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 bmr11182_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -7.00
_LACS_plot.Line_1_terminator_val_y_1 -2.78
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 0.72
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.63
_LACS_plot.Line_2_terminator_val_x_2 6.63
_LACS_plot.Line_2_terminator_val_y_2 5.16
_LACS_plot.Y_axis_chem_shift_offset 0.06
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
81 GLU -6.53 -0.83 0
10 TRP -4.24 -1.69 1
11 GLN -3.70 -0.75 1
13 SER -1.73 -0.89 1
14 LYS 4.01 3.03 1
15 GLU 1.40 0.90 1
17 ASP 0.66 -0.27 1
18 ARG -4.87 -2.00 1
19 LEU -4.08 -1.04 1
20 ILE -1.44 -2.55 1
22 ARG -1.83 -1.41 1
23 VAL -2.94 -1.73 1
24 ILE -1.37 -1.26 1
25 LEU -2.96 -2.39 1
26 ASN -1.22 -0.53 1
27 LYS 1.30 1.09 1
28 ARG 1.57 0.72 1
29 THR 0.30 -0.04 1
30 THR 0.72 0.34 1
31 MET 0.16 0.28 1
33 LYS 0.96 0.62 1
34 ASP 0.08 0.35 1
35 SER 1.42 1.38 1
37 ALA 0.49 0.75 1
38 LEU 0.67 0.67 1
39 LEU 3.24 1.87 1
41 LEU -4.57 -1.29 1
42 LYS -1.82 -0.10 1
43 VAL -4.01 -1.86 1
44 VAL -2.47 -1.13 1
47 LYS -1.45 -1.21 1
48 MET 2.18 0.44 1
49 THR -3.93 -1.45 1
50 ASP 2.94 1.81 1
51 LEU 0.26 -0.21 1
53 ARG -4.09 -2.56 1
54 LEU -0.89 -0.43 1
56 ALA -6.61 -3.37 1
57 PHE -5.72 -1.47 1
58 ILE 1.57 0.83 1
59 THR 1.08 0.09 1
60 LYS -3.19 0.20 1
61 VAL -2.46 -1.11 1
62 LYS 0.33 0.07 1
63 LYS 2.94 1.48 1
65 SER -2.27 -0.17 1
66 LEU 3.06 3.64 1
67 ALA 2.77 3.13 1
68 ASP -0.37 2.20 1
69 VAL 3.51 2.94 1
70 VAL 2.49 1.59 1
72 HIS 2.32 0.61 1
73 LEU -0.49 -0.38 1
74 ARG -5.72 -1.34 1
75 ALA 2.30 0.71 1
77 ASP 2.31 2.11 1
78 GLU -2.47 -1.82 1
79 VAL 1.55 -0.20 1
80 LEU 0.86 0.76 1
82 TRP -2.72 -1.27 1
83 ASN 1.40 0.74 1
85 LYS -1.61 -1.75 1
87 LEU 3.61 2.48 1
90 ALA -1.63 -1.06 1
91 THR -2.24 -0.83 1
92 ASN 4.84 4.87 1
93 GLU 3.84 3.31 1
94 GLU 2.39 2.56 1
95 VAL 6.63 5.23 1
96 TYR 4.90 3.86 1
97 ASN 3.98 3.30 1
98 ILE 4.49 4.26 1
99 ILE 6.11 4.21 1
100 LEU 3.93 3.21 1
101 GLU 2.83 2.22 1
102 SER -0.57 0.66 1
103 LYS 4.29 3.94 1
104 SER 1.05 0.48 1
105 GLU -0.65 -0.29 1
107 GLN -4.49 -1.64 1
108 VAL -4.69 -2.17 1
109 GLU -4.70 -2.66 1
110 ILE -4.69 -1.37 1
111 ILE -1.58 -2.22 1
112 VAL -7.00 -3.72 1
113 SER -3.95 -2.42 1
114 ARG -5.59 -1.01 1
116 SER -0.51 -0.21 1
119 SER 0.14 0.10 1
120 SER -0.35 0.11 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11182_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -7.00
_LACS_plot.Line_1_terminator_val_y_1 4.22
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -1.28
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.37
_LACS_plot.Line_2_terminator_val_x_2 6.63
_LACS_plot.Line_2_terminator_val_y_2 -1.47
_LACS_plot.Y_axis_chem_shift_offset 0.06
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
81 GLU -6.53 5.70 0
10 TRP -4.24 2.55 1
11 GLN -3.70 2.95 1
13 SER -1.73 0.84 1
14 LYS 4.01 -0.98 1
15 GLU 1.40 -0.50 1
17 ASP 0.66 -0.93 1
18 ARG -4.87 2.87 1
19 LEU -4.08 3.04 1
20 ILE -1.44 -1.11 1
22 ARG -1.83 0.42 1
23 VAL -2.94 1.21 1
24 ILE -1.37 0.11 1
25 LEU -2.96 0.57 1
26 ASN -1.22 0.69 1
27 LYS 1.30 -0.21 1
28 ARG 1.57 -0.85 1
29 THR 0.30 -0.34 1
30 THR 0.72 -0.38 1
31 MET 0.16 0.12 1
33 LYS 0.96 -0.34 1
34 ASP 0.08 0.27 1
35 SER 1.42 -0.04 1
37 ALA 0.49 0.26 1
38 LEU 0.67 0.00 1
39 LEU 3.24 -1.37 1
41 LEU -4.57 3.28 1
42 LYS -1.82 1.72 1
43 VAL -4.01 2.15 1
44 VAL -2.47 1.34 1
47 LYS -1.45 0.24 1
48 MET 2.18 -1.74 1
49 THR -3.93 2.48 1
50 ASP 2.94 -1.13 1
51 LEU 0.26 -0.47 1
53 ARG -4.09 1.53 1
54 LEU -0.89 0.46 1
56 ALA -6.61 3.24 1
57 PHE -5.72 4.25 1
58 ILE 1.57 -0.74 1
59 THR 1.08 -0.99 1
60 LYS -3.19 3.39 1
61 VAL -2.46 1.35 1
62 LYS 0.33 -0.26 1
63 LYS 2.94 -1.46 1
65 SER -2.27 2.10 1
66 LEU 3.06 0.58 1
67 ALA 2.77 0.36 1
68 ASP -0.37 2.57 1
69 VAL 3.51 -0.57 1
70 VAL 2.49 -0.90 1
72 HIS 2.32 -1.71 1
73 LEU -0.49 0.11 1
74 ARG -5.72 4.38 1
75 ALA 2.30 -1.59 1
77 ASP 2.31 -0.20 1
78 GLU -2.47 0.65 1
79 VAL 1.55 -1.75 1
80 LEU 0.86 -0.10 1
82 TRP -2.72 1.45 1
83 ASN 1.40 -0.66 1
85 LYS -1.61 -0.14 1
87 LEU 3.61 -1.13 1
90 ALA -1.63 0.57 1
91 THR -2.24 1.41 1
92 ASN 4.84 0.03 1
93 GLU 3.84 -0.53 1
94 GLU 2.39 0.17 1
95 VAL 6.63 -1.40 1
96 TYR 4.90 -1.04 1
97 ASN 3.98 -0.68 1
98 ILE 4.49 -0.23 1
99 ILE 6.11 -1.90 1
100 LEU 3.93 -0.72 1
101 GLU 2.83 -0.61 1
102 SER -0.57 1.23 1
103 LYS 4.29 -0.35 1
104 SER 1.05 -0.57 1
105 GLU -0.65 0.36 1
107 GLN -4.49 2.85 1
108 VAL -4.69 2.52 1
109 GLU -4.70 2.04 1
110 ILE -4.69 3.32 1
111 ILE -1.58 -0.64 1
112 VAL -7.00 3.28 1
113 SER -3.95 1.53 1
114 ARG -5.59 4.58 1
116 SER -0.51 0.30 1
119 SER 0.14 -0.04 1
120 SER -0.35 0.46 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11182_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -7.00
_LACS_plot.Line_1_terminator_val_y_1 0.80
_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 0.26
_LACS_plot.Line_2_terminator_val_x_2 6.63
_LACS_plot.Line_2_terminator_val_y_2 -0.66
_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
20 ILE -1.44 1.08 0
99 ILE 6.11 -1.30 0
112 VAL -7.00 1.61 0
111 ILE -1.58 1.18 0
10 TRP -4.24 0.78 1
11 GLN -3.70 0.43 1
13 SER -1.73 0.00 1
14 LYS 4.01 -0.25 1
15 GLU 1.40 -0.06 1
17 ASP 0.66 -0.04 1
18 ARG -4.87 0.67 1
19 LEU -4.08 0.49 1
22 ARG -1.83 0.47 1
23 VAL -2.94 0.33 1
24 ILE -1.37 0.45 1
25 LEU -2.96 0.29 1
26 ASN -1.22 0.18 1
27 LYS 1.30 -0.23 1
28 ARG 1.57 -0.01 1
29 THR 0.30 0.06 1
30 THR 0.72 -0.03 1
31 MET 0.16 0.09 1
33 LYS 0.96 -0.07 1
34 ASP 0.08 -0.02 1
35 SER 1.42 -0.10 1
37 ALA 0.49 0.00 1
38 LEU 0.67 0.01 1
39 LEU 3.24 -0.24 1
41 LEU -4.57 0.78 1
42 LYS -1.82 0.31 1
43 VAL -4.01 0.78 1
44 VAL -2.47 0.36 1
47 LYS -1.45 0.15 1
48 MET 2.18 0.17 1
49 THR -3.93 0.44 1
50 ASP 2.94 -0.21 1
51 LEU 0.26 0.05 1
53 ARG -4.09 0.40 1
54 LEU -0.89 0.44 1
56 ALA -6.61 1.28 1
57 PHE -5.72 0.70 1
58 ILE 1.57 0.41 1
59 THR 1.08 0.30 1
60 LYS -3.19 0.15 1
61 VAL -2.46 0.30 1
62 LYS 0.33 -0.05 1
63 LYS 2.94 -0.12 1
65 SER -2.27 0.06 1
66 LEU 3.06 -0.28 1
67 ALA 2.77 -0.65 1
68 ASP -0.37 -0.20 1
69 VAL 3.51 -0.43 1
70 VAL 2.49 -0.06 1
72 HIS 2.32 0.06 1
73 LEU -0.49 -0.10 1
74 ARG -5.72 0.25 1
75 ALA 2.30 -0.51 1
77 ASP 2.31 0.19 1
78 GLU -2.47 0.06 1
79 VAL 1.55 0.19 1
80 LEU 0.86 0.02 1
81 GLU -6.53 0.71 1
82 TRP -2.72 0.04 1
83 ASN 1.40 -0.17 1
85 LYS -1.61 0.31 1
87 LEU 3.61 -0.05 1
90 ALA -1.63 0.29 1
91 THR -2.24 -0.12 1
92 ASN 4.84 -0.78 1
93 GLU 3.84 -0.37 1
94 GLU 2.39 -0.33 1
95 VAL 6.63 -0.81 1
96 TYR 4.90 -0.74 1
97 ASN 3.98 -0.38 1
98 ILE 4.49 -0.52 1
100 LEU 3.93 -0.47 1
101 GLU 2.83 -0.25 1
102 SER -0.57 0.29 1
103 LYS 4.29 -0.25 1
104 SER 1.05 -0.04 1
105 GLU -0.65 -0.04 1
107 GLN -4.49 0.80 1
108 VAL -4.69 0.36 1
109 GLU -4.70 0.74 1
110 ILE -4.69 0.32 1
113 SER -3.95 1.32 1
114 ARG -5.59 0.68 1
116 SER -0.51 -0.19 1
119 SER 0.14 0.03 1
120 SER -0.35 0.03 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11182_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -7.00
_LACS_plot.Line_1_terminator_val_y_1 -2.34
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 0.73
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -0.63
_LACS_plot.Line_2_terminator_val_x_2 6.63
_LACS_plot.Line_2_terminator_val_y_2 2.30
_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
95 VAL 6.63 0.13 0
99 ILE 6.11 4.47 0
10 TRP -4.24 0.32 1
11 GLN -3.70 -1.48 1
13 SER -1.73 1.09 1
14 LYS 4.01 1.43 1
15 GLU 1.40 1.24 1
17 ASP 0.66 -0.45 1
18 ARG -4.87 -1.80 1
19 LEU -4.08 -2.59 1
20 ILE -1.44 0.29 1
22 ARG -1.83 -1.70 1
23 VAL -2.94 -2.75 1
24 ILE -1.37 -1.22 1
25 LEU -2.96 -3.07 1
26 ASN -1.22 -0.04 1
27 LYS 1.30 0.21 1
28 ARG 1.57 0.41 1
29 THR 0.30 -0.30 1
30 THR 0.72 -0.33 1
31 MET 0.16 -0.19 1
33 LYS 0.96 -0.19 1
34 ASP 0.08 0.21 1
35 SER 1.42 -0.18 1
37 ALA 0.49 0.09 1
38 LEU 0.67 0.32 1
39 LEU 3.24 -1.49 1
41 LEU -4.57 -1.42 1
42 LYS -1.82 -1.63 1
43 VAL -4.01 -1.28 1
44 VAL -2.47 -1.24 1
47 LYS -1.45 -0.30 1
48 MET 2.18 0.24 1
49 THR -3.93 1.34 1
50 ASP 2.94 0.38 1
51 LEU 0.26 0.53 1
53 ARG -4.09 -1.47 1
54 LEU -0.89 0.71 1
56 ALA -6.61 -1.80 1
57 PHE -5.72 -0.25 1
58 ILE 1.57 1.44 1
59 THR 1.08 0.42 1
60 LYS -3.19 -3.08 1
61 VAL -2.46 -0.79 1
62 LYS 0.33 0.76 1
63 LYS 2.94 1.91 1
65 SER -2.27 0.37 1
66 LEU 3.06 1.74 1
67 ALA 2.77 -1.48 1
68 ASP -0.37 0.61 1
69 VAL 3.51 0.32 1
70 VAL 2.49 0.94 1
72 HIS 2.32 2.15 1
73 LEU -0.49 -1.89 1
74 ARG -5.72 -1.50 1
75 ALA 2.30 0.87 1
77 ASP 2.31 -0.92 1
78 GLU -2.47 -0.27 1
79 VAL 1.55 -1.36 1
80 LEU 0.86 1.98 1
81 GLU -6.53 -3.10 1
82 TRP -2.72 -0.66 1
83 ASN 1.40 0.25 1
85 LYS -1.61 -0.70 1
87 LEU 3.61 -0.79 1
90 ALA -1.63 0.12 1
91 THR -2.24 0.52 1
92 ASN 4.84 1.93 1
93 GLU 3.84 1.91 1
94 GLU 2.39 3.28 1
96 TYR 4.90 1.96 1
97 ASN 3.98 2.42 1
98 ILE 4.49 2.45 1
100 LEU 3.93 2.70 1
101 GLU 2.83 1.17 1
102 SER -0.57 0.98 1
103 LYS 4.29 0.71 1
104 SER 1.05 0.11 1
105 GLU -0.65 1.61 1
107 GLN -4.49 -2.11 1
108 VAL -4.69 -3.46 1
109 GLU -4.70 -2.04 1
110 ILE -4.69 -2.20 1
111 ILE -1.58 0.42 1
112 VAL -7.00 -1.84 1
113 SER -3.95 -1.22 1
114 ARG -5.59 -1.13 1
116 SER -0.51 -0.05 1
119 SER 0.14 0.10 1
120 SER -0.35 -0.70 1
stop_
save_