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 bmr11191_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -8.96
_LACS_plot.Line_1_terminator_val_y_1 -3.74
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 0.93
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.30
_LACS_plot.Line_2_terminator_val_x_2 6.46
_LACS_plot.Line_2_terminator_val_y_2 4.97
_LACS_plot.Y_axis_chem_shift_offset -0.13
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
45 ILE 1.98 -2.55 0
10 THR -2.19 -0.62 1
13 ILE 1.67 0.39 1
14 VAL -1.56 -0.83 1
17 GLN -4.51 -1.89 1
18 GLU 1.45 0.76 1
19 MET -3.41 -1.73 1
20 ILE -0.70 -0.36 1
21 ILE -5.04 -2.13 1
22 GLU -6.76 -2.52 1
23 ILE -4.99 -1.56 1
24 SER -0.35 -0.82 1
25 LYS 1.15 1.94 1
27 ARG 1.98 1.20 1
28 SER -1.06 -0.22 1
30 LEU 2.23 2.77 1
32 LEU -5.16 -1.85 1
33 SER -3.98 -2.52 1
34 ILE -5.52 -2.14 1
35 VAL -5.49 -2.31 1
38 LYS 3.03 2.03 1
39 ASP 1.81 -0.70 1
40 THR -0.04 0.17 1
42 LEU -0.50 0.43 1
43 ASN 2.85 2.28 1
44 ALA -2.90 -0.92 1
46 VAL -5.13 -2.20 1
47 ILE 3.36 2.39 1
48 HIS -1.13 2.32 1
49 GLU -5.10 -1.23 1
50 VAL 0.09 -0.85 1
51 TYR 0.49 -0.83 1
52 GLU 2.60 2.64 1
53 GLU 1.02 0.17 1
55 ALA 1.02 2.30 1
56 ALA 3.28 2.86 1
57 ALA 3.05 2.70 1
58 ARG 3.84 3.02 1
59 ASP 0.41 2.98 1
61 ARG 0.26 2.69 1
62 LEU -0.26 0.49 1
63 TRP -8.96 -4.61 1
64 ALA 2.51 1.09 1
66 ASP 2.37 1.88 1
67 GLN -2.54 -1.32 1
68 ILE -0.36 -0.38 1
69 LEU 1.25 0.93 1
70 GLU -6.01 -1.36 1
71 VAL -4.23 -2.55 1
72 ASN 2.58 1.69 1
74 VAL 1.55 0.30 1
75 ASP 0.46 0.98 1
76 LEU -1.05 -1.11 1
77 ARG 4.99 3.70 1
78 ASN -1.53 -0.72 1
79 SER -0.94 0.85 1
80 SER -1.92 -0.46 1
81 HIS 6.41 6.86 1
82 GLU 3.17 2.77 1
83 GLU 2.42 2.53 1
84 ALA 2.44 2.69 1
85 ILE 4.73 2.63 1
86 THR 6.46 5.29 1
87 ALA 3.44 2.48 1
88 LEU 2.75 2.38 1
89 ARG 2.67 2.63 1
90 GLN 1.16 -0.48 1
91 THR -1.57 -1.21 1
93 GLN 3.95 3.62 1
94 LYS -0.49 -0.89 1
95 VAL -1.31 -0.87 1
96 ARG -1.85 -1.16 1
97 LEU -5.00 -1.43 1
98 VAL 0.35 -0.52 1
99 VAL -6.85 -3.48 1
100 TYR -4.37 -0.06 1
101 ARG -4.03 -1.79 1
102 ASP -0.90 0.29 1
103 GLU 0.03 0.72 1
104 ALA 0.47 0.40 1
105 HIS -0.07 0.80 1
106 TYR 0.15 0.24 1
107 ARG -0.65 -0.19 1
108 ASP 0.16 0.32 1
109 GLU -0.18 0.25 1
110 GLU -0.14 0.22 1
111 SER 0.00 0.22 1
114 SER 0.08 0.06 1
115 SER -0.15 0.14 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11191_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -8.96
_LACS_plot.Line_1_terminator_val_y_1 5.22
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -1.07
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.70
_LACS_plot.Line_2_terminator_val_x_2 6.46
_LACS_plot.Line_2_terminator_val_y_2 -1.49
_LACS_plot.Y_axis_chem_shift_offset -0.13
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
45 ILE 1.98 -4.53 0
10 THR -2.19 1.57 1
13 ILE 1.67 -1.28 1
14 VAL -1.56 0.73 1
17 GLN -4.51 2.62 1
18 GLU 1.45 -0.69 1
19 MET -3.41 1.68 1
20 ILE -0.70 0.34 1
21 ILE -5.04 2.91 1
22 GLU -6.76 4.24 1
23 ILE -4.99 3.43 1
24 SER -0.35 -0.47 1
25 LYS 1.15 0.79 1
27 ARG 1.98 -0.78 1
28 SER -1.06 0.84 1
30 LEU 2.23 0.54 1
32 LEU -5.16 3.31 1
33 SER -3.98 1.46 1
34 ILE -5.52 3.38 1
35 VAL -5.49 3.18 1
38 LYS 3.03 -1.00 1
39 ASP 1.81 -2.51 1
40 THR -0.04 0.21 1
42 LEU -0.50 0.93 1
43 ASN 2.85 -0.57 1
44 ALA -2.90 1.98 1
46 VAL -5.13 2.93 1
47 ILE 3.36 -0.97 1
48 HIS -1.13 3.45 1
49 GLU -5.10 3.87 1
50 VAL 0.09 -0.94 1
51 TYR 0.49 -1.32 1
52 GLU 2.60 0.04 1
53 GLU 1.02 -0.85 1
55 ALA 1.02 1.28 1
56 ALA 3.28 -0.42 1
57 ALA 3.05 -0.35 1
58 ARG 3.84 -0.82 1
59 ASP 0.41 2.57 1
61 ARG 0.26 2.43 1
62 LEU -0.26 0.75 1
63 TRP -8.96 4.35 1
64 ALA 2.51 -1.42 1
66 ASP 2.37 -0.49 1
67 GLN -2.54 1.22 1
68 ILE -0.36 -0.02 1
69 LEU 1.25 -0.32 1
70 GLU -6.01 4.65 1
71 VAL -4.23 1.68 1
72 ASN 2.58 -0.89 1
74 VAL 1.55 -1.25 1
75 ASP 0.46 0.52 1
76 LEU -1.05 -0.06 1
77 ARG 4.99 -1.29 1
78 ASN -1.53 0.81 1
79 SER -0.94 1.79 1
80 SER -1.92 1.46 1
81 HIS 6.41 0.45 1
82 GLU 3.17 -0.40 1
83 GLU 2.42 0.11 1
84 ALA 2.44 0.25 1
85 ILE 4.73 -2.10 1
86 THR 6.46 -1.17 1
87 ALA 3.44 -0.96 1
88 LEU 2.75 -0.37 1
89 ARG 2.67 -0.04 1
90 GLN 1.16 -1.64 1
91 THR -1.57 0.36 1
93 GLN 3.95 -0.33 1
94 LYS -0.49 -0.40 1
95 VAL -1.31 0.44 1
96 ARG -1.85 0.69 1
97 LEU -5.00 3.57 1
98 VAL 0.35 -0.87 1
99 VAL -6.85 3.37 1
100 TYR -4.37 4.31 1
101 ARG -4.03 2.24 1
102 ASP -0.90 1.19 1
103 GLU 0.03 0.69 1
104 ALA 0.47 -0.07 1
105 HIS -0.07 0.87 1
106 TYR 0.15 0.09 1
107 ARG -0.65 0.46 1
108 ASP 0.16 0.16 1
109 GLU -0.18 0.43 1
110 GLU -0.14 0.36 1
111 SER 0.00 0.22 1
114 SER 0.08 -0.02 1
115 SER -0.15 0.29 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11191_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -8.96
_LACS_plot.Line_1_terminator_val_y_1 1.01
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.18
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.22
_LACS_plot.Line_2_terminator_val_x_2 6.46
_LACS_plot.Line_2_terminator_val_y_2 -0.63
_LACS_plot.Y_axis_chem_shift_offset -0.03
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
63 TRP -8.96 0.29 0
10 THR -2.19 0.11 1
13 ILE 1.67 -0.47 1
14 VAL -1.56 -0.08 1
17 GLN -4.51 0.44 1
18 GLU 1.45 0.31 1
19 MET -3.41 0.45 1
20 ILE -0.70 0.77 1
21 ILE -5.04 0.73 1
22 GLU -6.76 1.11 1
23 ILE -4.99 0.15 1
24 SER -0.35 0.55 1
25 LYS 1.15 -0.43 1
27 ARG 1.98 -0.02 1
28 SER -1.06 0.21 1
30 LEU 2.23 -0.31 1
32 LEU -5.16 0.50 1
33 SER -3.98 0.55 1
34 ILE -5.52 1.22 1
35 VAL -5.49 0.53 1
38 LYS 3.03 -0.09 1
39 ASP 1.81 -0.07 1
40 THR -0.04 0.43 1
42 LEU -0.50 -0.05 1
43 ASN 2.85 -0.45 1
44 ALA -2.90 -0.05 1
45 ILE 1.98 0.34 1
46 VAL -5.13 0.75 1
47 ILE 3.36 -0.16 1
48 HIS -1.13 -0.02 1
49 GLU -5.10 -0.14 1
50 VAL 0.09 -0.09 1
51 TYR 0.49 0.12 1
52 GLU 2.60 -0.42 1
53 GLU 1.02 -0.05 1
55 ALA 1.02 -0.22 1
56 ALA 3.28 -0.19 1
57 ALA 3.05 -0.27 1
58 ARG 3.84 -0.33 1
59 ASP 0.41 -0.22 1
61 ARG 0.26 -0.02 1
62 LEU -0.26 -0.45 1
64 ALA 2.51 -0.59 1
66 ASP 2.37 0.07 1
67 GLN -2.54 0.96 1
68 ILE -0.36 0.25 1
69 LEU 1.25 -0.06 1
70 GLU -6.01 0.76 1
71 VAL -4.23 0.77 1
72 ASN 2.58 -0.37 1
74 VAL 1.55 -0.17 1
75 ASP 0.46 -0.24 1
76 LEU -1.05 0.61 1
77 ARG 4.99 -0.31 1
78 ASN -1.53 0.25 1
79 SER -0.94 0.22 1
80 SER -1.92 0.13 1
81 HIS 6.41 -0.66 1
82 GLU 3.17 -0.38 1
83 GLU 2.42 -0.41 1
84 ALA 2.44 -0.29 1
85 ILE 4.73 -0.55 1
86 THR 6.46 -0.58 1
87 ALA 3.44 -0.22 1
88 LEU 2.75 -0.40 1
89 ARG 2.67 -0.09 1
90 GLN 1.16 0.20 1
91 THR -1.57 0.01 1
93 GLN 3.95 -0.37 1
94 LYS -0.49 0.45 1
95 VAL -1.31 0.19 1
96 ARG -1.85 0.75 1
97 LEU -5.00 0.90 1
98 VAL 0.35 0.92 1
99 VAL -6.85 1.38 1
100 TYR -4.37 0.05 1
101 ARG -4.03 0.22 1
102 ASP -0.90 -0.25 1
103 GLU 0.03 -0.29 1
104 ALA 0.47 -0.11 1
105 HIS -0.07 -0.11 1
106 TYR 0.15 -0.01 1
107 ARG -0.65 -0.06 1
108 ASP 0.16 -0.10 1
109 GLU -0.18 -0.09 1
110 GLU -0.14 -0.05 1
111 SER 0.00 0.00 1
114 SER 0.08 0.05 1
115 SER -0.15 0.04 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11191_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -8.96
_LACS_plot.Line_1_terminator_val_y_1 -3.01
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 0.46
_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 6.46
_LACS_plot.Line_2_terminator_val_y_2 2.04
_LACS_plot.Y_axis_chem_shift_offset 0.19
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
63 TRP -8.96 0.04 0
10 THR -2.19 0.12 1
13 ILE 1.67 -1.12 1
14 VAL -1.56 -0.80 1
17 GLN -4.51 -1.44 1
18 GLU 1.45 -0.32 1
19 MET -3.41 -2.48 1
20 ILE -0.70 -0.42 1
21 ILE -5.04 -2.81 1
22 GLU -6.76 -1.64 1
23 ILE -4.99 -1.60 1
24 SER -0.35 -0.11 1
25 LYS 1.15 0.31 1
32 LEU -5.16 -2.36 1
33 SER -3.98 0.69 1
34 ILE -5.52 -0.88 1
35 VAL -5.49 -2.08 1
39 ASP 1.81 -1.78 1
40 THR -0.04 0.55 1
42 LEU -0.50 -0.62 1
43 ASN 2.85 -1.29 1
44 ALA -2.90 -2.70 1
45 ILE 1.98 -1.35 1
46 VAL -5.13 -0.50 1
47 ILE 3.36 -0.72 1
48 HIS -1.13 -0.31 1
49 GLU -5.10 -3.46 1
50 VAL 0.09 -0.20 1
51 TYR 0.49 1.73 1
52 GLU 2.60 0.22 1
53 GLU 1.02 -0.27 1
55 ALA 1.02 2.87 1
56 ALA 3.28 3.18 1
57 ALA 3.05 2.20 1
58 ARG 3.84 2.05 1
59 ASP 0.41 1.52 1
61 ARG 0.26 0.38 1
62 LEU -0.26 -1.87 1
64 ALA 2.51 0.97 1
66 ASP 2.37 -1.20 1
67 GLN -2.54 0.37 1
68 ILE -0.36 -1.65 1
69 LEU 1.25 -1.18 1
70 GLU -6.01 -1.80 1
71 VAL -4.23 -1.65 1
72 ASN 2.58 -0.64 1
74 VAL 1.55 -1.48 1
75 ASP 0.46 0.64 1
76 LEU -1.05 1.77 1
77 ARG 4.99 0.82 1
78 ASN -1.53 -0.75 1
79 SER -0.94 0.68 1
80 SER -1.92 -0.45 1
81 HIS 6.41 2.86 1
82 GLU 3.17 3.03 1
83 GLU 2.42 2.98 1
84 ALA 2.44 0.69 1
85 ILE 4.73 3.09 1
86 THR 6.46 0.82 1
87 ALA 3.44 2.18 1
88 LEU 2.75 1.33 1
89 ARG 2.67 1.75 1
90 GLN 1.16 -0.67 1
91 THR -1.57 0.20 1
93 GLN 3.95 -0.42 1
94 LYS -0.49 -1.44 1
95 VAL -1.31 -2.36 1
96 ARG -1.85 -0.93 1
97 LEU -5.00 -2.35 1
98 VAL 0.35 -0.14 1
99 VAL -6.85 -2.80 1
100 TYR -4.37 -3.40 1
101 ARG -4.03 -2.67 1
102 ASP -0.90 0.17 1
103 GLU 0.03 -0.37 1
104 ALA 0.47 -0.08 1
105 HIS -0.07 0.55 1
106 TYR 0.15 -0.52 1
107 ARG -0.65 -0.86 1
108 ASP 0.16 0.07 1
109 GLU -0.18 0.12 1
110 GLU -0.14 0.06 1
111 SER 0.00 0.06 1
114 SER 0.08 0.13 1
115 SER -0.15 -0.66 1
stop_
save_