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 bmr11111_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -6.89
_LACS_plot.Line_1_terminator_val_y_1 -2.22
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 0.61
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -0.76
_LACS_plot.Line_2_terminator_val_x_2 4.58
_LACS_plot.Line_2_terminator_val_y_2 1.94
_LACS_plot.Y_axis_chem_shift_offset -0.02
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
81 HIS -5.20 1.49 0
10 HIS -0.46 1.46 1
12 THR 0.09 0.16 1
13 THR 0.20 0.17 1
14 PHE -0.32 -0.27 1
15 GLU -1.77 -0.36 1
16 LEU -3.83 -1.23 1
17 VAL 3.45 1.05 1
19 THR 0.11 -1.05 1
20 SER -0.19 0.78 1
23 LYS -4.56 -1.33 1
24 ASP 2.50 0.80 1
25 VAL 3.08 1.58 1
26 THR -4.29 -1.20 1
27 VAL -2.83 -1.31 1
28 VAL -6.44 -3.15 1
29 SER 0.23 0.85 1
30 LYS -0.74 -0.37 1
31 GLU 2.82 2.06 1
33 LYS -2.00 -1.48 1
35 LYS 1.34 0.64 1
36 THR -0.95 -0.43 1
37 ILE -5.48 -2.97 1
38 ILE -1.32 -0.66 1
39 VAL -3.00 -2.24 1
40 ASN -4.96 -0.51 1
41 TRP -1.31 -0.19 1
42 GLN -2.60 -1.23 1
45 SER 3.06 2.35 1
46 GLU -0.91 -2.83 1
47 ALA 2.05 2.60 1
48 ASN 2.40 0.71 1
50 LYS 0.57 0.14 1
51 ILE 1.17 -1.17 1
52 THR -0.11 -0.96 1
54 TYR -6.06 -1.50 1
55 ILE -0.61 1.04 1
56 ILE -1.28 -0.69 1
57 TYR -5.19 -2.41 1
58 TYR -6.16 -1.52 1
59 SER -3.08 -2.99 1
60 THR 0.72 -0.03 1
61 ASP -3.17 -1.74 1
62 VAL 3.48 1.29 1
63 ASN -0.83 -0.26 1
64 ALA 0.92 0.19 1
65 GLU 0.37 0.43 1
66 ILE 1.06 0.36 1
67 HIS 2.83 3.01 1
68 ASP -0.21 0.40 1
69 TRP 2.64 1.21 1
70 VAL 3.15 1.40 1
71 ILE -1.44 -0.12 1
72 GLU -4.07 -1.47 1
74 VAL -1.97 -0.60 1
75 VAL 2.14 1.33 1
77 ASN 0.82 -1.02 1
78 ARG -2.38 -0.74 1
79 LEU -0.78 -2.19 1
80 THR -4.32 -3.35 1
82 GLN -3.32 -1.70 1
83 ILE -1.48 -0.19 1
84 GLN -3.86 -0.98 1
85 GLU 3.64 0.35 1
86 LEU 1.68 0.05 1
87 THR 0.94 0.81 1
88 LEU 2.00 0.62 1
89 ASP -0.14 -0.06 1
90 THR -2.93 0.99 1
92 TYR -6.79 -0.23 1
93 TYR -4.66 -1.56 1
94 PHE -4.18 -0.45 1
95 LYS -4.68 -0.31 1
96 ILE -3.70 -1.72 1
97 GLN -6.89 -1.54 1
98 ALA -5.39 -1.63 1
99 ARG -5.12 -1.55 1
100 ASN -3.37 -1.51 1
101 SER 4.59 3.57 1
102 LYS -0.10 -1.14 1
104 MET -1.97 -0.41 1
107 MET -2.00 -0.38 1
108 SER -0.67 0.45 1
109 GLU -0.10 -0.08 1
110 ALA 0.04 0.14 1
111 VAL -3.17 -1.21 1
112 GLN -3.26 -1.33 1
113 PHE -3.54 0.73 1
114 ARG -2.94 -2.22 1
115 THR 2.02 0.23 1
117 LYS -0.74 0.26 1
118 ALA -0.26 0.12 1
119 SER -0.50 -0.14 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11111_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -6.89
_LACS_plot.Line_1_terminator_val_y_1 4.67
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -1.39
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 1.24
_LACS_plot.Line_2_terminator_val_x_2 4.58
_LACS_plot.Line_2_terminator_val_y_2 -2.64
_LACS_plot.Y_axis_chem_shift_offset -0.02
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
81 HIS -5.20 6.69 0
10 HIS -0.46 1.92 1
12 THR 0.09 0.07 1
13 THR 0.20 -0.03 1
14 PHE -0.32 0.05 1
15 GLU -1.77 1.41 1
16 LEU -3.83 2.60 1
17 VAL 3.45 -2.40 1
19 THR 0.11 -1.16 1
20 SER -0.19 0.97 1
23 LYS -4.56 3.23 1
24 ASP 2.50 -1.70 1
25 VAL 3.08 -1.50 1
26 THR -4.29 3.09 1
27 VAL -2.83 1.52 1
28 VAL -6.44 3.29 1
29 SER 0.23 0.62 1
30 LYS -0.74 0.37 1
31 GLU 2.82 -0.76 1
33 LYS -2.00 0.52 1
35 LYS 1.34 -0.70 1
36 THR -0.95 0.52 1
37 ILE -5.48 2.51 1
38 ILE -1.32 0.66 1
39 VAL -3.00 0.76 1
40 ASN -4.96 4.45 1
41 TRP -1.31 1.12 1
42 GLN -2.60 1.37 1
45 SER 3.06 -0.71 1
46 GLU -0.91 -1.92 1
47 ALA 2.05 0.55 1
48 ASN 2.40 -1.69 1
50 LYS 0.57 -0.43 1
51 ILE 1.17 -2.34 1
52 THR -0.11 -0.85 1
54 TYR -6.06 4.56 1
55 ILE -0.61 1.65 1
56 ILE -1.28 0.59 1
57 TYR -5.19 2.78 1
58 TYR -6.16 4.64 1
59 SER -3.08 0.09 1
60 THR 0.72 -0.75 1
61 ASP -3.17 1.43 1
62 VAL 3.48 -2.19 1
63 ASN -0.83 0.57 1
64 ALA 0.92 -0.73 1
65 GLU 0.37 0.06 1
66 ILE 1.06 -0.70 1
67 HIS 2.83 0.18 1
68 ASP -0.21 0.61 1
69 TRP 2.64 -1.43 1
70 VAL 3.15 -1.75 1
71 ILE -1.44 1.32 1
72 GLU -4.07 2.60 1
74 VAL -1.97 1.37 1
75 VAL 2.14 -0.81 1
77 ASN 0.82 -1.84 1
78 ARG -2.38 1.64 1
79 LEU -0.78 -1.41 1
80 THR -4.32 0.97 1
82 GLN -3.32 1.62 1
83 ILE -1.48 1.29 1
84 GLN -3.86 2.88 1
85 GLU 3.64 -3.29 1
86 LEU 1.68 -1.63 1
87 THR 0.94 -0.13 1
88 LEU 2.00 -1.38 1
89 ASP -0.14 0.08 1
90 THR -2.93 3.92 1
92 TYR -6.79 6.56 1
93 TYR -4.66 3.10 1
94 PHE -4.18 3.73 1
95 LYS -4.68 4.37 1
96 ILE -3.70 1.98 1
97 GLN -6.89 5.35 1
98 ALA -5.39 3.76 1
99 ARG -5.12 3.57 1
100 ASN -3.37 1.86 1
101 SER 4.59 -1.02 1
102 LYS -0.10 -1.04 1
104 MET -1.97 1.56 1
107 MET -2.00 1.62 1
108 SER -0.67 1.12 1
109 GLU -0.10 0.02 1
110 ALA 0.04 0.10 1
111 VAL -3.17 1.96 1
112 GLN -3.26 1.93 1
113 PHE -3.54 4.27 1
114 ARG -2.94 0.72 1
115 THR 2.02 -1.79 1
117 LYS -0.74 1.00 1
118 ALA -0.26 0.38 1
119 SER -0.50 0.36 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11111_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -6.89
_LACS_plot.Line_1_terminator_val_y_1 0.74
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.20
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.25
_LACS_plot.Line_2_terminator_val_x_2 4.58
_LACS_plot.Line_2_terminator_val_y_2 -0.52
_LACS_plot.Y_axis_chem_shift_offset -0.02
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
79 LEU -0.78 -1.28 0
10 HIS -0.46 -0.14 1
12 THR 0.09 0.02 1
13 THR 0.20 -0.07 1
14 PHE -0.32 0.07 1
15 GLU -1.77 0.07 1
16 LEU -3.83 0.28 1
17 VAL 3.45 -0.11 1
19 THR 0.11 0.11 1
20 SER -0.19 0.17 1
23 LYS -4.56 0.34 1
24 ASP 2.50 -0.45 1
25 VAL 3.08 0.47 1
26 THR -4.29 0.32 1
27 VAL -2.83 0.40 1
28 VAL -6.44 0.25 1
29 SER 0.23 0.03 1
30 LYS -0.74 -0.24 1
31 GLU 2.82 -0.41 1
33 LYS -2.00 0.34 1
35 LYS 1.34 -0.14 1
36 THR -0.95 0.93 1
37 ILE -5.48 0.63 1
38 ILE -1.32 0.15 1
39 VAL -3.00 0.66 1
40 ASN -4.96 0.71 1
41 TRP -1.31 0.34 1
42 GLN -2.60 0.20 1
45 SER 3.06 -0.22 1
46 GLU -0.91 0.23 1
47 ALA 2.05 -0.50 1
48 ASN 2.40 -0.46 1
50 LYS 0.57 -0.09 1
51 ILE 1.17 0.05 1
52 THR -0.11 0.07 1
54 TYR -6.06 0.78 1
55 ILE -0.61 -0.04 1
56 ILE -1.28 0.35 1
57 TYR -5.19 1.39 1
58 TYR -6.16 1.78 1
59 SER -3.08 0.13 1
60 THR 0.72 0.25 1
61 ASP -3.17 0.14 1
62 VAL 3.48 -0.72 1
63 ASN -0.83 0.03 1
64 ALA 0.92 -0.17 1
65 GLU 0.37 -0.27 1
66 ILE 1.06 -0.48 1
67 HIS 2.83 -0.18 1
68 ASP -0.21 0.35 1
69 TRP 2.64 -0.25 1
70 VAL 3.15 -0.37 1
71 ILE -1.44 0.27 1
72 GLU -4.07 0.40 1
74 VAL -1.97 -0.03 1
75 VAL 2.14 0.12 1
77 ASN 0.82 0.25 1
78 ARG -2.38 0.00 1
80 THR -4.32 0.66 1
81 HIS -5.20 0.16 1
82 GLN -3.32 0.91 1
83 ILE -1.48 -0.07 1
84 GLN -3.86 0.60 1
85 GLU 3.64 -0.61 1
86 LEU 1.68 0.05 1
87 THR 0.94 -0.07 1
88 LEU 2.00 -0.18 1
89 ASP -0.14 -0.34 1
92 TYR -6.79 0.08 1
93 TYR -4.66 0.89 1
94 PHE -4.18 1.27 1
95 LYS -4.68 0.25 1
96 ILE -3.70 1.28 1
97 GLN -6.89 0.51 1
98 ALA -5.39 0.55 1
99 ARG -5.12 0.70 1
100 ASN -3.37 0.47 1
101 SER 4.59 -0.33 1
102 LYS -0.10 0.03 1
104 MET -1.97 0.32 1
107 MET -2.00 0.16 1
108 SER -0.67 -0.25 1
109 GLU -0.10 -0.11 1
110 ALA 0.04 0.52 1
111 VAL -3.17 0.49 1
112 GLN -3.26 0.81 1
113 PHE -3.54 -0.07 1
114 ARG -2.94 0.70 1
115 THR 2.02 -0.39 1
117 LYS -0.74 -0.10 1
118 ALA -0.26 -0.09 1
119 SER -0.50 0.00 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11111_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -6.89
_LACS_plot.Line_1_terminator_val_y_1 -2.16
_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 -1.09
_LACS_plot.Line_2_terminator_val_x_2 4.58
_LACS_plot.Line_2_terminator_val_y_2 0.41
_LACS_plot.Y_axis_chem_shift_offset 0.63
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
57 TYR -5.19 0.89 0
65 GLU 0.37 2.80 0
12 THR 0.09 0.15 1
13 THR 0.20 -0.72 1
14 PHE -0.32 -0.58 1
15 GLU -1.77 -1.44 1
16 LEU -3.83 -0.99 1
17 VAL 3.45 -1.87 1
19 THR 0.11 -1.28 1
20 SER -0.19 -1.92 1
23 LYS -4.56 -2.03 1
24 ASP 2.50 -1.71 1
25 VAL 3.08 1.26 1
26 THR -4.29 -2.55 1
27 VAL -2.83 -2.68 1
28 VAL -6.44 -1.97 1
29 SER 0.23 -0.07 1
30 LYS -0.74 -0.60 1
31 GLU 2.82 0.90 1
33 LYS -2.00 -2.07 1
35 LYS 1.34 -1.69 1
36 THR -0.95 -0.13 1
37 ILE -5.48 -2.54 1
38 ILE -1.32 -1.93 1
39 VAL -3.00 -2.20 1
40 ASN -4.96 -1.60 1
41 TRP -1.31 -3.47 1
42 GLN -2.60 -0.72 1
45 SER 3.06 1.00 1
46 GLU -0.91 -1.59 1
47 ALA 2.05 -0.85 1
48 ASN 2.40 -1.98 1
50 LYS 0.57 0.01 1
51 ILE 1.17 0.94 1
52 THR -0.11 0.86 1
54 TYR -6.06 -1.27 1
55 ILE -0.61 -2.38 1
56 ILE -1.28 -3.37 1
58 TYR -6.16 -1.74 1
59 SER -3.08 -0.52 1
60 THR 0.72 -0.54 1
61 ASP -3.17 -0.05 1
62 VAL 3.48 -1.99 1
63 ASN -0.83 0.20 1
64 ALA 0.92 1.05 1
66 ILE 1.06 0.25 1
67 HIS 2.83 1.40 1
68 ASP -0.21 1.32 1
69 TRP 2.64 -0.91 1
70 VAL 3.15 -1.06 1
71 ILE -1.44 -0.09 1
72 GLU -4.07 -1.99 1
74 VAL -1.97 -0.64 1
75 VAL 2.14 0.23 1
77 ASN 0.82 0.10 1
78 ARG -2.38 -2.70 1
79 LEU -0.78 -3.41 1
80 THR -4.32 -2.29 1
81 HIS -5.20 -1.75 1
82 GLN -3.32 -1.75 1
83 ILE -1.48 -2.56 1
84 GLN -3.86 -1.43 1
85 GLU 3.64 -0.60 1
86 LEU 1.68 -0.93 1
87 THR 0.94 0.88 1
88 LEU 2.00 0.59 1
89 ASP -0.14 -1.57 1
90 THR -2.93 -1.89 1
92 TYR -6.79 -2.16 1
93 TYR -4.66 -0.83 1
94 PHE -4.18 0.55 1
95 LYS -4.68 -2.90 1
96 ILE -3.70 -2.30 1
97 GLN -6.89 -2.52 1
98 ALA -5.39 -3.11 1
99 ARG -5.12 -1.83 1
100 ASN -3.37 1.32 1
101 SER 4.59 0.72 1
102 LYS -0.10 0.13 1
104 MET -1.97 0.79 1
107 MET -2.00 0.65 1
108 SER -0.67 -0.58 1
109 GLU -0.10 1.08 1
110 ALA 0.04 0.24 1
111 VAL -3.17 -1.51 1
112 GLN -3.26 -0.74 1
113 PHE -3.54 -3.64 1
114 ARG -2.94 -1.35 1
115 THR 2.02 -0.78 1
117 LYS -0.74 0.25 1
118 ALA -0.26 -0.20 1
119 SER -0.50 -0.05 1
stop_
save_