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 bmr16832_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -8.86
_LACS_plot.Line_1_terminator_val_y_1 -3.37
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 1.00
_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 6.92
_LACS_plot.Line_2_terminator_val_y_2 5.23
_LACS_plot.Y_axis_chem_shift_offset -0.19
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
136 VAL -8.86 -5.91 0
52 PHE 5.91 6.39 0
12 SER 0.23 0.46 1
13 SER 1.09 0.65 1
14 LEU 0.42 0.35 1
15 SER 0.07 0.22 1
17 PHE -0.13 0.13 1
18 VAL -0.51 -0.30 1
19 ASN -0.24 -0.02 1
21 GLN 0.61 0.47 1
22 SER 0.19 0.30 1
26 HIS -0.38 0.15 1
27 ALA -0.13 0.20 1
29 GLN 0.19 0.24 1
30 THR 0.11 0.10 1
31 ASN 0.03 0.05 1
32 PHE 1.21 0.85 1
33 ALA 0.79 0.79 1
34 ASN 1.65 1.85 1
37 SER -0.17 0.26 1
38 ALA -1.49 -0.03 1
39 ARG -2.58 -0.58 1
40 VAL -4.67 -1.88 1
41 THR -0.15 0.03 1
42 LEU -5.47 -2.25 1
44 LYS 4.95 5.08 1
45 SER 5.50 4.49 1
46 LEU 0.18 -0.73 1
47 VAL -1.50 1.87 1
48 TYR 2.75 1.78 1
49 ASP 3.23 1.95 1
50 LYS -5.17 -3.75 1
51 THR -0.41 -0.51 1
53 SER 6.92 4.53 1
54 LYS 4.24 3.72 1
55 VAL 6.09 5.40 1
56 LEU 2.81 3.65 1
57 TRP 4.24 1.95 1
58 SER 5.53 4.93 1
59 ALA -0.02 -0.31 1
61 LEU -0.27 1.31 1
62 VAL -6.59 -3.80 1
63 ALA 0.45 1.41 1
64 SER -4.23 -2.05 1
65 LYS 4.88 3.32 1
66 SER 4.84 3.88 1
67 GLU 2.40 2.56 1
69 GLN 3.39 2.73 1
70 ARG 4.55 3.88 1
71 ILE 4.37 3.09 1
72 ILE 3.70 3.08 1
73 ASN 3.28 2.19 1
74 ASN -0.41 -0.42 1
75 ASN 3.15 1.52 1
77 ALA -6.77 -2.50 1
78 TYR -5.80 -1.10 1
79 VAL -6.50 -4.06 1
81 SER -3.04 -0.99 1
82 ARG -0.95 0.17 1
85 VAL -0.04 0.02 1
86 LYS -0.03 0.02 1
87 LYS -0.06 0.19 1
88 ASN 0.31 0.22 1
89 GLU -0.86 0.05 1
96 ASP 0.28 0.37 1
97 ASP -0.25 -0.29 1
98 LEU -2.07 -0.12 1
99 THR -2.68 -1.21 1
100 PHE -1.49 0.57 1
101 THR -4.93 -2.54 1
103 ILE 1.70 1.20 1
104 LYS -2.94 -3.14 1
105 THR 2.98 0.55 1
106 TRP -3.86 -1.46 1
107 ASN 0.92 1.00 1
108 ALA 3.19 2.90 1
109 SER 2.32 1.71 1
110 LYS 0.08 0.30 1
111 THR 6.18 4.90 1
112 GLN 3.22 1.20 1
113 GLU 2.95 1.70 1
114 PHE 1.01 1.34 1
115 ILE 2.36 1.65 1
116 ILE -1.80 -0.56 1
117 ASP 2.53 1.26 1
119 ASP 0.95 -1.34 1
120 LEU -4.46 -1.22 1
121 LEU -6.37 -1.56 1
122 ILE -0.61 0.41 1
123 LEU -7.03 -2.36 1
124 LYS -5.92 -1.04 1
125 LEU -3.98 -1.86 1
127 LYS 1.92 1.72 1
128 TRP -2.70 -0.30 1
129 LYS 0.25 0.36 1
130 MET -4.73 -0.65 1
131 LYS -5.33 -1.45 1
132 LEU -0.53 -0.43 1
133 VAL -1.06 -1.41 1
134 SER -0.71 -0.44 1
135 ILE -1.30 -0.76 1
137 SER -0.84 -0.28 1
138 ASP 5.37 3.94 1
139 GLU 4.33 3.67 1
140 LYS 3.20 1.56 1
141 PHE 4.45 5.03 1
142 LYS 3.25 3.25 1
143 GLU 2.63 2.66 1
144 LEU -0.26 0.52 1
146 LEU -1.92 -1.58 1
147 THR -2.13 -1.66 1
148 ALA -1.86 0.50 1
151 TRP -1.01 1.27 1
152 ASP 3.25 1.93 1
153 GLU 1.19 1.37 1
154 VAL 3.26 2.29 1
155 VAL 1.47 0.74 1
157 LYS 0.10 0.21 1
159 LYS -0.24 0.02 1
160 GLU 0.90 2.15 1
163 SER -3.34 -2.56 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr16832_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -8.86
_LACS_plot.Line_1_terminator_val_y_1 5.49
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -1.00
_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 6.92
_LACS_plot.Line_2_terminator_val_y_2 -1.69
_LACS_plot.Y_axis_chem_shift_offset -0.19
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
136 VAL -8.86 2.95 0
52 PHE 5.91 0.48 0
12 SER 0.23 0.23 1
13 SER 1.09 -0.44 1
14 LEU 0.42 -0.07 1
15 SER 0.07 0.15 1
17 PHE -0.13 0.26 1
18 VAL -0.51 0.21 1
19 ASN -0.24 0.22 1
21 GLN 0.61 -0.14 1
22 SER 0.19 0.11 1
26 HIS -0.38 0.53 1
27 ALA -0.13 0.33 1
29 GLN 0.19 0.05 1
30 THR 0.11 -0.01 1
31 ASN 0.03 0.02 1
32 PHE 1.21 -0.36 1
33 ALA 0.79 0.00 1
34 ASN 1.65 0.20 1
37 SER -0.17 0.43 1
38 ALA -1.49 1.46 1
39 ARG -2.58 2.00 1
40 VAL -4.67 2.79 1
41 THR -0.15 0.18 1
42 LEU -5.47 3.22 1
44 LYS 4.95 0.13 1
45 SER 5.50 -1.01 1
46 LEU 0.18 -0.91 1
47 VAL -1.50 3.37 1
48 TYR 2.75 -0.97 1
49 ASP 3.23 -1.28 1
50 LYS -5.17 1.42 1
51 THR -0.41 -0.10 1
53 SER 6.92 -2.39 1
54 LYS 4.24 -0.52 1
55 VAL 6.09 -0.69 1
56 LEU 2.81 0.84 1
57 TRP 4.24 -2.29 1
58 SER 5.53 -0.60 1
59 ALA -0.02 -0.29 1
61 LEU -0.27 1.58 1
62 VAL -6.59 2.79 1
63 ALA 0.45 0.96 1
64 SER -4.23 2.18 1
65 LYS 4.88 -1.56 1
66 SER 4.84 -0.96 1
67 GLU 2.40 0.16 1
69 GLN 3.39 -0.66 1
70 ARG 4.55 -0.67 1
71 ILE 4.37 -1.28 1
72 ILE 3.70 -0.62 1
73 ASN 3.28 -1.09 1
74 ASN -0.41 -0.01 1
75 ASN 3.15 -1.63 1
77 ALA -6.77 4.27 1
78 TYR -5.80 4.70 1
79 VAL -6.50 2.44 1
81 SER -3.04 2.05 1
82 ARG -0.95 1.12 1
85 VAL -0.04 0.06 1
86 LYS -0.03 0.05 1
87 LYS -0.06 0.25 1
88 ASN 0.31 -0.09 1
89 GLU -0.86 0.91 1
96 ASP 0.28 0.09 1
97 ASP -0.25 -0.04 1
98 LEU -2.07 1.95 1
99 THR -2.68 1.47 1
100 PHE -1.49 2.06 1
101 THR -4.93 2.39 1
103 ILE 1.70 -0.50 1
104 LYS -2.94 -0.20 1
105 THR 2.98 -2.43 1
106 TRP -3.86 2.40 1
107 ASN 0.92 0.08 1
108 ALA 3.19 -0.29 1
109 SER 2.32 -0.61 1
110 LYS 0.08 0.22 1
111 THR 6.18 -1.28 1
112 GLN 3.22 -2.02 1
113 GLU 2.95 -1.25 1
114 PHE 1.01 0.33 1
115 ILE 2.36 -0.71 1
116 ILE -1.80 1.24 1
117 ASP 2.53 -1.27 1
119 ASP 0.95 -2.29 1
120 LEU -4.46 3.24 1
121 LEU -6.37 4.81 1
122 ILE -0.61 1.02 1
123 LEU -7.03 4.67 1
124 LYS -5.92 4.88 1
125 LEU -3.98 2.12 1
127 LYS 1.92 -0.20 1
128 TRP -2.70 2.40 1
129 LYS 0.25 0.11 1
130 MET -4.73 4.08 1
131 LYS -5.33 3.88 1
132 LEU -0.53 0.10 1
133 VAL -1.06 -0.35 1
134 SER -0.71 0.27 1
135 ILE -1.30 0.54 1
137 SER -0.84 0.56 1
138 ASP 5.37 -1.43 1
139 GLU 4.33 -0.66 1
140 LYS 3.20 -1.64 1
141 PHE 4.45 0.58 1
142 LYS 3.25 0.00 1
143 GLU 2.63 0.03 1
144 LEU -0.26 0.78 1
146 LEU -1.92 0.34 1
147 THR -2.13 0.47 1
148 ALA -1.86 2.36 1
151 TRP -1.01 2.28 1
152 ASP 3.25 -1.32 1
153 GLU 1.19 0.18 1
154 VAL 3.26 -0.97 1
155 VAL 1.47 -0.73 1
157 LYS 0.10 0.11 1
159 LYS -0.24 0.26 1
160 GLU 0.90 1.25 1
163 SER -3.34 0.78 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr16832_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -8.86
_LACS_plot.Line_1_terminator_val_y_1 0.89
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.19
_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 6.92
_LACS_plot.Line_2_terminator_val_y_2 -0.67
_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
120 LEU -4.46 1.38 0
53 SER 6.92 0.25 0
12 SER 0.23 -0.07 1
14 LEU 0.42 0.05 1
15 SER 0.07 -0.07 1
17 PHE -0.13 0.11 1
18 VAL -0.51 -0.08 1
19 ASN -0.24 -0.17 1
21 GLN 0.61 0.02 1
26 HIS -0.38 -0.09 1
27 ALA -0.13 -0.05 1
29 GLN 0.19 0.01 1
30 THR 0.11 -0.07 1
31 ASN 0.03 -0.06 1
32 PHE 1.21 -0.10 1
33 ALA 0.79 -0.15 1
34 ASN 1.65 -0.35 1
37 SER -0.17 0.10 1
38 ALA -1.49 0.33 1
39 ARG -2.58 0.94 1
40 VAL -4.67 0.48 1
41 THR -0.15 0.97 1
42 LEU -5.47 -0.15 1
44 LYS 4.95 -0.74 1
45 SER 5.50 0.00 1
46 LEU 0.18 0.25 1
47 VAL -1.50 -0.07 1
48 TYR 2.75 0.17 1
49 ASP 3.23 -0.69 1
50 LYS -5.17 0.51 1
51 THR -0.41 -0.02 1
52 PHE 5.91 -0.44 1
54 LYS 4.24 -0.05 1
55 VAL 6.09 -0.58 1
56 LEU 2.81 -0.53 1
57 TRP 4.24 -0.08 1
58 SER 5.53 -0.61 1
59 ALA -0.02 -0.24 1
61 LEU -0.27 -0.04 1
62 VAL -6.59 0.55 1
63 ALA 0.45 0.07 1
64 SER -4.23 -0.23 1
65 LYS 4.88 0.40 1
66 SER 4.84 -0.37 1
67 GLU 2.40 -0.23 1
69 GLN 3.39 -0.49 1
70 ARG 4.55 -0.41 1
71 ILE 4.37 -0.39 1
72 ILE 3.70 -0.37 1
73 ASN 3.28 -0.36 1
74 ASN -0.41 0.06 1
75 ASN 3.15 -0.34 1
77 ALA -6.77 0.89 1
78 TYR -5.80 0.63 1
79 VAL -6.50 1.39 1
81 SER -3.04 0.28 1
82 ARG -0.95 0.54 1
85 VAL -0.04 0.01 1
86 LYS -0.03 -0.01 1
87 LYS -0.06 -0.05 1
88 ASN 0.31 -0.05 1
89 GLU -0.86 0.00 1
96 ASP 0.28 -0.08 1
97 ASP -0.25 -0.06 1
98 LEU -2.07 0.16 1
99 THR -2.68 0.14 1
100 PHE -1.49 0.50 1
101 THR -4.93 0.72 1
103 ILE 1.70 -0.88 1
104 LYS -2.94 -0.07 1
105 THR 2.98 -0.19 1
106 TRP -3.86 0.41 1
108 ALA 3.19 0.39 1
109 SER 2.32 -0.05 1
110 LYS 0.08 -0.31 1
111 THR 6.18 -0.60 1
112 GLN 3.22 0.00 1
113 GLU 2.95 -0.41 1
114 PHE 1.01 -0.18 1
115 ILE 2.36 -0.01 1
116 ILE -1.80 0.17 1
117 ASP 2.53 -0.31 1
121 LEU -6.37 0.57 1
122 ILE -0.61 0.68 1
123 LEU -7.03 1.06 1
124 LYS -5.92 0.79 1
125 LEU -3.98 0.67 1
127 LYS 1.92 -0.62 1
128 TRP -2.70 0.28 1
129 LYS 0.25 0.15 1
130 MET -4.73 0.77 1
131 LYS -5.33 0.70 1
132 LEU -0.53 0.34 1
133 VAL -1.06 0.65 1
134 SER -0.71 0.73 1
135 ILE -1.30 0.87 1
136 VAL -8.86 0.76 1
137 SER -0.84 -0.23 1
138 ASP 5.37 -0.25 1
139 GLU 4.33 -0.28 1
140 LYS 3.20 -0.17 1
141 PHE 4.45 -0.99 1
142 LYS 3.25 -0.06 1
143 GLU 2.63 -0.36 1
144 LEU -0.26 -0.24 1
146 LEU -1.92 -0.25 1
147 THR -2.13 0.12 1
148 ALA -1.86 0.14 1
151 TRP -1.01 0.08 1
152 ASP 3.25 -0.49 1
153 GLU 1.19 -0.25 1
154 VAL 3.26 -0.36 1
155 VAL 1.47 -0.38 1
157 LYS 0.10 -0.07 1
159 LYS -0.24 0.00 1
160 GLU 0.90 -0.33 1
163 SER -3.34 0.16 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr16832_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -8.86
_LACS_plot.Line_1_terminator_val_y_1 -3.55
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.45
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.67
_LACS_plot.Line_2_terminator_val_x_2 6.92
_LACS_plot.Line_2_terminator_val_y_2 0.92
_LACS_plot.Y_axis_chem_shift_offset 1.06
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
136 VAL -8.86 -2.30 0
45 SER 5.50 4.00 0
12 SER 0.23 -0.30 1
13 SER 1.09 -0.70 1
14 LEU 0.42 -2.50 1
15 SER 0.07 -0.30 1
17 PHE -0.13 -1.10 1
18 VAL -0.51 -1.90 1
21 GLN 0.61 0.20 1
22 SER 0.19 -0.40 1
26 HIS -0.38 -0.60 1
29 GLN 0.19 -0.60 1
30 THR 0.11 1.80 1
31 ASN 0.03 0.00 1
32 PHE 1.21 -0.70 1
33 ALA 0.79 -1.20 1
37 SER -0.17 -1.00 1
38 ALA -1.49 -2.50 1
39 ARG -2.58 -1.10 1
40 VAL -4.67 -4.50 1
41 THR -0.15 -2.10 1
44 LYS 4.95 -2.40 1
46 LEU 0.18 -3.50 1
47 VAL -1.50 -3.00 1
48 TYR 2.75 0.50 1
49 ASP 3.23 0.80 1
50 LYS -5.17 -1.80 1
51 THR -0.41 0.80 1
52 PHE 5.91 -1.80 1
53 SER 6.92 -0.40 1
54 LYS 4.24 0.20 1
55 VAL 6.09 -2.10 1
56 LEU 2.81 1.20 1
57 TRP 4.24 2.80 1
58 SER 5.53 -1.20 1
59 ALA -0.02 -2.10 1
61 LEU -0.27 -2.60 1
62 VAL -6.59 -1.30 1
63 ALA 0.45 -1.40 1
64 SER -4.23 -1.50 1
65 LYS 4.88 -1.10 1
66 SER 4.84 -1.50 1
67 GLU 2.40 0.10 1
69 GLN 3.39 -2.80 1
70 ARG 4.55 0.50 1
71 ILE 4.37 1.80 1
72 ILE 3.70 1.90 1
73 ASN 3.28 1.00 1
74 ASN -0.41 0.10 1
75 ASN 3.15 -1.20 1
77 ALA -6.77 -3.50 1
78 TYR -5.80 -3.50 1
79 VAL -6.50 -2.00 1
81 SER -3.04 -3.00 1
85 VAL -0.04 -1.10 1
86 LYS -0.03 -1.10 1
87 LYS -0.06 -1.10 1
88 ASN 0.31 -1.30 1
96 ASP 0.28 -1.00 1
97 ASP -0.25 -1.60 1
98 LEU -2.07 -1.70 1
99 THR -2.68 -2.70 1
100 PHE -1.49 -1.20 1
103 ILE 1.70 -3.20 1
104 LYS -2.94 -1.40 1
105 THR 2.98 -0.70 1
106 TRP -3.86 0.20 1
107 ASN 0.92 1.30 1
108 ALA 3.19 -0.90 1
109 SER 2.32 -0.70 1
110 LYS 0.08 0.70 1
111 THR 6.18 0.80 1
113 GLU 2.95 0.20 1
114 PHE 1.01 -1.20 1
115 ILE 2.36 -0.80 1
116 ILE -1.80 -2.10 1
117 ASP 2.53 -1.50 1
119 ASP 0.95 -1.50 1
120 LEU -4.46 -3.40 1
121 LEU -6.37 -2.90 1
122 ILE -0.61 -2.30 1
123 LEU -7.03 -3.10 1
124 LYS -5.92 -3.50 1
125 LEU -3.98 -2.20 1
127 LYS 1.92 0.40 1
128 TRP -2.70 -0.60 1
129 LYS 0.25 -3.20 1
130 MET -4.73 -1.80 1
131 LYS -5.33 -3.60 1
132 LEU -0.53 -3.00 1
133 VAL -1.06 -1.10 1
134 SER -0.71 -1.80 1
135 ILE -1.30 0.30 1
137 SER -0.84 -1.00 1
138 ASP 5.37 -0.60 1
139 GLU 4.33 1.90 1
140 LYS 3.20 -0.90 1
141 PHE 4.45 1.30 1
142 LYS 3.25 2.80 1
143 GLU 2.63 1.50 1
144 LEU -0.26 -0.30 1
146 LEU -1.92 -3.80 1
147 THR -2.13 -3.20 1
151 TRP -1.01 -0.40 1
152 ASP 3.25 0.60 1
153 GLU 1.19 0.20 1
154 VAL 3.26 0.60 1
155 VAL 1.47 -0.10 1
157 LYS 0.10 -0.30 1
159 LYS -0.24 -0.90 1
stop_
save_