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 bmr5719_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -8.48
_LACS_plot.Line_1_terminator_val_y_1 -3.75
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 0.85
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.72
_LACS_plot.Line_2_terminator_val_x_2 6.11
_LACS_plot.Line_2_terminator_val_y_2 4.67
_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
94 LEU -8.48 -2.27 0
10 GLU -0.60 -0.33 1
12 ARG 0.87 0.27 1
13 TRP 0.07 -0.45 1
14 ILE -0.02 -0.14 1
15 LEU 3.38 2.37 1
16 LYS 0.50 0.23 1
17 ASN 0.34 0.05 1
18 ASP -0.28 0.20 1
19 VAL 3.22 2.20 1
20 LYS 4.71 3.35 1
21 ASN 1.27 0.98 1
22 ARG -1.24 -1.19 1
23 SER -1.64 -0.47 1
24 VAL -4.27 -0.31 1
25 TYR -4.72 -2.10 1
26 ILE -4.25 -1.47 1
29 PHE 1.76 1.14 1
31 THR 4.41 2.60 1
32 ASP -0.25 -1.68 1
33 ALA 0.71 0.06 1
34 THR -4.97 -3.03 1
35 LEU 4.45 2.85 1
36 ASP 4.21 3.32 1
37 ASP 3.78 3.17 1
38 ILE 5.05 4.08 1
39 LYS 4.83 4.25 1
40 GLU 2.99 2.48 1
41 TRP 5.07 4.08 1
42 LEU 0.28 1.02 1
43 GLU 3.15 2.80 1
44 ASP 0.19 -0.74 1
45 LYS -0.13 -1.49 1
47 GLN 1.20 -0.05 1
48 VAL -0.86 -0.77 1
49 LEU -0.91 -0.17 1
50 ASN -2.81 0.66 1
51 ILE -3.18 -0.45 1
52 GLN -3.36 -1.65 1
53 MET 2.01 0.40 1
54 ARG 0.37 1.52 1
57 LEU 0.39 -0.14 1
58 HIS 0.96 0.26 1
59 LYS 5.81 1.63 1
60 ALA -0.84 -0.92 1
61 PHE 0.05 -1.56 1
64 SER -6.29 -4.26 1
65 ILE -5.73 -3.11 1
66 PHE -5.13 -2.68 1
67 VAL -5.16 -2.96 1
68 VAL -1.82 -0.80 1
69 PHE -1.67 0.93 1
70 ASP 2.05 1.76 1
71 SER -5.27 -2.50 1
72 ILE 4.26 3.30 1
73 GLU 4.98 3.85 1
74 SER 3.94 2.66 1
75 ALA 3.01 2.52 1
76 LYS 4.25 3.98 1
77 LYS 3.39 2.42 1
78 PHE 3.78 3.57 1
79 VAL 4.52 3.29 1
80 GLU 0.79 -0.19 1
81 THR 1.72 1.32 1
84 GLN 0.86 1.51 1
85 LYS -6.07 -1.18 1
86 TYR -2.38 -1.16 1
87 LYS 5.66 1.95 1
88 GLU 1.59 0.30 1
89 THR 0.30 0.68 1
90 ASP 1.15 1.29 1
91 LEU -3.64 -2.27 1
92 LEU -2.22 -1.17 1
93 ILE -2.63 -0.92 1
95 PHE 6.12 4.51 1
96 LYS 4.87 5.07 1
97 ASP 3.78 3.01 1
98 ASP 2.53 2.38 1
99 TYR 4.96 2.90 1
100 PHE 4.40 3.10 1
101 ALA 3.17 2.21 1
102 LYS 2.53 1.79 1
103 LYS 2.49 0.85 1
104 ASN 1.75 1.30 1
105 GLU 0.97 0.77 1
106 GLU 0.82 0.77 1
107 ARG 1.28 0.58 1
108 LYS 0.97 0.54 1
109 GLN 0.11 -0.05 1
110 ASN 0.31 0.18 1
111 LYS -0.27 -0.24 1
112 VAL 0.09 -0.15 1
113 GLU -0.28 0.92 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr5719_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -8.48
_LACS_plot.Line_1_terminator_val_y_1 4.73
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -1.15
_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 6.11
_LACS_plot.Line_2_terminator_val_y_2 -1.44
_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
94 LEU -8.48 6.21 0
10 GLU -0.60 0.27 1
12 ARG 0.87 -0.60 1
13 TRP 0.07 -0.52 1
14 ILE -0.02 -0.12 1
15 LEU 3.38 -1.01 1
16 LYS 0.50 -0.27 1
17 ASN 0.34 -0.29 1
18 ASP -0.28 0.48 1
19 VAL 3.22 -1.02 1
20 LYS 4.71 -1.36 1
21 ASN 1.27 -0.29 1
22 ARG -1.24 0.05 1
23 SER -1.64 1.17 1
24 VAL -4.27 3.96 1
25 TYR -4.72 2.62 1
26 ILE -4.25 2.78 1
29 PHE 1.76 -0.62 1
31 THR 4.41 -1.81 1
32 ASP -0.25 -1.43 1
33 ALA 0.71 -0.65 1
34 THR -4.97 1.94 1
35 LEU 4.45 -1.60 1
36 ASP 4.21 -0.89 1
37 ASP 3.78 -0.61 1
38 ILE 5.05 -0.97 1
39 LYS 4.83 -0.58 1
40 GLU 2.99 -0.51 1
41 TRP 5.07 -0.99 1
42 LEU 0.28 0.74 1
43 GLU 3.15 -0.35 1
44 ASP 0.19 -0.93 1
45 LYS -0.13 -1.36 1
47 GLN 1.20 -1.25 1
48 VAL -0.86 0.09 1
49 LEU -0.91 0.74 1
50 ASN -2.81 3.47 1
51 ILE -3.18 2.73 1
52 GLN -3.36 1.71 1
53 MET 2.01 -1.61 1
54 ARG 0.37 1.15 1
57 LEU 0.39 -0.53 1
58 HIS 0.96 -0.70 1
59 LYS 5.81 -4.18 1
60 ALA -0.84 -0.08 1
61 PHE 0.05 -1.61 1
64 SER -6.29 2.03 1
65 ILE -5.73 2.62 1
66 PHE -5.13 2.45 1
67 VAL -5.16 2.20 1
68 VAL -1.82 1.02 1
69 PHE -1.67 2.60 1
70 ASP 2.05 -0.29 1
71 SER -5.27 2.77 1
72 ILE 4.26 -0.96 1
73 GLU 4.98 -1.13 1
74 SER 3.94 -1.28 1
75 ALA 3.01 -0.49 1
76 LYS 4.25 -0.27 1
77 LYS 3.39 -0.97 1
78 PHE 3.78 -0.21 1
79 VAL 4.52 -1.23 1
80 GLU 0.79 -0.98 1
81 THR 1.72 -0.40 1
84 GLN 0.86 0.65 1
85 LYS -6.07 4.89 1
86 TYR -2.38 1.22 1
87 LYS 5.66 -3.71 1
88 GLU 1.59 -1.29 1
89 THR 0.30 0.38 1
90 ASP 1.15 0.14 1
91 LEU -3.64 1.37 1
92 LEU -2.22 1.05 1
93 ILE -2.63 1.71 1
95 PHE 6.12 -1.61 1
96 LYS 4.87 0.20 1
97 ASP 3.78 -0.77 1
98 ASP 2.53 -0.15 1
99 TYR 4.96 -2.06 1
100 PHE 4.40 -1.30 1
101 ALA 3.17 -0.96 1
102 LYS 2.53 -0.74 1
103 LYS 2.49 -1.64 1
104 ASN 1.75 -0.45 1
105 GLU 0.97 -0.20 1
106 GLU 0.82 -0.05 1
107 ARG 1.28 -0.70 1
108 LYS 0.97 -0.43 1
109 GLN 0.11 -0.16 1
110 ASN 0.31 -0.13 1
111 LYS -0.27 0.03 1
112 VAL 0.09 -0.24 1
113 GLU -0.28 1.20 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr5719_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -8.48
_LACS_plot.Line_1_terminator_val_y_1 0.94
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.17
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.27
_LACS_plot.Line_2_terminator_val_x_2 6.11
_LACS_plot.Line_2_terminator_val_y_2 -0.62
_LACS_plot.Y_axis_chem_shift_offset -0.05
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
66 PHE -5.13 1.59 0
23 SER -1.64 1.36 0
10 GLU -0.60 -0.06 1
12 ARG 0.87 -0.10 1
13 TRP 0.07 0.02 1
14 ILE -0.02 -0.14 1
15 LEU 3.38 -0.19 1
16 LYS 0.50 -0.08 1
17 ASN 0.34 -0.04 1
18 ASP -0.28 -0.07 1
19 VAL 3.22 -0.31 1
20 LYS 4.71 -0.26 1
21 ASN 1.27 -0.07 1
22 ARG -1.24 0.42 1
24 VAL -4.27 0.63 1
25 TYR -4.72 0.93 1
26 ILE -4.25 0.82 1
29 PHE 1.76 -0.95 1
31 THR 4.41 -0.54 1
32 ASP -0.25 0.07 1
33 ALA 0.71 0.14 1
34 THR -4.97 0.00 1
35 LEU 4.45 -0.44 1
36 ASP 4.21 -0.33 1
37 ASP 3.78 -0.26 1
38 ILE 5.05 -0.70 1
39 LYS 4.83 -0.56 1
40 GLU 2.99 -0.23 1
41 TRP 5.07 -0.30 1
42 LEU 0.28 -0.54 1
43 GLU 3.15 -0.24 1
44 ASP 0.19 0.06 1
45 LYS -0.13 0.10 1
47 GLN 1.20 0.00 1
48 VAL -0.86 -0.17 1
49 LEU -0.91 0.05 1
50 ASN -2.81 0.02 1
51 ILE -3.18 0.29 1
52 GLN -3.36 0.37 1
53 MET 2.01 -0.15 1
54 ARG 0.37 0.07 1
57 LEU 0.39 -0.05 1
58 HIS 0.96 0.10 1
59 LYS 5.81 -0.53 1
60 ALA -0.84 0.24 1
61 PHE 0.05 0.39 1
65 ILE -5.73 1.14 1
67 VAL -5.16 0.89 1
68 VAL -1.82 0.59 1
69 PHE -1.67 0.38 1
70 ASP 2.05 -0.37 1
71 SER -5.27 0.49 1
72 ILE 4.26 -0.27 1
73 GLU 4.98 -0.33 1
74 SER 3.94 -0.31 1
75 ALA 3.01 -1.25 1
76 LYS 4.25 -0.30 1
77 LYS 3.39 -0.32 1
78 PHE 3.78 -0.40 1
79 VAL 4.52 -0.89 1
80 GLU 0.79 -0.19 1
81 THR 1.72 -0.12 1
84 GLN 0.86 0.08 1
85 LYS -6.07 0.70 1
86 TYR -2.38 -0.09 1
87 LYS 5.66 -0.72 1
88 GLU 1.59 -0.22 1
89 THR 0.30 0.02 1
90 ASP 1.15 -0.18 1
91 LEU -3.64 0.28 1
92 LEU -2.22 0.29 1
93 ILE -2.63 0.94 1
94 LEU -8.48 0.74 1
95 PHE 6.12 0.09 1
96 LYS 4.87 -0.35 1
97 ASP 3.78 0.01 1
98 ASP 2.53 0.04 1
99 TYR 4.96 -0.60 1
100 PHE 4.40 -0.75 1
101 ALA 3.17 -0.11 1
102 LYS 2.53 -0.23 1
103 LYS 2.49 -0.33 1
104 ASN 1.75 -0.16 1
105 GLU 0.97 -0.17 1
106 GLU 0.82 -0.20 1
107 ARG 1.28 -0.08 1
108 LYS 0.97 -0.07 1
109 GLN 0.11 -0.02 1
110 ASN 0.31 0.02 1
111 LYS -0.27 0.04 1
112 VAL 0.09 0.03 1
113 GLU -0.28 -0.19 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr5719_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -8.48
_LACS_plot.Line_1_terminator_val_y_1 -2.94
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 0.57
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -0.89
_LACS_plot.Line_2_terminator_val_x_2 6.11
_LACS_plot.Line_2_terminator_val_y_2 2.10
_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
59 LYS 5.81 -1.53 0
94 LEU -8.48 -0.24 0
10 GLU -0.60 0.15 1
12 ARG 0.87 0.86 1
13 TRP 0.07 -0.01 1
14 ILE -0.02 -0.51 1
15 LEU 3.38 -0.24 1
16 LYS 0.50 0.01 1
17 ASN 0.34 -0.04 1
18 ASP -0.28 1.77 1
19 VAL 3.22 2.46 1
20 LYS 4.71 1.75 1
21 ASN 1.27 -1.29 1
22 ARG -1.24 -1.99 1
23 SER -1.64 -0.95 1
24 VAL -4.27 -3.18 1
25 TYR -4.72 -2.63 1
26 ILE -4.25 -2.63 1
31 THR 4.41 -0.11 1
32 ASP -0.25 0.15 1
33 ALA 0.71 -1.36 1
34 THR -4.97 0.52 1
35 LEU 4.45 0.84 1
36 ASP 4.21 2.23 1
37 ASP 3.78 3.12 1
38 ILE 5.05 1.15 1
39 LYS 4.83 2.84 1
40 GLU 2.99 2.27 1
41 TRP 5.07 2.40 1
42 LEU 0.28 0.90 1
43 GLU 3.15 0.61 1
44 ASP 0.19 0.53 1
45 LYS -0.13 -0.64 1
47 GLN 1.20 -1.48 1
48 VAL -0.86 -0.04 1
49 LEU -0.91 -0.74 1
50 ASN -2.81 -2.75 1
51 ILE -3.18 -2.31 1
52 GLN -3.36 -0.48 1
53 MET 2.01 -1.05 1
54 ARG 0.37 -0.18 1
58 HIS 0.96 -0.28 1
60 ALA -0.84 -0.16 1
61 PHE 0.05 0.56 1
64 SER -6.29 -1.86 1
65 ILE -5.73 -2.38 1
66 PHE -5.13 0.36 1
67 VAL -5.16 -2.49 1
68 VAL -1.82 0.13 1
69 PHE -1.67 -0.28 1
70 ASP 2.05 -0.71 1
71 SER -5.27 -0.24 1
72 ILE 4.26 1.01 1
73 GLU 4.98 2.95 1
74 SER 3.94 2.02 1
75 ALA 3.01 -0.07 1
76 LYS 4.25 1.10 1
77 LYS 3.39 2.02 1
78 PHE 3.78 1.22 1
79 VAL 4.52 1.56 1
80 GLU 0.79 0.09 1
84 GLN 0.86 -0.05 1
86 TYR -2.38 -1.42 1
87 LYS 5.66 -0.57 1
88 GLU 1.59 -0.87 1
89 THR 0.30 -1.32 1
90 ASP 1.15 -1.21 1
91 LEU -3.64 -1.42 1
92 LEU -2.22 -3.17 1
93 ILE -2.63 -1.50 1
95 PHE 6.12 2.23 1
96 LYS 4.87 0.79 1
97 ASP 3.78 2.66 1
98 ASP 2.53 1.77 1
99 TYR 4.96 1.03 1
100 PHE 4.40 2.23 1
101 ALA 3.17 2.28 1
102 LYS 2.53 2.09 1
103 LYS 2.49 1.63 1
104 ASN 1.75 1.35 1
105 GLU 0.97 1.03 1
106 GLU 0.82 0.84 1
107 ARG 1.28 0.73 1
108 LYS 0.97 0.38 1
109 GLN 0.11 -0.27 1
110 ASN 0.31 2.17 1
111 LYS -0.27 -0.46 1
112 VAL 0.09 -1.05 1
stop_
save_