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 bmr10079_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -4.90
_LACS_plot.Line_1_terminator_val_y_1 -2.20
_LACS_plot.Line_1_terminator_val_x_2 1.99
_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 -1.43
_LACS_plot.Line_2_terminator_val_x_2 7.03
_LACS_plot.Line_2_terminator_val_y_2 5.68
_LACS_plot.Y_axis_chem_shift_offset -0.16
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
42 HIS 0.25 3.85 0
10 ALA 1.81 1.60 1
11 THR 2.06 1.37 1
12 ALA 2.55 2.14 1
13 GLN 3.24 2.62 1
14 MET 4.05 4.22 1
15 GLU 4.76 4.13 1
17 ARG 2.84 3.16 1
18 LEU 2.56 3.06 1
19 GLN 4.96 3.81 1
20 GLU 3.14 3.09 1
21 PHE 3.72 3.80 1
22 LEU 3.04 2.86 1
23 THR 4.98 4.20 1
24 ALA 2.91 1.92 1
25 TYR -0.67 -0.77 1
26 ALA 2.48 1.68 1
29 ALA 1.47 1.38 1
30 ARG -0.42 -0.12 1
31 LEU -0.16 0.02 1
32 ALA -0.96 -0.33 1
33 LEU 0.96 -0.26 1
34 ALA 1.32 1.35 1
35 ASP -1.17 -0.03 1
37 VAL 5.33 4.08 1
38 LEU 4.04 2.61 1
40 PHE 3.89 3.00 1
41 ILE 5.98 5.46 1
43 HIS 4.55 5.77 1
44 GLN 2.96 3.58 1
45 ILE 5.65 5.14 1
46 VAL 7.03 5.28 1
47 GLU 3.51 2.75 1
48 LEU 4.00 3.02 1
49 ALA 3.81 3.27 1
50 ARG 5.05 4.35 1
51 ASP 2.58 3.78 1
53 LEU 3.54 3.23 1
54 ALA 3.61 2.60 1
55 LYS 3.05 2.26 1
56 SER 4.90 4.01 1
58 GLU -1.89 -0.92 1
59 ASN 2.87 1.31 1
60 LEU -2.00 -0.77 1
61 VAL 1.25 0.19 1
62 THR -4.90 -2.06 1
63 SER 4.87 3.69 1
64 ARG 4.18 2.89 1
65 TYR 4.23 4.02 1
66 PHE 4.83 3.98 1
67 LEU 4.11 3.35 1
68 GLU 3.60 2.80 1
69 MET 4.79 4.30 1
70 GLN 5.78 4.30 1
71 GLU 3.40 3.07 1
72 LYS 3.92 3.71 1
73 LEU 4.06 3.10 1
74 GLU 4.18 3.38 1
75 ARG 3.99 2.92 1
76 LEU 4.10 3.00 1
77 LEU 3.28 3.05 1
78 GLN 4.78 3.46 1
79 ASP 3.97 3.23 1
80 ALA 3.56 2.65 1
81 HIS 3.06 4.00 1
82 GLU 0.87 1.06 1
83 ARG 0.57 -1.48 1
84 SER 0.27 0.91 1
85 ASP -0.22 -0.17 1
86 SER 0.62 1.05 1
87 GLU 3.34 2.57 1
88 GLU 2.64 3.01 1
89 VAL 6.09 5.10 1
90 SER 4.65 3.51 1
91 PHE 4.23 3.36 1
92 ILE 4.62 0.84 1
93 VAL 6.08 4.84 1
94 GLN 4.27 3.07 1
95 LEU 3.13 3.30 1
96 VAL 6.96 5.59 1
97 ARG 5.12 3.96 1
98 LYS 3.73 3.57 1
99 LEU 3.73 2.25 1
100 LEU 3.77 2.75 1
101 ILE 4.55 3.78 1
102 ILE 5.56 4.95 1
103 ILE 1.96 1.26 1
104 SER 1.24 1.03 1
105 ARG 1.09 0.52 1
107 ALA -0.13 0.08 1
108 ARG -0.07 0.07 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr10079_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -4.90
_LACS_plot.Line_1_terminator_val_y_1 2.70
_LACS_plot.Line_1_terminator_val_x_2 1.99
_LACS_plot.Line_1_terminator_val_y_2 -0.84
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.57
_LACS_plot.Line_2_terminator_val_x_2 7.03
_LACS_plot.Line_2_terminator_val_y_2 -1.35
_LACS_plot.Y_axis_chem_shift_offset -0.16
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
42 HIS 0.25 3.60 0
10 ALA 1.81 -0.21 1
11 THR 2.06 -0.69 1
12 ALA 2.55 -0.41 1
13 GLN 3.24 -0.62 1
14 MET 4.05 0.17 1
15 GLU 4.76 -0.63 1
17 ARG 2.84 0.32 1
18 LEU 2.56 0.50 1
19 GLN 4.96 -1.15 1
20 GLU 3.14 -0.05 1
21 PHE 3.72 0.08 1
22 LEU 3.04 -0.18 1
23 THR 4.98 -0.78 1
24 ALA 2.91 -0.99 1
25 TYR -0.67 -0.10 1
26 ALA 2.48 -0.80 1
29 ALA 1.47 -0.09 1
30 ARG -0.42 0.30 1
31 LEU -0.16 0.18 1
32 ALA -0.96 0.63 1
33 LEU 0.96 -1.22 1
34 ALA 1.32 0.03 1
35 ASP -1.17 1.14 1
37 VAL 5.33 -1.25 1
38 LEU 4.04 -1.43 1
40 PHE 3.89 -0.89 1
41 ILE 5.98 -0.52 1
43 HIS 4.55 1.22 1
44 GLN 2.96 0.62 1
45 ILE 5.65 -0.51 1
46 VAL 7.03 -1.75 1
47 GLU 3.51 -0.76 1
48 LEU 4.00 -0.98 1
49 ALA 3.81 -0.54 1
50 ARG 5.05 -0.70 1
51 ASP 2.58 1.20 1
53 LEU 3.54 -0.31 1
54 ALA 3.61 -1.01 1
55 LYS 3.05 -0.79 1
56 SER 4.90 -0.89 1
58 GLU -1.89 0.97 1
59 ASN 2.87 -1.56 1
60 LEU -2.00 1.23 1
61 VAL 1.25 -1.06 1
62 THR -4.90 2.84 1
63 SER 4.87 -1.18 1
64 ARG 4.18 -1.29 1
65 TYR 4.23 -0.21 1
66 PHE 4.83 -0.85 1
67 LEU 4.11 -0.76 1
68 GLU 3.60 -0.80 1
69 MET 4.79 -0.49 1
70 GLN 5.78 -1.48 1
71 GLU 3.40 -0.33 1
72 LYS 3.92 -0.21 1
73 LEU 4.06 -0.96 1
74 GLU 4.18 -0.80 1
75 ARG 3.99 -1.07 1
76 LEU 4.10 -1.10 1
77 LEU 3.28 -0.23 1
78 GLN 4.78 -1.32 1
79 ASP 3.97 -0.74 1
80 ALA 3.56 -0.91 1
81 HIS 3.06 0.94 1
82 GLU 0.87 0.19 1
83 ARG 0.57 -2.05 1
84 SER 0.27 0.64 1
85 ASP -0.22 0.05 1
86 SER 0.62 0.43 1
87 GLU 3.34 -0.77 1
88 GLU 2.64 0.37 1
89 VAL 6.09 -0.99 1
90 SER 4.65 -1.14 1
91 PHE 4.23 -0.87 1
92 ILE 4.62 -3.78 1
93 VAL 6.08 -1.24 1
94 GLN 4.27 -1.20 1
95 LEU 3.13 0.17 1
96 VAL 6.96 -1.37 1
97 ARG 5.12 -1.16 1
98 LYS 3.73 -0.16 1
99 LEU 3.73 -1.48 1
100 LEU 3.77 -1.02 1
101 ILE 4.55 -0.77 1
102 ILE 5.56 -0.61 1
103 ILE 1.96 -0.70 1
104 SER 1.24 -0.21 1
105 ARG 1.09 -0.57 1
107 ALA -0.13 0.21 1
108 ARG -0.07 0.14 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr10079_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -4.90
_LACS_plot.Line_1_terminator_val_y_1 0.40
_LACS_plot.Line_1_terminator_val_x_2 1.99
_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 0.17
_LACS_plot.Line_2_terminator_val_x_2 7.03
_LACS_plot.Line_2_terminator_val_y_2 -0.60
_LACS_plot.Y_axis_chem_shift_offset -0.00
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
62 THR -4.90 0.32 0
10 ALA 1.81 0.00 1
11 THR 2.06 -0.04 1
12 ALA 2.55 -0.07 1
13 GLN 3.24 -0.12 1
14 MET 4.05 -0.42 1
15 GLU 4.76 -0.50 1
17 ARG 2.84 -0.05 1
18 LEU 2.56 -0.19 1
19 GLN 4.96 -0.17 1
20 GLU 3.14 -0.29 1
21 PHE 3.72 -0.35 1
22 LEU 3.04 -0.34 1
23 THR 4.98 -0.43 1
24 ALA 2.91 -0.39 1
25 TYR -0.67 0.35 1
26 ALA 2.48 -0.17 1
29 ALA 1.47 -0.13 1
30 ARG -0.42 0.02 1
31 LEU -0.16 -0.03 1
32 ALA -0.96 0.13 1
33 LEU 0.96 -0.09 1
34 ALA 1.32 -0.13 1
35 ASP -1.17 0.00 1
37 VAL 5.33 -0.15 1
38 LEU 4.04 -0.14 1
40 PHE 3.89 0.01 1
41 ILE 5.98 -0.54 1
42 HIS 0.25 -0.53 1
43 HIS 4.55 -0.78 1
44 GLN 2.96 -0.48 1
45 ILE 5.65 -0.73 1
46 VAL 7.03 -0.40 1
47 GLU 3.51 -0.26 1
48 LEU 4.00 -0.11 1
49 ALA 3.81 -0.42 1
50 ARG 5.05 -0.42 1
51 ASP 2.58 -0.21 1
53 LEU 3.54 -0.35 1
54 ALA 3.61 -0.20 1
55 LYS 3.05 -0.41 1
56 SER 4.90 -0.37 1
58 GLU -1.89 0.07 1
59 ASN 2.87 -0.15 1
60 LEU -2.00 0.18 1
61 VAL 1.25 -0.44 1
63 SER 4.87 0.03 1
64 ARG 4.18 -0.21 1
65 TYR 4.23 -0.50 1
66 PHE 4.83 -0.33 1
67 LEU 4.11 -0.18 1
68 GLU 3.60 -0.35 1
69 MET 4.79 -0.61 1
70 GLN 5.78 -0.55 1
71 GLU 3.40 -0.29 1
72 LYS 3.92 -0.33 1
73 LEU 4.06 -0.38 1
74 GLU 4.18 -0.39 1
75 ARG 3.99 -0.15 1
76 LEU 4.10 -0.12 1
77 LEU 3.28 -0.44 1
78 GLN 4.78 -0.22 1
79 ASP 3.97 -0.29 1
80 ALA 3.56 -0.49 1
81 HIS 3.06 -0.31 1
82 GLU 0.87 -0.10 1
83 ARG 0.57 0.17 1
84 SER 0.27 0.03 1
85 ASP -0.22 0.11 1
86 SER 0.62 -0.05 1
87 GLU 3.34 -0.09 1
88 GLU 2.64 -0.17 1
89 VAL 6.09 -0.63 1
90 SER 4.65 -0.36 1
91 PHE 4.23 -0.31 1
92 ILE 4.62 -0.76 1
93 VAL 6.08 -0.75 1
94 GLN 4.27 -0.36 1
95 LEU 3.13 -0.70 1
96 VAL 6.96 -0.74 1
97 ARG 5.12 -0.43 1
98 LYS 3.73 -0.31 1
99 LEU 3.73 -0.55 1
100 LEU 3.77 -0.43 1
101 ILE 4.55 -0.47 1
102 ILE 5.56 -0.59 1
103 ILE 1.96 0.04 1
104 SER 1.24 -0.24 1
105 ARG 1.09 -0.13 1
107 ALA -0.13 -0.04 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr10079_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -4.90
_LACS_plot.Line_1_terminator_val_y_1 -1.74
_LACS_plot.Line_1_terminator_val_x_2 1.99
_LACS_plot.Line_1_terminator_val_y_2 1.10
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -0.31
_LACS_plot.Line_2_terminator_val_x_2 7.03
_LACS_plot.Line_2_terminator_val_y_2 2.88
_LACS_plot.Y_axis_chem_shift_offset -0.34
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
62 THR -4.90 0.19 0
10 ALA 1.81 1.54 1
11 THR 2.06 0.36 1
12 ALA 2.55 2.22 1
13 GLN 3.24 2.17 1
14 MET 4.05 1.92 1
15 GLU 4.76 2.41 1
17 ARG 2.84 4.44 1
18 LEU 2.56 0.95 1
19 GLN 4.96 3.13 1
20 GLU 3.14 2.12 1
21 PHE 3.72 0.78 1
22 LEU 3.04 1.91 1
23 THR 4.98 1.02 1
24 ALA 2.91 2.21 1
25 TYR -0.67 -0.62 1
26 ALA 2.48 -0.18 1
29 ALA 1.47 0.39 1
30 ARG -0.42 -0.43 1
31 LEU -0.16 -1.80 1
32 ALA -0.96 -0.53 1
34 ALA 1.32 1.54 1
35 ASP -1.17 1.39 1
37 VAL 5.33 2.47 1
38 LEU 4.04 2.06 1
40 PHE 3.89 2.39 1
41 ILE 5.98 0.98 1
42 HIS 0.25 3.20 1
43 HIS 4.55 3.51 1
44 GLN 2.96 3.07 1
45 ILE 5.65 1.05 1
46 VAL 7.03 1.52 1
47 GLU 3.51 3.15 1
48 LEU 4.00 2.13 1
49 ALA 3.81 0.99 1
50 ARG 5.05 3.18 1
51 ASP 2.58 0.52 1
53 LEU 3.54 1.43 1
54 ALA 3.61 3.14 1
55 LYS 3.05 2.98 1
56 SER 4.90 3.89 1
58 GLU -1.89 -1.23 1
59 ASN 2.87 0.27 1
60 LEU -2.00 -0.13 1
61 VAL 1.25 -1.30 1
64 ARG 4.18 1.03 1
65 TYR 4.23 2.60 1
66 PHE 4.83 2.34 1
67 LEU 4.11 2.13 1
68 GLU 3.60 2.65 1
69 MET 4.79 1.49 1
70 GLN 5.78 1.61 1
71 GLU 3.40 3.08 1
72 LYS 3.92 3.19 1
73 LEU 4.06 0.68 1
74 GLU 4.18 3.34 1
75 ARG 3.99 2.20 1
76 LEU 4.10 1.37 1
77 LEU 3.28 1.03 1
78 GLN 4.78 3.08 1
79 ASP 3.97 3.09 1
80 ALA 3.56 0.50 1
81 HIS 3.06 2.80 1
82 GLU 0.87 1.19 1
83 ARG 0.57 -0.17 1
84 SER 0.27 -0.82 1
85 ASP -0.22 -0.22 1
87 GLU 3.34 2.42 1
88 GLU 2.64 1.81 1
89 VAL 6.09 1.48 1
90 SER 4.65 1.88 1
91 PHE 4.23 0.81 1
92 ILE 4.62 1.06 1
93 VAL 6.08 1.86 1
94 GLN 4.27 2.22 1
95 LEU 3.13 1.18 1
96 VAL 6.96 1.39 1
97 ARG 5.12 3.01 1
98 LYS 3.73 2.55 1
99 LEU 3.73 0.69 1
100 LEU 3.77 2.51 1
101 ILE 4.55 2.75 1
102 ILE 5.56 1.45 1
103 ILE 1.96 -1.11 1
104 SER 1.24 -0.31 1
105 ARG 1.09 -0.48 1
107 ALA -0.13 0.08 1
108 ARG -0.07 -0.05 1
stop_
save_