 THR -1.17 1.19 1
113 VAL -5.63 3.53 1
114 LEU -5.39 3.48 1
115 VAL -4.46 1.59 1
116 ASN -0.43 -2.26 1
117 ALA 2.90 -0.90 1
118 ASP -0.70 0.57 1
120 GLU -1.81 0.04 1
121 GLU 1.15 -0.95 1
122 VAL -0.69 0.15 1
123 ALA -2.91 3.17 1
124 MET -2.74 2.44 1
125 ARG -3.09 3.48 1
126 THR -1.06 0.64 1
127 VAL -1.95 0.86 1
128 LYS -2.88 1.57 1
129 LYS 0.28 0.26 1
130 SER 0.12 0.01 1
131 SER 0.18 0.01 1
132 VAL 0.76 -0.51 1
133 MET 0.35 -0.40 1
134 ARG 0.29 -0.20 1
135 GLU 0.44 -0.13 1
136 ASN 0.15 -0.06 1
137 GLU 0.22 0.09 1
138 ASN -0.34 0.43 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr18053_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -6.80
_LACS_plot.Line_1_terminator_val_y_1 0.90
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.27
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.25
_LACS_plot.Line_2_terminator_val_x_2 4.73
_LACS_plot.Line_2_terminator_val_y_2 -0.62
_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
116 ASN -0.43 -1.84 0
48 LEU -2.94 -1.71 0
19 SER -1.49 0.11 1
20 ALA -1.05 0.39 1
21 SER -0.14 0.04 1
23 SER 0.91 -0.11 1
24 VAL -0.75 0.92 1
25 SER -4.39 0.20 1
26 ILE 1.07 0.01 1
27 GLU -1.41 -0.12 1
28 GLU -1.64 -0.18 1
29 ILE -3.08 -0.41 1
30 ASP -1.98 -0.46 1
31 LEU 3.18 -0.28 1
32 GLU -0.51 -0.07 1
34 LYS 3.75 0.24 1
35 PHE -2.07 0.89 1
36 VAL -2.83 -0.41 1
37 GLN -6.80 1.11 1
38 LEU -5.05 1.08 1
39 LYS -6.36 0.53 1
40 ASN -0.64 0.05 1
41 ASN 0.18 -0.15 1
42 SER -3.45 0.25 1
43 ASP 0.10 -0.17 1
44 LYS -4.47 0.25 1
45 ASP 1.53 -0.66 1
46 GLN -4.63 0.10 1
47 SER 1.24 -0.24 1
50 ASN 4.74 -0.49 1
51 TRP 2.82 -0.18 1
52 ARG -6.10 1.63 1
53 ILE -2.13 0.82 1
54 LYS -3.53 1.14 1
56 GLN -2.93 0.50 1
57 VAL -0.28 0.15 1
58 LEU 2.84 -0.26 1
59 GLU 2.17 -0.24 1
61 GLU -1.36 -0.03 1
62 GLU -3.36 0.70 1
63 ILE -3.30 0.62 1
64 ALA -4.11 1.20 1
65 TYR -2.46 -1.46 1
66 LYS -4.14 0.50 1
67 PHE -0.07 -0.69 1
68 THR 2.83 -0.19 1
70 LYS 0.10 0.06 1
71 TYR 4.43 -0.82 1
72 ILE -3.90 -0.24 1
73 LEU -3.28 0.15 1
74 ARG 1.46 -0.60 1
75 ALA 1.48 -0.80 1
77 GLN -1.81 0.02 1
78 MET -5.63 0.91 1
79 VAL -3.51 0.84 1
80 THR 0.71 0.24 1
81 VAL 1.13 0.48 1
82 TRP -2.16 0.68 1
83 ALA 0.06 -0.01 1
84 ALA 2.82 -0.37 1
86 ALA -0.81 0.02 1
88 VAL -1.41 -0.54 1
89 ALA -1.41 -0.13 1
90 HIS 0.37 -0.70 1
91 SER 0.37 -0.15 1
94 SER 3.31 0.21 1
95 THR 0.03 0.51 1
96 LEU -4.41 0.79 1
97 VAL -1.48 0.75 1
98 TRP -2.85 0.30 1
99 LYS 3.26 -0.48 1
101 GLN -1.27 -0.37 1
102 SER 4.68 -0.60 1
103 SER -2.53 -0.23 1
104 TRP 3.47 -0.56 1
106 THR -2.90 -0.49 1
108 GLU 1.49 -0.21 1
109 SER -1.82 0.49 1
110 PHE -2.07 0.46 1
112 THR -1.17 1.12 1
113 VAL -5.63 0.74 1
114 LEU -5.39 0.98 1
115 VAL -4.46 0.73 1
117 ALA 2.90 -0.45 1
118 ASP -0.70 0.00 1
120 GLU -1.81 -0.24 1
121 GLU 1.15 -0.07 1
122 VAL -0.69 0.24 1
123 ALA -2.91 0.57 1
124 MET -2.74 0.81 1
125 ARG -3.09 0.56 1
126 THR -1.06 0.33 1
127 VAL -1.95 0.03 1
128 LYS -2.88 0.39 1
129 LYS 0.28 -0.01 1
130 SER 0.12 -0.09 1
131 SER 0.18 -0.06 1
132 VAL 0.76 -0.08 1
133 MET 0.35 -0.10 1
134 ARG 0.29 -0.08 1
135 GLU 0.44 -0.19 1
136 ASN 0.15 -0.12 1
137 GLU 0.22 -0.20 1
138 ASN -0.34 -0.03 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr18053_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -6.80
_LACS_plot.Line_1_terminator_val_y_1 -2.32
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.15
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.18
_LACS_plot.Line_2_terminator_val_x_2 4.73
_LACS_plot.Line_2_terminator_val_y_2 0.59
_LACS_plot.Y_axis_chem_shift_offset 0.65
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
67 PHE -0.07 2.19 0
30 ASP -1.98 2.02 0
19 SER -1.49 -0.59 1
20 ALA -1.05 -0.57 1
21 SER -0.14 0.14 1
23 SER 0.91 -1.17 1
24 VAL -0.75 -1.69 1
25 SER -4.39 -0.17 1
26 ILE 1.07 -0.89 1
27 GLU -1.41 -1.42 1
28 GLU -1.64 -1.90 1
29 ILE -3.08 -2.23 1
31 LEU 3.18 -0.09 1
32 GLU -0.51 0.46 1
34 LYS 3.75 0.48 1
35 PHE -2.07 -1.62 1
36 VAL -2.83 -3.63 1
37 GLN -6.80 -1.20 1
38 LEU -5.05 -2.01 1
39 LYS -6.36 -3.29 1
40 ASN -0.64 -0.70 1
41 ASN 0.18 -0.39 1
42 SER -3.45 -1.80 1
43 ASP 0.10 -0.96 1
44 LYS -4.47 -1.20 1
45 ASP 1.53 -1.49 1
46 GLN -4.63 -1.98 1
47 SER 1.24 -0.04 1
48 LEU -2.94 -0.81 1
50 ASN 4.74 -0.24 1
51 TRP 2.82 -0.53 1
52 ARG -6.10 -0.49 1
53 ILE -2.13 -0.73 1
54 LYS -3.53 -1.03 1
56 GLN -2.93 -1.01 1
57 VAL -0.28 -0.38 1
58 LEU 2.84 -0.44 1
59 GLU 2.17 -0.37 1
61 GLU -1.36 -0.88 1
62 GLU -3.36 -0.67 1
63 ILE -3.30 -1.75 1
64 ALA -4.11 -3.19 1
65 TYR -2.46 -2.86 1
66 LYS -4.14 -1.69 1
70 LYS 0.10 -0.28 1
71 TYR 4.43 -1.06 1
72 ILE -3.90 -3.43 1
73 LEU -3.28 -1.77 1
74 ARG 1.46 -1.07 1
75 ALA 1.48 0.64 1
77 GLN -1.81 -2.06 1
78 MET -5.63 -0.49 1
79 VAL -3.51 -4.08 1
80 THR 0.71 -2.48 1
81 VAL 1.13 0.37 1
82 TRP -2.16 0.78 1
83 ALA 0.06 0.34 1
84 ALA 2.82 1.72 1
86 ALA -0.81 -0.11 1
88 VAL -1.41 -1.45 1
89 ALA -1.41 -1.12 1
90 HIS 0.37 1.69 1
94 SER 3.31 0.25 1
95 THR 0.03 -2.61 1
96 LEU -4.41 -1.68 1
97 VAL -1.48 -0.07 1
98 TRP -2.85 -2.71 1
99 LYS 3.26 0.98 1
102 SER 4.68 -0.06 1
103 SER -2.53 -0.51 1
104 TRP 3.47 -0.03 1
106 THR -2.90 -1.83 1
108 GLU 1.49 -0.25 1
109 SER -1.82 -0.81 1
110 PHE -2.07 0.25 1
112 THR -1.17 -2.32 1
113 VAL -5.63 -3.17 1
114 LEU -5.39 -3.36 1
115 VAL -4.46 -1.09 1
116 ASN -0.43 1.68 1
117 ALA 2.90 -0.03 1
118 ASP -0.70 -0.25 1
120 GLU -1.81 -1.01 1
121 GLU 1.15 0.22 1
122 VAL -0.69 -0.30 1
123 ALA -2.91 -2.54 1
124 MET -2.74 -1.87 1
126 THR -1.06 -2.26 1
127 VAL -1.95 -2.36 1
128 LYS -2.88 -1.07 1
129 LYS 0.28 -0.03 1
130 SER 0.12 -0.04 1
131 SER 0.18 -0.14 1
132 VAL 0.76 -0.23 1
133 MET 0.35 -0.26 1
134 ARG 0.29 0.00 1
135 GLU 0.44 -0.52 1
136 ASN 0.15 0.11 1
137 GLU 0.22 -0.36 1
138 ASN -0.34 -0.65 1
stop_
save_