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 bmr6150_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -8.99
_LACS_plot.Line_1_terminator_val_y_1 -5.44
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.96
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -2.81
_LACS_plot.Line_2_terminator_val_x_2 5.02
_LACS_plot.Line_2_terminator_val_y_2 1.77
_LACS_plot.Y_axis_chem_shift_offset 1.64
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
54 GLU 0.96 2.87 0
10 LEU 1.75 -0.50 1
11 SER -1.29 -2.18 1
12 GLU -4.36 -2.81 1
13 SER -3.71 -4.13 1
14 HIS -3.89 -2.00 1
15 ASN -0.78 -1.50 1
16 PHE 2.19 0.75 1
17 ASP 3.21 2.13 1
18 ALA 3.25 0.11 1
19 VAL 4.97 2.11 1
20 MET 2.96 1.50 1
21 SER 4.73 1.32 1
22 LYS 2.35 -0.28 1
23 LEU -2.22 -2.18 1
25 VAL 0.64 -1.79 1
26 SER -1.36 -2.19 1
28 ALA 2.39 0.89 1
29 THR 4.18 1.18 1
30 ARG 4.27 1.08 1
31 GLN 3.22 -0.18 1
32 ILE 2.88 0.08 1
34 ASN -0.34 -1.08 1
35 THR -0.18 -1.04 1
36 VAL -1.43 -2.58 1
37 THR -1.04 -1.34 1
39 THR -2.17 -2.56 1
40 VAL -4.43 -4.13 1
41 THR -2.14 -2.57 1
42 PHE -3.38 -2.90 1
43 THR -3.70 -3.40 1
44 MET -5.01 -3.18 1
45 ASP -2.05 -3.42 1
47 ASP -0.76 -2.76 1
48 LYS -2.71 -3.20 1
49 MET -3.39 -3.57 1
50 THR -2.13 -2.56 1
51 MET -4.98 -3.56 1
52 LEU -4.39 -3.50 1
53 THR -0.49 -1.78 1
55 SER 2.04 -1.86 1
56 THR 3.26 -0.17 1
57 PHE -0.93 -1.72 1
58 LYS -3.36 -2.50 1
59 ASN -2.69 -3.21 1
60 LEU -4.46 -2.88 1
61 SER -2.30 -3.51 1
62 VAL -5.16 -3.74 1
63 THR -3.37 -2.95 1
64 PHE -4.76 -4.70 1
65 LYS -3.99 -4.35 1
66 PHE 3.22 -0.09 1
68 GLU -4.16 -3.61 1
69 GLU -1.36 -2.04 1
70 PHE -5.39 -4.70 1
71 ASP -1.99 -2.36 1
72 GLU -5.02 -3.60 1
73 LYS -3.31 -4.23 1
74 THR -1.95 -2.95 1
76 ASP -1.05 -2.77 1
78 ARG -1.04 -2.14 1
79 ASN -0.49 -1.66 1
80 VAL -6.67 -5.69 1
81 LYS -3.49 -4.18 1
82 SER -6.32 -3.74 1
83 VAL -3.50 -2.57 1
84 VAL -0.66 -2.82 1
85 GLU -5.61 -4.76 1
86 LYS -0.30 -3.20 1
87 ASN 1.56 1.08 1
88 SER -2.72 -3.56 1
89 GLU 1.89 -0.10 1
90 SER -3.10 -3.35 1
91 LYS -3.64 -2.03 1
92 LEU -7.08 -4.05 1
93 THR -0.18 -0.61 1
94 GLN -8.99 -5.05 1
95 THR -1.40 -2.20 1
96 GLN -4.50 -3.87 1
97 VAL -0.56 -1.23 1
98 ASP -2.17 -2.49 1
100 LYS -1.83 -1.64 1
101 ASN -6.43 -2.05 1
102 THR -1.27 -1.40 1
103 THR -1.07 -2.56 1
104 VAL -1.49 -2.57 1
105 ILE -3.33 -3.03 1
106 VAL -0.72 -2.42 1
107 ARG -4.63 -3.78 1
108 GLU -6.92 -4.38 1
109 VAL -2.35 -2.81 1
110 ASP -1.95 -3.16 1
112 ASP -0.03 -1.98 1
113 THR -2.19 -2.09 1
114 MET -3.39 -3.56 1
115 LYS -1.73 -2.81 1
116 THR 5.03 1.77 1
117 THR -4.04 -4.90 1
118 VAL -2.66 -2.75 1
119 THR -2.59 -2.17 1
120 VAL -2.44 -3.73 1
122 ASP -0.68 -2.76 1
123 VAL -1.03 -2.18 1
124 THR -3.61 -2.56 1
125 ALA -5.99 -4.18 1
126 ILE -4.50 -3.42 1
127 ARG -2.86 -4.17 1
128 ASN -3.08 -3.52 1
129 TYR -6.32 -3.34 1
130 LYS -5.57 -4.37 1
131 ARG 1.07 -0.66 1
132 LEU -1.51 -2.48 1
133 SER 0.59 -0.62 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr6150_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -8.99
_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 -2.96
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -0.81
_LACS_plot.Line_2_terminator_val_x_2 5.02
_LACS_plot.Line_2_terminator_val_y_2 -3.25
_LACS_plot.Y_axis_chem_shift_offset 1.64
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
54 GLU 0.96 1.91 0
10 LEU 1.75 -2.25 1
11 SER -1.29 -0.89 1
12 GLU -4.36 1.55 1
13 SER -3.71 -0.42 1
14 HIS -3.89 1.89 1
15 ASN -0.78 -0.72 1
16 PHE 2.19 -1.44 1
17 ASP 3.21 -1.08 1
18 ALA 3.25 -3.14 1
19 VAL 4.97 -2.86 1
20 MET 2.96 -1.46 1
21 SER 4.73 -3.41 1
22 LYS 2.35 -2.63 1
23 LEU -2.22 0.04 1
25 VAL 0.64 -2.43 1
26 SER -1.36 -0.83 1
28 ALA 2.39 -1.50 1
29 THR 4.18 -3.00 1
30 ARG 4.27 -3.19 1
31 GLN 3.22 -3.40 1
32 ILE 2.88 -2.80 1
34 ASN -0.34 -0.74 1
35 THR -0.18 -0.86 1
36 VAL -1.43 -1.15 1
37 THR -1.04 -0.30 1
39 THR -2.17 -0.39 1
40 VAL -4.43 0.30 1
41 THR -2.14 -0.43 1
42 PHE -3.38 0.48 1
43 THR -3.70 0.30 1
44 MET -5.01 1.83 1
45 ASP -2.05 -1.37 1
47 ASP -0.76 -2.00 1
48 LYS -2.71 -0.49 1
49 MET -3.39 -0.18 1
50 THR -2.13 -0.43 1
51 MET -4.98 1.42 1
52 LEU -4.39 0.89 1
53 THR -0.49 -1.29 1
55 SER 2.04 -3.90 1
56 THR 3.26 -3.43 1
57 PHE -0.93 -0.79 1
58 LYS -3.36 0.86 1
59 ASN -2.69 -0.52 1
60 LEU -4.46 1.58 1
61 SER -2.30 -1.21 1
62 VAL -5.16 1.42 1
63 THR -3.37 0.42 1
64 PHE -4.76 0.06 1
65 LYS -3.99 -0.36 1
66 PHE 3.22 -3.31 1
68 GLU -4.16 0.55 1
69 GLU -1.36 -0.68 1
70 PHE -5.39 0.69 1
71 ASP -1.99 -0.37 1
72 GLU -5.02 1.42 1
73 LYS -3.31 -0.92 1
74 THR -1.95 -1.00 1
76 ASP -1.05 -1.72 1
78 ARG -1.04 -1.10 1
79 ASN -0.49 -1.17 1
80 VAL -6.67 0.98 1
81 LYS -3.49 -0.69 1
82 SER -6.32 2.58 1
83 VAL -3.50 0.93 1
84 VAL -0.66 -2.16 1
85 GLU -5.61 0.85 1
86 LYS -0.30 -2.90 1
87 ASN 1.56 -0.48 1
88 SER -2.72 -0.84 1
89 GLU 1.89 -1.99 1
90 SER -3.10 -0.25 1
91 LYS -3.64 1.61 1
92 LEU -7.08 3.03 1
93 THR -0.18 -0.43 1
94 GLN -8.99 3.94 1
95 THR -1.40 -0.80 1
96 GLN -4.50 0.63 1
97 VAL -0.56 -0.67 1
98 ASP -2.17 -0.32 1
100 LYS -1.83 0.19 1
101 ASN -6.43 4.38 1
102 THR -1.27 -0.13 1
103 THR -1.07 -1.49 1
104 VAL -1.49 -1.08 1
105 ILE -3.33 0.30 1
106 VAL -0.72 -1.70 1
107 ARG -4.63 0.85 1
108 GLU -6.92 2.54 1
109 VAL -2.35 -0.46 1
110 ASP -1.95 -1.21 1
112 ASP -0.03 -1.95 1
113 THR -2.19 0.10 1
114 MET -3.39 -0.17 1
115 LYS -1.73 -1.08 1
116 THR 5.03 -3.26 1
117 THR -4.04 -0.86 1
118 VAL -2.66 -0.09 1
119 THR -2.59 0.42 1
120 VAL -2.44 -1.29 1
122 ASP -0.68 -2.08 1
123 VAL -1.03 -1.15 1
124 THR -3.61 1.05 1
125 ALA -5.99 1.81 1
126 ILE -4.50 1.08 1
127 ARG -2.86 -1.31 1
128 ASN -3.08 -0.44 1
129 TYR -6.32 2.98 1
130 LYS -5.57 1.20 1
131 ARG 1.07 -1.73 1
132 LEU -1.51 -0.97 1
133 SER 0.59 -1.21 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr6150_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -8.99
_LACS_plot.Line_1_terminator_val_y_1 1.17
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 0.03
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.45
_LACS_plot.Line_2_terminator_val_x_2 5.02
_LACS_plot.Line_2_terminator_val_y_2 -0.28
_LACS_plot.Y_axis_chem_shift_offset -0.24
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
30 ARG 4.27 0.88 0
10 LEU 1.75 -0.06 1
11 SER -1.29 0.23 1
12 GLU -4.36 0.21 1
13 SER -3.71 0.85 1
14 HIS -3.89 0.45 1
15 ASN -0.78 0.04 1
16 PHE 2.19 -0.31 1
17 ASP 3.21 0.26 1
18 ALA 3.25 -0.25 1
19 VAL 4.97 -0.72 1
20 MET 2.96 -0.70 1
21 SER 4.73 -0.47 1
22 LYS 2.35 -0.25 1
23 LEU -2.22 -0.23 1
25 VAL 0.64 -0.33 1
26 SER -1.36 0.53 1
28 ALA 2.39 0.55 1
29 THR 4.18 -0.13 1
31 GLN 3.22 -0.59 1
32 ILE 2.88 -0.46 1
34 ASN -0.34 0.08 1
35 THR -0.18 0.62 1
36 VAL -1.43 0.20 1
37 THR -1.04 1.06 1
39 THR -2.17 1.19 1
40 VAL -4.43 1.17 1
41 THR -2.14 1.35 1
42 PHE -3.38 1.12 1
43 THR -3.70 0.35 1
44 MET -5.01 0.70 1
45 ASP -2.05 0.09 1
47 ASP -0.76 -0.05 1
48 LYS -2.71 0.13 1
49 MET -3.39 0.38 1
50 THR -2.13 0.73 1
51 MET -4.98 0.55 1
52 LEU -4.39 0.88 1
53 THR -0.49 0.72 1
54 GLU 0.96 0.55 1
55 SER 2.04 0.22 1
56 THR 3.26 -0.77 1
57 PHE -0.93 0.14 1
58 LYS -3.36 0.09 1
59 ASN -2.69 0.75 1
60 LEU -4.46 0.77 1
61 SER -2.30 0.86 1
62 VAL -5.16 0.61 1
63 THR -3.37 0.97 1
64 PHE -4.76 0.00 1
65 LYS -3.99 0.34 1
66 PHE 3.22 0.35 1
68 GLU -4.16 0.45 1
69 GLU -1.36 0.69 1
70 PHE -5.39 0.56 1
71 ASP -1.99 0.56 1
72 GLU -5.02 0.35 1
73 LYS -3.31 1.14 1
74 THR -1.95 0.19 1
76 ASP -1.05 -0.08 1
78 ARG -1.04 -0.05 1
79 ASN -0.49 0.52 1
80 VAL -6.67 0.82 1
81 LYS -3.49 0.58 1
82 SER -6.32 1.34 1
83 VAL -3.50 0.02 1
84 VAL -0.66 0.66 1
85 GLU -5.61 0.38 1
86 LYS -0.30 -0.04 1
87 ASN 1.56 -0.22 1
88 SER -2.72 0.11 1
89 GLU 1.89 0.58 1
90 SER -3.10 0.20 1
91 LYS -3.64 1.35 1
92 LEU -7.08 0.88 1
93 THR -0.18 0.58 1
94 GLN -8.99 1.33 1
95 THR -1.40 0.75 1
96 GLN -4.50 0.70 1
97 VAL -0.56 0.37 1
98 ASP -2.17 0.25 1
100 LYS -1.83 0.13 1
101 ASN -6.43 0.30 1
102 THR -1.27 0.72 1
103 THR -1.07 0.66 1
104 VAL -1.49 1.42 1
105 ILE -3.33 1.29 1
106 VAL -0.72 0.67 1
107 ARG -4.63 0.78 1
108 GLU -6.92 1.11 1
109 VAL -2.35 0.19 1
110 ASP -1.95 0.12 1
112 ASP -0.03 0.27 1
113 THR -2.19 1.18 1
114 MET -3.39 0.23 1
115 LYS -1.73 0.72 1
116 THR 5.03 -0.23 1
117 THR -4.04 0.61 1
118 VAL -2.66 0.68 1
119 THR -2.59 1.13 1
120 VAL -2.44 0.40 1
122 ASP -0.68 -0.08 1
123 VAL -1.03 0.15 1
124 THR -3.61 0.45 1
125 ALA -5.99 0.90 1
126 ILE -4.50 0.76 1
127 ARG -2.86 0.66 1
128 ASN -3.08 1.26 1
129 TYR -6.32 0.84 1
130 LYS -5.57 1.17 1
131 ARG 1.07 0.55 1
132 LEU -1.51 0.15 1
133 SER 0.59 -0.32 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr6150_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -8.99
_LACS_plot.Line_1_terminator_val_y_1 -3.52
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.16
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.49
_LACS_plot.Line_2_terminator_val_x_2 5.02
_LACS_plot.Line_2_terminator_val_y_2 1.09
_LACS_plot.Y_axis_chem_shift_offset 0.76
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
18 ALA 3.25 -6.81 0
28 ALA 2.39 -7.86 0
10 LEU 1.75 -3.00 1
11 SER -1.29 -0.45 1
12 GLU -4.36 -3.50 1
13 SER -3.71 -1.89 1
14 HIS -3.89 0.25 1
15 ASN -0.78 -0.15 1
16 PHE 2.19 1.06 1
17 ASP 3.21 1.16 1
19 VAL 4.97 -0.19 1
20 MET 2.96 1.47 1
21 SER 4.73 3.32 1
22 LYS 2.35 0.56 1
23 LEU -2.22 -0.89 1
25 VAL 0.64 -0.65 1
26 SER -1.36 -0.60 1
29 THR 4.18 0.72 1
30 ARG 4.27 0.51 1
31 GLN 3.22 1.77 1
32 ILE 2.88 1.35 1
34 ASN -0.34 0.09 1
35 THR -0.18 -0.45 1
36 VAL -1.43 -1.10 1
39 THR -2.17 -1.00 1
40 VAL -4.43 -2.15 1
41 THR -2.14 -0.88 1
42 PHE -3.38 -0.44 1
43 THR -3.70 -3.11 1
44 MET -5.01 -2.00 1
45 ASP -2.05 -0.50 1
47 ASP -0.76 -3.00 1
48 LYS -2.71 -1.94 1
49 MET -3.39 1.01 1
50 THR -2.13 -2.66 1
51 MET -4.98 -2.83 1
52 LEU -4.39 -2.69 1
53 THR -0.49 -1.95 1
54 GLU 0.96 -1.09 1
55 SER 2.04 4.01 1
56 THR 3.26 -0.40 1
57 PHE -0.93 -1.41 1
58 LYS -3.36 -3.05 1
59 ASN -2.69 -1.31 1
60 LEU -4.46 -2.97 1
61 SER -2.30 -1.35 1
62 VAL -5.16 -3.96 1
63 THR -3.37 -2.43 1
64 PHE -4.76 -3.87 1
65 LYS -3.99 1.01 1
66 PHE 3.22 1.97 1
68 GLU -4.16 -1.25 1
69 GLU -1.36 -1.54 1
70 PHE -5.39 -3.61 1
71 ASP -1.99 -1.55 1
72 GLU -5.02 -3.81 1
73 LYS -3.31 0.03 1
74 THR -1.95 2.75 1
76 ASP -1.05 -1.85 1
78 ARG -1.04 -1.40 1
79 ASN -0.49 -0.70 1
80 VAL -6.67 -2.00 1
81 LYS -3.49 -0.34 1
82 SER -6.32 -3.31 1
83 VAL -3.50 -2.45 1
84 VAL -0.66 -2.15 1
85 GLU -5.61 -2.68 1
86 LYS -0.30 -1.55 1
87 ASN 1.56 -0.75 1
88 SER -2.72 -1.74 1
89 GLU 1.89 -1.02 1
90 SER -3.10 -2.41 1
91 LYS -3.64 -3.80 1
92 LEU -7.08 -0.59 1
93 THR -0.18 -2.96 1
94 GLN -8.99 -2.40 1
95 THR -1.40 -1.15 1
96 GLN -4.50 -0.80 1
97 VAL -0.56 -1.55 1
100 LYS -1.83 -0.94 1
101 ASN -6.43 -1.94 1
102 THR -1.27 -1.75 1
103 THR -1.07 -0.86 1
104 VAL -1.49 -2.94 1
105 ILE -3.33 -0.60 1
106 VAL -0.72 -1.70 1
107 ARG -4.63 -2.90 1
108 GLU -6.92 -2.15 1
109 VAL -2.35 -2.13 1
110 ASP -1.95 -0.49 1
112 ASP -0.03 -1.84 1
113 THR -2.19 -3.46 1
114 MET -3.39 -2.45 1
115 LYS -1.73 -6.02 1
116 THR 5.03 1.11 1
117 THR -4.04 -1.55 1
118 VAL -2.66 -2.12 1
119 THR -2.59 -1.49 1
120 VAL -2.44 -1.10 1
122 ASP -0.68 -1.40 1
123 VAL -1.03 -2.90 1
124 THR -3.61 -1.45 1
125 ALA -5.99 -2.98 1
126 ILE -4.50 -1.05 1
127 ARG -2.86 -2.15 1
128 ASN -3.08 -1.50 1
129 TYR -6.32 -1.30 1
130 LYS -5.57 -0.94 1
131 ARG 1.07 -0.19 1
132 LEU -1.51 -1.72 1
stop_
save_