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 bmr6447_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -8.10
_LACS_plot.Line_1_terminator_val_y_1 -2.49
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 1.49
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -0.50
_LACS_plot.Line_2_terminator_val_x_2 5.79
_LACS_plot.Line_2_terminator_val_y_2 4.63
_LACS_plot.Y_axis_chem_shift_offset -0.76
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
100 VAL -1.30 3.70 0
10 ASN 3.70 2.30 1
11 THR -5.60 -1.10 1
12 ALA -8.10 -1.40 1
13 LEU -1.50 -0.90 1
14 HIS -3.70 -1.70 1
15 LEU -0.90 -1.20 1
16 LYS -6.30 -1.20 1
17 ALA -0.50 0.60 1
18 LEU -5.60 -1.30 1
19 LEU -7.10 -1.30 1
20 ASP 0.10 0.70 1
21 PHE -1.00 0.30 1
22 GLU -3.80 -1.20 1
23 ASP -1.90 -0.50 1
24 LYS 3.10 2.90 1
25 ASP 0.30 1.10 1
27 ASP -0.10 0.60 1
28 LYS 0.80 1.00 1
30 VAL -2.80 -1.40 1
31 ALA 2.40 2.30 1
33 ASP 2.00 2.70 1
34 GLU -7.10 -0.70 1
35 TRP -1.30 0.60 1
36 LEU -4.60 -1.60 1
37 PHE -2.20 0.00 1
38 GLU 1.20 3.30 1
42 THR -0.70 0.60 1
43 TYR -0.90 2.10 1
46 ARG -3.90 -0.50 1
47 LYS 3.40 3.30 1
48 GLU 2.30 3.10 1
49 VAL -3.70 0.20 1
50 GLU -6.10 -1.90 1
51 VAL 1.70 0.20 1
52 VAL 2.70 3.50 1
53 GLU -5.30 -1.30 1
54 ILE -0.20 0.80 1
55 ILE -2.30 -0.50 1
56 GLN -3.60 -1.10 1
57 ALA -0.10 0.90 1
58 THR 0.80 2.60 1
59 ILE 2.00 0.50 1
60 ILE 1.40 1.80 1
61 ARG 0.50 1.70 1
62 GLN 2.90 2.80 1
63 ASN 3.70 2.80 1
64 GLN -4.30 -0.10 1
65 ALA -6.60 -1.30 1
66 LEU -0.70 1.30 1
67 ARG -1.20 0.50 1
68 LEU -5.70 -2.10 1
69 ARG -7.60 -2.10 1
70 ALA -0.10 0.20 1
71 ARG 0.90 2.60 1
72 LYS -4.20 -1.40 1
73 GLU 2.50 2.00 1
75 TRP -2.00 0.00 1
76 ASP -1.90 -0.50 1
77 ARG 3.30 2.70 1
78 ASP -0.60 0.80 1
80 LYS 0.20 -0.10 1
81 GLU 0.50 1.00 1
82 ARG -6.00 -3.10 1
83 VAL -3.60 -1.90 1
84 THR 5.80 5.30 1
86 GLU 0.30 1.90 1
87 GLU -5.60 -1.50 1
88 TRP -4.70 -2.00 1
89 LEU -4.60 -1.40 1
90 VAL -1.10 0.60 1
91 THR -0.90 -0.60 1
92 THR 0.80 1.30 1
93 VAL 1.90 1.90 1
95 ALA 0.50 0.60 1
96 TYR 1.00 3.60 1
99 ALA -2.90 -1.00 1
101 PHE 0.40 -0.60 1
102 GLU -2.10 -0.20 1
103 GLU -4.20 -1.30 1
104 VAL 2.10 2.10 1
105 LEU 1.20 0.70 1
106 ASP -2.60 -0.10 1
107 LEU -2.20 0.00 1
108 VAL -4.10 -1.50 1
109 ASP -0.10 1.20 1
110 ALA -0.30 0.50 1
111 VAL 0.40 0.90 1
112 ILE -0.00 0.40 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr6447_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -8.10
_LACS_plot.Line_1_terminator_val_y_1 5.61
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.51
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 1.50
_LACS_plot.Line_2_terminator_val_x_2 5.79
_LACS_plot.Line_2_terminator_val_y_2 -1.16
_LACS_plot.Y_axis_chem_shift_offset -0.76
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
100 VAL -1.30 5.00 0
10 ASN 3.70 -1.40 1
11 THR -5.60 4.50 1
12 ALA -8.10 6.70 1
13 LEU -1.50 0.60 1
14 HIS -3.70 2.00 1
15 LEU -0.90 -0.30 1
16 LYS -6.30 5.10 1
17 ALA -0.50 1.10 1
18 LEU -5.60 4.30 1
19 LEU -7.10 5.80 1
20 ASP 0.10 0.60 1
21 PHE -1.00 1.30 1
22 GLU -3.80 2.60 1
23 ASP -1.90 1.40 1
24 LYS 3.10 -0.20 1
25 ASP 0.30 0.80 1
27 ASP -0.10 0.70 1
28 LYS 0.80 0.20 1
30 VAL -2.80 1.40 1
31 ALA 2.40 -0.10 1
33 ASP 2.00 0.70 1
34 GLU -7.10 6.40 1
35 TRP -1.30 1.90 1
36 LEU -4.60 3.00 1
37 PHE -2.20 2.20 1
38 GLU 1.20 2.10 1
42 THR -0.70 1.30 1
43 TYR -0.90 3.00 1
46 ARG -3.90 3.40 1
47 LYS 3.40 -0.10 1
48 GLU 2.30 0.80 1
49 VAL -3.70 3.90 1
50 GLU -6.10 4.20 1
51 VAL 1.70 -1.50 1
52 VAL 2.70 0.80 1
53 GLU -5.30 4.00 1
54 ILE -0.20 1.00 1
55 ILE -2.30 1.80 1
56 GLN -3.60 2.50 1
57 ALA -0.10 1.00 1
58 THR 0.80 1.80 1
59 ILE 2.00 -1.50 1
60 ILE 1.40 0.40 1
61 ARG 0.50 1.20 1
62 GLN 2.90 -0.10 1
63 ASN 3.70 -0.90 1
64 GLN -4.30 4.20 1
65 ALA -6.60 5.30 1
66 LEU -0.70 2.00 1
67 ARG -1.20 1.70 1
68 LEU -5.70 3.60 1
69 ARG -7.60 5.50 1
70 ALA -0.10 0.30 1
71 ARG 0.90 1.70 1
72 LYS -4.20 2.80 1
73 GLU 2.50 -0.50 1
75 TRP -2.00 2.00 1
76 ASP -1.90 1.40 1
77 ARG 3.30 -0.60 1
78 ASP -0.60 1.40 1
80 LYS 0.20 -0.30 1
81 GLU 0.50 0.50 1
82 ARG -6.00 2.90 1
83 VAL -3.60 1.70 1
84 THR 5.80 -0.50 1
86 GLU 0.30 1.60 1
87 GLU -5.60 4.10 1
88 TRP -4.70 2.70 1
89 LEU -4.60 3.20 1
90 VAL -1.10 1.70 1
91 THR -0.90 0.30 1
92 THR 0.80 0.50 1
93 VAL 1.90 0.00 1
95 ALA 0.50 0.10 1
96 TYR 1.00 2.60 1
99 ALA -2.90 1.90 1
101 PHE 0.40 -1.00 1
102 GLU -2.10 1.90 1
103 GLU -4.20 2.90 1
104 VAL 2.10 0.00 1
105 LEU 1.20 -0.50 1
106 ASP -2.60 2.50 1
107 LEU -2.20 2.20 1
108 VAL -4.10 2.60 1
109 ASP -0.10 1.30 1
110 ALA -0.30 0.80 1
111 VAL 0.40 0.50 1
112 ILE -0.00 0.40 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr6447_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -8.10
_LACS_plot.Line_1_terminator_val_y_1 0.83
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.28
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.16
_LACS_plot.Line_2_terminator_val_x_2 5.79
_LACS_plot.Line_2_terminator_val_y_2 -0.68
_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
87 GLU -5.60 1.55 0
10 ASN 3.70 -0.67 1
11 THR -5.60 0.87 1
12 ALA -8.10 0.72 1
13 LEU -1.50 0.48 1
14 HIS -3.70 0.10 1
15 LEU -0.90 0.48 1
16 LYS -6.30 0.83 1
17 ALA -0.50 0.68 1
18 LEU -5.60 -0.04 1
19 LEU -7.10 0.23 1
20 ASP 0.10 0.28 1
21 PHE -1.00 0.10 1
22 GLU -3.80 0.38 1
23 ASP -1.90 0.05 1
24 LYS 3.10 -0.26 1
25 ASP 0.30 0.01 1
27 ASP -0.10 -0.16 1
28 LYS 0.80 -0.18 1
30 VAL -2.80 0.15 1
31 ALA 2.40 -0.84 1
33 ASP 2.00 0.13 1
34 GLU -7.10 1.35 1
35 TRP -1.30 0.00 1
36 LEU -4.60 1.08 1
37 PHE -2.20 0.19 1
38 GLU 1.20 -0.49 1
42 THR -0.70 0.45 1
43 TYR -0.90 -0.93 1
46 ARG -3.90 0.27 1
47 LYS 3.40 -0.37 1
48 GLU 2.30 -0.45 1
49 VAL -3.70 0.47 1
50 GLU -6.10 0.64 1
51 VAL 1.70 -0.22 1
52 VAL 2.70 -0.68 1
53 GLU -5.30 0.15 1
54 ILE -0.20 0.35 1
55 ILE -2.30 0.07 1
56 GLN -3.60 0.28 1
57 ALA -0.10 -0.03 1
58 THR 0.80 -0.09 1
59 ILE 2.00 -0.19 1
60 ILE 1.40 -0.32 1
61 ARG 0.50 0.09 1
62 GLN 2.90 -0.49 1
63 ASN 3.70 -0.49 1
64 GLN -4.30 0.78 1
65 ALA -6.60 0.40 1
67 ARG -1.20 0.25 1
68 LEU -5.70 0.48 1
69 ARG -7.60 0.93 1
70 ALA -0.10 0.63 1
71 ARG 0.90 -0.15 1
72 LYS -4.20 0.17 1
73 GLU 2.50 -0.01 1
75 TRP -2.00 0.30 1
76 ASP -1.90 -0.05 1
77 ARG 3.30 -0.21 1
78 ASP -0.60 0.18 1
80 LYS 0.20 -0.03 1
81 GLU 0.50 -0.75 1
82 ARG -6.00 0.25 1
83 VAL -3.60 0.30 1
84 THR 5.80 -1.27 1
86 GLU 0.30 -0.22 1
88 TRP -4.70 0.19 1
89 LEU -4.60 0.93 1
90 VAL -1.10 0.13 1
91 THR -0.90 0.21 1
92 THR 0.80 -0.35 1
93 VAL 1.90 -0.55 1
95 ALA 0.50 0.03 1
96 TYR 1.00 -0.61 1
99 ALA -2.90 -0.21 1
100 VAL -1.30 -0.84 1
101 PHE 0.40 0.33 1
102 GLU -2.10 0.21 1
103 GLU -4.20 0.10 1
104 VAL 2.10 -0.37 1
105 LEU 1.20 0.09 1
106 ASP -2.60 -0.13 1
107 LEU -2.20 0.57 1
108 VAL -4.10 0.27 1
109 ASP -0.10 0.07 1
110 ALA -0.30 -0.18 1
111 VAL 0.40 -0.20 1
112 ILE -0.00 -0.08 1
stop_
save_