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 bmr5145_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -4.40
_LACS_plot.Line_1_terminator_val_y_1 -1.99
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 0.83
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.74
_LACS_plot.Line_2_terminator_val_x_2 6.69
_LACS_plot.Line_2_terminator_val_y_2 5.32
_LACS_plot.Y_axis_chem_shift_offset 0.08
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
46 ASP 0.40 -1.70 0
47 ILE -4.40 -1.60 0
10 HIS -0.20 -0.10 1
12 ILE -0.10 -0.10 1
14 TRP -0.70 -0.50 1
15 ASN -0.30 -0.60 1
16 ARG 0.60 0.30 1
17 LYS 0.10 -0.10 1
18 ALA -0.70 -0.60 1
19 LEU -0.20 -0.30 1
21 SER 0.00 -0.10 1
22 THR 0.60 0.20 1
23 ALA 0.60 0.50 1
24 GLN 0.30 0.20 1
25 ILE 0.70 0.50 1
26 THR 0.70 0.50 1
27 GLU 1.00 0.40 1
28 ALA 1.00 0.70 1
29 GLN 0.90 0.60 1
30 VAL 1.30 0.90 1
31 ALA 1.20 0.90 1
32 GLU 1.00 0.40 1
33 ASN -0.70 -0.80 1
34 ARG 0.40 0.20 1
37 ALA -0.50 0.50 1
38 PHE -2.50 -2.60 1
39 ILE -1.20 -0.10 1
40 LYS -1.20 -0.90 1
41 GLN -0.20 0.00 1
43 ARG -0.40 -0.10 1
44 LYS 0.90 -0.30 1
45 LEU -0.40 -0.40 1
48 ASP -1.50 -1.90 1
49 PHE 0.60 0.50 1
51 ALA 5.00 4.50 1
52 GLU 3.70 2.90 1
54 ASN 4.50 2.80 1
55 ARG 4.20 3.30 1
56 TYR 3.60 4.10 1
57 TYR 4.80 4.80 1
58 GLU 4.30 2.90 1
59 ALA -0.70 0.30 1
60 ASN -1.50 0.10 1
61 TYR 6.60 3.50 1
62 TRP 1.90 -0.50 1
63 GLN 1.30 0.20 1
64 PHE -0.50 0.70 1
70 TYR -0.30 1.60 1
71 ASN 0.10 -0.80 1
74 SER 1.10 0.80 1
75 GLU -0.20 -0.50 1
76 ALA 0.80 0.50 1
77 ASN 1.40 0.30 1
78 VAL -0.70 -0.20 1
79 THR -2.70 -1.20 1
80 LYS 4.70 3.30 1
81 GLU 4.50 3.10 1
82 ALA 2.70 2.20 1
83 PHE 3.40 3.50 1
84 VAL 6.70 5.50 1
85 THR 6.10 5.10 1
88 ILE 5.30 4.50 1
89 ASN 4.10 2.80 1
90 ALA 3.30 2.40 1
91 THR 6.10 4.20 1
92 GLN 4.30 3.40 1
93 ALA 2.80 1.90 1
94 ALA 0.60 0.50 1
95 ASN -3.80 -2.00 1
96 GLN 5.10 4.40 1
98 GLU 1.80 1.20 1
99 PHE 1.90 2.20 1
100 GLN 0.30 -0.20 1
101 LYS 0.80 0.50 1
103 ASP 0.00 -0.20 1
104 ASN -0.70 -0.60 1
105 LYS 4.10 3.30 1
106 LEU 3.80 2.30 1
107 HIS 5.20 5.10 1
108 GLN 3.90 3.40 1
109 GLN 4.30 3.60 1
110 VAL 5.70 3.80 1
111 LEU 3.30 3.10 1
112 TRP 3.60 3.30 1
113 ARG 4.00 2.00 1
114 LEU 3.60 3.60 1
115 VAL 6.50 5.10 1
116 GLN 5.30 4.20 1
117 GLU 3.50 2.10 1
118 LEU 3.30 2.90 1
120 SER 3.00 2.50 1
121 LEU -0.20 0.20 1
123 HIS -2.20 -0.60 1
125 GLU 2.20 1.20 1
126 PHE 0.30 -0.90 1
127 TRP -0.90 -1.40 1
128 LEU 0.00 0.00 1
129 GLU -0.60 -0.90 1
130 ARG -0.00 -0.10 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr5145_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -4.40
_LACS_plot.Line_1_terminator_val_y_1 2.41
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -1.17
_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 6.69
_LACS_plot.Line_2_terminator_val_y_2 -1.37
_LACS_plot.Y_axis_chem_shift_offset 0.08
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
46 ASP 0.40 -2.10 0
47 ILE -4.40 2.80 0
10 HIS -0.20 0.10 1
12 ILE -0.10 0.00 1
14 TRP -0.70 0.20 1
15 ASN -0.30 -0.30 1
16 ARG 0.60 -0.30 1
17 LYS 0.10 -0.20 1
18 ALA -0.70 0.10 1
19 LEU -0.20 -0.10 1
21 SER 0.00 -0.10 1
22 THR 0.60 -0.40 1
23 ALA 0.60 -0.10 1
24 GLN 0.30 -0.10 1
25 ILE 0.70 -0.20 1
26 THR 0.70 -0.20 1
27 GLU 1.00 -0.60 1
28 ALA 1.00 -0.30 1
29 GLN 0.90 -0.30 1
30 VAL 1.30 -0.40 1
31 ALA 1.20 -0.30 1
32 GLU 1.00 -0.60 1
33 ASN -0.70 -0.10 1
34 ARG 0.40 -0.20 1
37 ALA -0.50 1.00 1
38 PHE -2.50 -0.10 1
39 ILE -1.20 1.10 1
40 LYS -1.20 0.30 1
41 GLN -0.20 0.20 1
43 ARG -0.40 0.30 1
44 LYS 0.90 -1.20 1
45 LEU -0.40 0.00 1
48 ASP -1.50 -0.40 1
49 PHE 0.60 -0.10 1
51 ALA 5.00 -0.50 1
52 GLU 3.70 -0.80 1
54 ASN 4.50 -1.70 1
55 ARG 4.20 -0.90 1
56 TYR 3.60 0.50 1
57 TYR 4.80 0.00 1
58 GLU 4.30 -1.40 1
59 ALA -0.70 1.00 1
60 ASN -1.50 1.60 1
61 TYR 6.60 -3.10 1
62 TRP 1.90 -2.40 1
63 GLN 1.30 -1.10 1
64 PHE -0.50 1.20 1
70 TYR -0.30 1.90 1
71 ASN 0.10 -0.90 1
74 SER 1.10 -0.30 1
75 GLU -0.20 -0.30 1
76 ALA 0.80 -0.30 1
77 ASN 1.40 -1.10 1
78 VAL -0.70 0.50 1
79 THR -2.70 1.50 1
80 LYS 4.70 -1.40 1
81 GLU 4.50 -1.40 1
82 ALA 2.70 -0.50 1
83 PHE 3.40 0.10 1
84 VAL 6.70 -1.20 1
85 THR 6.10 -1.00 1
88 ILE 5.30 -0.80 1
89 ASN 4.10 -1.30 1
90 ALA 3.30 -0.90 1
91 THR 6.10 -1.90 1
92 GLN 4.30 -0.90 1
93 ALA 2.80 -0.90 1
94 ALA 0.60 -0.10 1
95 ASN -3.80 1.80 1
96 GLN 5.10 -0.70 1
98 GLU 1.80 -0.60 1
99 PHE 1.90 0.30 1
100 GLN 0.30 -0.50 1
101 LYS 0.80 -0.30 1
103 ASP 0.00 -0.20 1
104 ASN -0.70 0.10 1
105 LYS 4.10 -0.80 1
106 LEU 3.80 -1.50 1
107 HIS 5.20 -0.10 1
108 GLN 3.90 -0.50 1
109 GLN 4.30 -0.70 1
110 VAL 5.70 -1.90 1
111 LEU 3.30 -0.20 1
112 TRP 3.60 -0.30 1
113 ARG 4.00 -2.00 1
114 LEU 3.60 0.00 1
115 VAL 6.50 -1.40 1
116 GLN 5.30 -1.10 1
117 GLU 3.50 -1.40 1
118 LEU 3.30 -0.40 1
120 SER 3.00 -0.50 1
121 LEU -0.20 0.40 1
123 HIS -2.20 1.60 1
125 GLU 2.20 -1.00 1
126 PHE 0.30 -1.20 1
127 TRP -0.90 -0.50 1
128 LEU 0.00 0.00 1
129 GLU -0.60 -0.30 1
130 ARG -0.00 -0.10 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr5145_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -4.40
_LACS_plot.Line_1_terminator_val_y_1 0.20
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.34
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.00
_LACS_plot.Line_2_terminator_val_x_2 6.69
_LACS_plot.Line_2_terminator_val_y_2 -0.75
_LACS_plot.Y_axis_chem_shift_offset 0.17
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
47 ILE -4.40 -0.65 0
10 HIS -0.20 -0.18 1
12 ILE -0.10 -0.22 1
14 TRP -0.70 -0.15 1
15 ASN -0.30 -0.27 1
16 ARG 0.60 -0.39 1
17 LYS 0.10 -0.22 1
18 ALA -0.70 -0.16 1
19 LEU -0.20 -0.23 1
21 SER 0.00 -0.14 1
22 THR 0.60 -0.20 1
23 ALA 0.60 -0.17 1
24 GLN 0.30 -0.19 1
25 ILE 0.70 -0.12 1
26 THR 0.70 -0.17 1
27 GLU 1.00 -0.24 1
28 ALA 1.00 -0.20 1
29 GLN 0.90 -0.22 1
30 VAL 1.30 -0.25 1
31 ALA 1.20 -0.27 1
32 GLU 1.00 -0.36 1
33 ASN -0.70 -0.52 1
34 ARG 0.40 -0.20 1
37 ALA -0.50 -0.34 1
38 PHE -2.50 0.38 1
39 ILE -1.20 -0.17 1
40 LYS -1.20 0.44 1
41 GLN -0.20 0.06 1
43 ARG -0.40 -0.15 1
44 LYS 0.90 -0.38 1
45 LEU -0.40 -0.08 1
46 ASP 0.40 -0.04 1
48 ASP -1.50 0.00 1
49 PHE 0.60 -0.37 1
51 ALA 5.00 -0.34 1
52 GLU 3.70 -0.36 1
54 ASN 4.50 -0.03 1
55 ARG 4.20 -0.31 1
56 TYR 3.60 -0.53 1
57 TYR 4.80 -1.03 1
58 GLU 4.30 -0.65 1
59 ALA -0.70 0.02 1
60 ASN -1.50 -0.61 1
61 TYR 6.60 -0.91 1
62 TRP 1.90 -0.56 1
63 GLN 1.30 -0.43 1
64 PHE -0.50 -0.50 1
70 TYR -0.30 -0.29 1
71 ASN 0.10 -0.02 1
74 SER 1.10 -0.24 1
75 GLU -0.20 -0.20 1
76 ALA 0.80 -0.59 1
77 ASN 1.40 -0.34 1
78 VAL -0.70 0.15 1
79 THR -2.70 0.03 1
80 LYS 4.70 -0.76 1
81 GLU 4.50 -0.46 1
82 ALA 2.70 -0.28 1
83 PHE 3.40 -0.41 1
84 VAL 6.70 -0.89 1
85 THR 6.10 -0.68 1
88 ILE 5.30 -1.03 1
89 ASN 4.10 -0.47 1
90 ALA 3.30 -0.30 1
91 THR 6.10 -0.27 1
92 GLN 4.30 -0.85 1
93 ALA 2.80 -0.34 1
94 ALA 0.60 -0.19 1
95 ASN -3.80 0.31 1
96 GLN 5.10 -0.25 1
98 GLU 1.80 -0.35 1
99 PHE 1.90 -0.32 1
100 GLN 0.30 -0.01 1
101 LYS 0.80 -0.23 1
103 ASP 0.00 -0.27 1
104 ASN -0.70 -0.13 1
105 LYS 4.10 -0.45 1
106 LEU 3.80 -0.44 1
107 HIS 5.20 -1.02 1
108 GLN 3.90 -0.41 1
109 GLN 4.30 -0.30 1
110 VAL 5.70 -0.87 1
111 LEU 3.30 -0.51 1
112 TRP 3.60 -0.29 1
113 ARG 4.00 -0.26 1
114 LEU 3.60 -0.58 1
115 VAL 6.50 -0.72 1
116 GLN 5.30 -0.90 1
117 GLU 3.50 -0.41 1
118 LEU 3.30 -0.43 1
120 SER 3.00 -0.22 1
121 LEU -0.20 -0.16 1
123 HIS -2.20 -0.23 1
125 GLU 2.20 -0.52 1
126 PHE 0.30 -0.17 1
127 TRP -0.90 0.06 1
128 LEU 0.00 -0.11 1
129 GLU -0.60 -0.20 1
130 ARG -0.00 -0.10 1
stop_
save_