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 bmr10089_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -7.98
_LACS_plot.Line_1_terminator_val_y_1 -2.71
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 0.86
_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 6.93
_LACS_plot.Line_2_terminator_val_y_2 5.21
_LACS_plot.Y_axis_chem_shift_offset -0.21
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
96 ALA 0.50 4.85 0
155 SER -2.40 3.53 0
10 ARG 0.49 0.30 1
12 HIS 1.45 1.72 1
13 GLN 2.15 1.81 1
14 TRP 1.37 -0.08 1
15 GLN 4.37 3.47 1
16 THR 4.37 3.15 1
17 ASP 4.46 3.10 1
18 GLU 4.48 3.80 1
19 GLU 2.84 2.27 1
21 VAL 4.30 3.30 1
22 ARG 3.70 3.49 1
23 THR -1.21 -0.23 1
25 LYS -1.79 -1.16 1
27 SER -3.90 -2.52 1
28 PHE -5.27 -1.26 1
30 VAL -7.98 -2.54 1
31 LYS -1.09 -1.03 1
32 TYR -1.38 -1.66 1
33 LEU 0.80 0.72 1
35 HIS -5.06 -2.71 1
36 VAL -6.19 -2.85 1
37 GLU 0.56 0.49 1
38 VAL -6.18 -2.89 1
39 ASP -0.03 1.32 1
40 GLU -7.34 -2.55 1
41 SER 0.66 -0.01 1
42 ARG -3.45 -1.91 1
44 MET 5.00 4.83 1
45 HIS 4.20 3.53 1
46 ILE 3.83 0.65 1
48 GLU 2.28 2.11 1
49 ASP 2.47 2.80 1
50 ALA 3.45 3.66 1
51 VAL 5.79 4.90 1
52 LYS 4.69 4.24 1
53 ARG 4.04 3.62 1
54 LEU 3.23 2.59 1
55 LYS 4.04 2.90 1
56 ALA 1.57 1.34 1
57 THR 0.78 1.50 1
59 LYS 0.38 0.03 1
60 LYS 0.70 0.27 1
61 ALA -2.46 -0.89 1
62 VAL -2.70 -0.70 1
63 LYS 2.95 1.74 1
64 ALA -6.75 -1.07 1
65 VAL -1.91 -0.02 1
66 LEU -4.18 -1.71 1
67 TRP -2.90 -2.49 1
68 VAL -1.19 -0.40 1
69 SER -5.11 -1.69 1
70 ALA 1.89 1.65 1
71 ASP -0.82 0.21 1
73 LEU -3.54 -2.30 1
74 ARG -4.58 -1.14 1
75 VAL -0.96 -1.15 1
76 VAL -3.84 -1.81 1
77 ASP -1.00 1.76 1
78 GLU 2.22 2.94 1
79 LYS 2.06 2.25 1
80 THR -0.49 0.49 1
81 LYS 5.61 1.45 1
82 ASP 0.14 0.63 1
83 LEU 0.80 0.24 1
84 ILE 2.01 2.44 1
85 VAL -3.65 -0.32 1
86 ASP -2.20 -0.95 1
87 GLN -5.34 -1.91 1
88 THR 1.06 0.18 1
89 ILE 0.86 0.37 1
90 GLU 3.25 2.46 1
91 LYS -0.76 -0.49 1
92 VAL 2.59 1.44 1
93 SER 0.41 1.13 1
94 PHE -3.91 0.64 1
98 ASP -6.01 0.39 1
99 ARG 2.61 2.11 1
100 ASN 0.60 1.33 1
101 PHE -1.90 -1.21 1
102 ASP 3.52 2.92 1
103 ARG 0.82 0.46 1
104 ALA -2.28 -0.31 1
105 PHE -5.09 -0.48 1
106 SER -4.83 -0.86 1
107 TYR -4.87 -1.45 1
108 ILE -3.26 -1.30 1
110 ARG -1.73 -0.95 1
111 ASP -1.75 -0.43 1
113 THR 2.85 2.06 1
114 THR -0.70 -0.04 1
115 ARG 3.95 0.86 1
116 ARG -2.25 -1.02 1
117 TRP -1.89 -0.70 1
118 ILE -3.75 -2.26 1
120 HIS -4.44 0.63 1
122 PHE -5.20 -0.96 1
123 MET -3.33 -1.92 1
124 ALA 0.83 0.71 1
125 VAL 2.78 3.17 1
126 LYS -1.65 -0.70 1
127 ASP -5.98 -0.86 1
128 THR -3.15 -2.00 1
130 GLU 3.18 2.67 1
131 ARG 5.07 3.58 1
132 LEU 6.88 4.13 1
133 SER 4.01 3.22 1
134 HIS 5.76 4.32 1
135 ALA 5.37 3.63 1
136 VAL 6.94 4.77 1
139 ALA 4.55 3.18 1
140 PHE 3.70 2.88 1
141 ALA 3.69 2.62 1
142 ALA 3.25 2.26 1
144 LEU 3.59 2.73 1
145 GLU 2.42 2.27 1
146 ARG 2.93 2.48 1
147 LYS 2.17 1.74 1
148 GLN 1.35 1.00 1
149 LYS 0.99 0.64 1
150 ARG 0.27 0.23 1
151 SER -0.14 0.17 1
154 SER -5.67 0.41 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr10089_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -7.98
_LACS_plot.Line_1_terminator_val_y_1 5.27
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -1.14
_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 6.93
_LACS_plot.Line_2_terminator_val_y_2 -1.72
_LACS_plot.Y_axis_chem_shift_offset -0.21
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
96 ALA 0.50 4.35 0
155 SER -2.40 5.93 0
10 ARG 0.49 -0.19 1
12 HIS 1.45 0.27 1
13 GLN 2.15 -0.34 1
14 TRP 1.37 -1.45 1
15 GLN 4.37 -0.90 1
16 THR 4.37 -1.22 1
17 ASP 4.46 -1.36 1
18 GLU 4.48 -0.68 1
19 GLU 2.84 -0.57 1
21 VAL 4.30 -1.00 1
22 ARG 3.70 -0.21 1
23 THR -1.21 0.98 1
25 LYS -1.79 0.63 1
27 SER -3.90 1.38 1
28 PHE -5.27 4.01 1
30 VAL -7.98 5.44 1
31 LYS -1.09 0.06 1
32 TYR -1.38 -0.28 1
33 LEU 0.80 -0.08 1
35 HIS -5.06 2.35 1
36 VAL -6.19 3.34 1
37 GLU 0.56 -0.07 1
38 VAL -6.18 3.29 1
39 ASP -0.03 1.35 1
40 GLU -7.34 4.79 1
41 SER 0.66 -0.67 1
42 ARG -3.45 1.54 1
44 MET 5.00 -0.17 1
45 HIS 4.20 -0.67 1
46 ILE 3.83 -3.18 1
48 GLU 2.28 -0.17 1
49 ASP 2.47 0.33 1
50 ALA 3.45 0.21 1
51 VAL 5.79 -0.89 1
52 LYS 4.69 -0.45 1
53 ARG 4.04 -0.42 1
54 LEU 3.23 -0.64 1
55 LYS 4.04 -1.14 1
56 ALA 1.57 -0.23 1
57 THR 0.78 0.72 1
59 LYS 0.38 -0.35 1
60 LYS 0.70 -0.43 1
61 ALA -2.46 1.57 1
62 VAL -2.70 2.00 1
63 LYS 2.95 -1.21 1
64 ALA -6.75 5.68 1
65 VAL -1.91 1.89 1
66 LEU -4.18 2.47 1
67 TRP -2.90 0.41 1
68 VAL -1.19 0.79 1
69 SER -5.11 3.42 1
70 ALA 1.89 -0.24 1
71 ASP -0.82 1.03 1
73 LEU -3.54 1.24 1
74 ARG -4.58 3.44 1
75 VAL -0.96 -0.19 1
76 VAL -3.84 2.03 1
77 ASP -1.00 2.76 1
78 GLU 2.22 0.72 1
79 LYS 2.06 0.19 1
80 THR -0.49 0.98 1
81 LYS 5.61 -4.16 1
82 ASP 0.14 0.49 1
83 LEU 0.80 -0.56 1
84 ILE 2.01 0.43 1
85 VAL -3.65 3.33 1
86 ASP -2.20 1.25 1
87 GLN -5.34 3.43 1
88 THR 1.06 -0.88 1
89 ILE 0.86 -0.49 1
90 GLU 3.25 -0.79 1
91 LYS -0.76 0.27 1
92 VAL 2.59 -1.15 1
93 SER 0.41 0.72 1
94 PHE -3.91 4.55 1
98 ASP -6.01 6.40 1
99 ARG 2.61 -0.50 1
100 ASN 0.60 0.73 1
101 PHE -1.90 0.69 1
102 ASP 3.52 -0.60 1
103 ARG 0.82 -0.36 1
104 ALA -2.28 1.97 1
105 PHE -5.09 4.61 1
106 SER -4.83 3.97 1
107 TYR -4.87 3.42 1
108 ILE -3.26 1.96 1
110 ARG -1.73 0.78 1
111 ASP -1.75 1.32 1
113 THR 2.85 -0.79 1
114 THR -0.70 0.66 1
115 ARG 3.95 -3.09 1
116 ARG -2.25 1.23 1
117 TRP -1.89 1.19 1
118 ILE -3.75 1.49 1
120 HIS -4.44 5.07 1
122 PHE -5.20 4.24 1
123 MET -3.33 1.41 1
124 ALA 0.83 -0.12 1
125 VAL 2.78 0.39 1
126 LYS -1.65 0.95 1
127 ASP -5.98 5.12 1
128 THR -3.15 1.15 1
130 GLU 3.18 -0.51 1
131 ARG 5.07 -1.49 1
132 LEU 6.88 -2.75 1
133 SER 4.01 -0.79 1
134 HIS 5.76 -1.44 1
135 ALA 5.37 -1.74 1
136 VAL 6.94 -2.17 1
139 ALA 4.55 -1.37 1
140 PHE 3.70 -0.82 1
141 ALA 3.69 -1.07 1
142 ALA 3.25 -0.99 1
144 LEU 3.59 -0.86 1
145 GLU 2.42 -0.15 1
146 ARG 2.93 -0.45 1
147 LYS 2.17 -0.43 1
148 GLN 1.35 -0.35 1
149 LYS 0.99 -0.35 1
150 ARG 0.27 -0.04 1
151 SER -0.14 0.31 1
154 SER -5.67 6.08 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr10089_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -7.98
_LACS_plot.Line_1_terminator_val_y_1 0.88
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.13
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.28
_LACS_plot.Line_2_terminator_val_x_2 6.93
_LACS_plot.Line_2_terminator_val_y_2 -0.65
_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
41 SER 0.66 -1.64 0
10 ARG 0.49 -0.17 1
12 HIS 1.45 -0.33 1
13 GLN 2.15 -0.27 1
14 TRP 1.37 0.15 1
15 GLN 4.37 -0.13 1
16 THR 4.37 -0.15 1
17 ASP 4.46 -0.17 1
18 GLU 4.48 -0.46 1
19 GLU 2.84 -0.18 1
21 VAL 4.30 -0.01 1
22 ARG 3.70 -0.32 1
23 THR -1.21 0.14 1
25 LYS -1.79 0.42 1
27 SER -3.90 0.44 1
28 PHE -5.27 0.13 1
30 VAL -7.98 1.17 1
31 LYS -1.09 0.66 1
32 TYR -1.38 0.29 1
33 LEU 0.80 -0.42 1
35 HIS -5.06 1.11 1
36 VAL -6.19 0.34 1
37 GLU 0.56 0.53 1
38 VAL -6.18 0.71 1
39 ASP -0.03 0.19 1
40 GLU -7.34 -0.07 1
42 ARG -3.45 -0.75 1
44 MET 5.00 -0.41 1
45 HIS 4.20 -0.26 1
46 ILE 3.83 -0.49 1
48 GLU 2.28 -0.17 1
49 ASP 2.47 -0.21 1
50 ALA 3.45 -0.49 1
51 VAL 5.79 -0.85 1
52 LYS 4.69 -0.53 1
53 ARG 4.04 -0.33 1
54 LEU 3.23 -0.36 1
55 LYS 4.04 -0.38 1
56 ALA 1.57 -0.05 1
57 THR 0.78 -0.10 1
59 LYS 0.38 -0.12 1
60 LYS 0.70 -0.13 1
61 ALA -2.46 0.05 1
62 VAL -2.70 0.23 1
63 LYS 2.95 0.20 1
64 ALA -6.75 1.08 1
65 VAL -1.91 0.38 1
66 LEU -4.18 0.78 1
67 TRP -2.90 -0.01 1
68 VAL -1.19 0.28 1
69 SER -5.11 0.90 1
70 ALA 1.89 -0.25 1
71 ASP -0.82 0.10 1
73 LEU -3.54 1.07 1
74 ARG -4.58 0.84 1
75 VAL -0.96 0.96 1
76 VAL -3.84 0.68 1
77 ASP -1.00 -0.27 1
78 GLU 2.22 -0.29 1
79 LYS 2.06 -0.02 1
80 THR -0.49 -0.09 1
81 LYS 5.61 -0.27 1
82 ASP 0.14 -0.12 1
83 LEU 0.80 0.03 1
84 ILE 2.01 -0.08 1
85 VAL -3.65 0.04 1
86 ASP -2.20 0.35 1
87 GLN -5.34 0.24 1
88 THR 1.06 0.30 1
89 ILE 0.86 -0.25 1
90 GLU 3.25 -0.17 1
91 LYS -0.76 0.22 1
92 VAL 2.59 0.26 1
93 SER 0.41 0.07 1
94 PHE -3.91 0.23 1
96 ALA 0.50 0.13 1
98 ASP -6.01 0.15 1
99 ARG 2.61 -0.21 1
100 ASN 0.60 -0.24 1
101 PHE -1.90 0.28 1
102 ASP 3.52 -0.04 1
103 ARG 0.82 0.22 1
104 ALA -2.28 1.27 1
105 PHE -5.09 0.43 1
106 SER -4.83 1.15 1
107 TYR -4.87 0.86 1
108 ILE -3.26 1.27 1
110 ARG -1.73 0.09 1
111 ASP -1.75 0.04 1
113 THR 2.85 -0.06 1
114 THR -0.70 -0.01 1
115 ARG 3.95 -0.51 1
116 ARG -2.25 -0.10 1
117 TRP -1.89 0.49 1
118 ILE -3.75 0.57 1
120 HIS -4.44 0.13 1
122 PHE -5.20 0.72 1
123 MET -3.33 0.64 1
124 ALA 0.83 0.15 1
125 VAL 2.78 -0.22 1
126 LYS -1.65 0.32 1
127 ASP -5.98 0.50 1
128 THR -3.15 0.26 1
130 GLU 3.18 -0.37 1
131 ARG 5.07 -1.49 1
132 LEU 6.88 -1.57 1
133 SER 4.01 -0.64 1
134 HIS 5.76 -0.53 1
135 ALA 5.37 -0.61 1
136 VAL 6.94 -0.88 1
139 ALA 4.55 -0.56 1
140 PHE 3.70 -0.45 1
141 ALA 3.69 -0.20 1
142 ALA 3.25 -0.14 1
144 LEU 3.59 -0.28 1
145 GLU 2.42 -0.27 1
146 ARG 2.93 -0.17 1
147 LYS 2.17 -0.12 1
148 GLN 1.35 -0.10 1
149 LYS 0.99 -0.03 1
150 ARG 0.27 0.07 1
151 SER -0.14 0.07 1
155 SER -2.40 -0.06 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr10089_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -7.98
_LACS_plot.Line_1_terminator_val_y_1 -2.81
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 0.86
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -0.68
_LACS_plot.Line_2_terminator_val_x_2 6.93
_LACS_plot.Line_2_terminator_val_y_2 2.63
_LACS_plot.Y_axis_chem_shift_offset -0.09
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
132 LEU 6.88 -0.54 0
81 LYS 5.61 -1.37 0
10 ARG 0.49 -0.51 1
12 HIS 1.45 1.80 1
13 GLN 2.15 0.40 1
14 TRP 1.37 1.87 1
15 GLN 4.37 2.57 1
16 THR 4.37 2.50 1
17 ASP 4.46 0.98 1
18 GLU 4.48 1.97 1
19 GLU 2.84 3.14 1
21 VAL 4.30 2.08 1
22 ARG 3.70 1.95 1
23 THR -1.21 0.87 1
25 LYS -1.79 -1.32 1
27 SER -3.90 -2.21 1
28 PHE -5.27 -0.80 1
30 VAL -7.98 -1.77 1
31 LYS -1.09 -0.46 1
32 TYR -1.38 -0.67 1
33 LEU 0.80 -2.34 1
35 HIS -5.06 -0.77 1
36 VAL -6.19 -2.19 1
37 GLU 0.56 -0.14 1
38 VAL -6.18 -0.39 1
39 ASP -0.03 -0.38 1
40 GLU -7.34 -3.27 1
41 SER 0.66 -1.38 1
42 ARG -3.45 -3.23 1
45 HIS 4.20 2.87 1
46 ILE 3.83 2.51 1
48 GLU 2.28 3.76 1
49 ASP 2.47 1.29 1
50 ALA 3.45 0.54 1
51 VAL 5.79 2.08 1
52 LYS 4.69 3.34 1
53 ARG 4.04 3.69 1
54 LEU 3.23 3.22 1
55 LYS 4.04 1.89 1
56 ALA 1.57 1.20 1
57 THR 0.78 1.68 1
59 LYS 0.38 0.28 1
60 LYS 0.70 -0.26 1
61 ALA -2.46 -0.75 1
62 VAL -2.70 0.07 1
63 LYS 2.95 -0.46 1
64 ALA -6.75 -2.71 1
65 VAL -1.91 -1.85 1
66 LEU -4.18 -3.29 1
67 TRP -2.90 0.00 1
68 VAL -1.19 -2.57 1
69 SER -5.11 -1.18 1
70 ALA 1.89 -1.21 1
71 ASP -0.82 0.81 1
73 LEU -3.54 -1.89 1
74 ARG -4.58 -1.54 1
75 VAL -0.96 -1.54 1
76 VAL -3.84 -0.52 1
77 ASP -1.00 1.32 1
78 GLU 2.22 -0.05 1
79 LYS 2.06 2.14 1
80 THR -0.49 1.44 1
82 ASP 0.14 -0.61 1
83 LEU 0.80 -1.06 1
84 ILE 2.01 0.14 1
85 VAL -3.65 -3.06 1
86 ASP -2.20 -2.05 1
87 GLN -5.34 -0.57 1
88 THR 1.06 2.66 1
89 ILE 0.86 0.57 1
90 GLU 3.25 0.62 1
91 LYS -0.76 -0.19 1
92 VAL 2.59 -1.23 1
93 SER 0.41 1.62 1
94 PHE -3.91 -2.74 1
98 ASP -6.01 0.58 1
99 ARG 2.61 0.28 1
100 ASN 0.60 0.11 1
101 PHE -1.90 0.22 1
102 ASP 3.52 -1.17 1
103 ARG 0.82 -0.41 1
104 ALA -2.28 -0.65 1
105 PHE -5.09 -3.70 1
106 SER -4.83 -2.56 1
107 TYR -4.87 -4.19 1
108 ILE -3.26 -1.07 1
110 ARG -1.73 -0.13 1
111 ASP -1.75 0.60 1
113 THR 2.85 1.04 1
114 THR -0.70 -0.15 1
115 ARG 3.95 -1.35 1
116 ARG -2.25 -1.75 1
117 TRP -1.89 -0.99 1
118 ILE -3.75 -2.75 1
120 HIS -4.44 1.43 1
122 PHE -5.20 -0.88 1
123 MET -3.33 -0.34 1
124 ALA 0.83 -1.11 1
125 VAL 2.78 0.36 1
126 LYS -1.65 -1.98 1
127 ASP -5.98 -2.68 1
128 THR -3.15 1.29 1
130 GLU 3.18 1.14 1
131 ARG 5.07 2.53 1
133 SER 4.01 3.41 1
134 HIS 5.76 2.92 1
135 ALA 5.37 1.01 1
136 VAL 6.94 1.54 1
139 ALA 4.55 1.20 1
140 PHE 3.70 2.64 1
142 ALA 3.25 2.04 1
144 LEU 3.59 1.87 1
145 GLU 2.42 2.03 1
146 ARG 2.93 1.75 1
147 LYS 2.17 1.21 1
148 GLN 1.35 0.69 1
149 LYS 0.99 0.23 1
150 ARG 0.27 0.11 1
151 SER -0.14 -0.05 1
154 SER -5.67 0.37 1
155 SER -2.40 -0.02 1
stop_
save_