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 bmr10314_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -7.99
_LACS_plot.Line_1_terminator_val_y_1 -2.73
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 1.06
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -0.93
_LACS_plot.Line_2_terminator_val_x_2 9.93
_LACS_plot.Line_2_terminator_val_y_2 7.25
_LACS_plot.Y_axis_chem_shift_offset -0.37
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
27 ASN -7.99 -0.44 0
39 TYR -5.28 -5.59 0
10 LYS -2.42 0.71 1
11 SER -4.67 -1.12 1
13 TRP -3.06 -0.96 1
14 LEU -4.74 0.10 1
15 LEU -2.57 -0.73 1
16 ARG -5.80 -2.00 1
17 GLN 1.71 0.39 1
18 SER -1.46 -1.55 1
19 THR 3.85 2.97 1
20 ILE 2.52 1.88 1
21 LEU -0.06 -0.01 1
22 LYS 4.55 0.68 1
23 ARG -3.22 -1.43 1
24 TRP -0.72 -0.51 1
25 LYS -4.39 -1.55 1
26 LYS 1.33 1.32 1
28 TRP -1.27 -0.90 1
29 PHE -3.66 -0.99 1
30 ASP -5.04 -0.21 1
31 LEU -3.89 -1.69 1
32 TRP -3.65 -1.00 1
33 SER 3.96 3.13 1
34 ASP -0.05 -0.72 1
36 HIS 5.89 5.25 1
37 LEU -3.54 -1.26 1
38 ILE -3.25 -1.25 1
40 TYR -6.87 -1.59 1
41 ASP 2.66 3.54 1
42 ASP -1.86 -0.90 1
43 GLN 3.15 1.03 1
44 THR 1.78 1.58 1
45 ARG 5.94 1.53 1
46 GLN 0.94 1.89 1
47 SER -1.67 -1.80 1
48 ILE 1.08 1.64 1
49 GLU 0.38 0.99 1
50 ASP -4.44 -1.64 1
51 LYS -4.85 -1.46 1
52 VAL -4.81 -1.55 1
53 HIS -2.50 -0.70 1
54 MET 9.93 5.31 1
56 VAL -0.40 1.16 1
57 ASP 0.25 2.20 1
59 ILE -0.30 0.33 1
60 ASN -2.63 0.20 1
61 ILE -2.43 -0.48 1
62 ARG -5.34 -2.21 1
63 THR -3.75 -1.27 1
65 HIS 2.82 4.00 1
66 GLU -0.92 0.29 1
68 ARG -2.53 -0.52 1
69 ASP 2.62 1.14 1
70 ILE -5.61 -2.29 1
71 GLN -2.78 -1.67 1
74 ASP 2.27 1.79 1
76 LYS -2.15 -2.30 1
78 ARG 4.74 3.28 1
79 ASP 1.48 1.62 1
81 LEU -2.80 -0.09 1
82 LEU -3.63 0.15 1
83 GLN -6.27 -1.75 1
84 ILE -0.98 -0.12 1
85 VAL 1.14 0.44 1
87 ARG 2.61 2.40 1
88 ASP 1.54 0.10 1
90 LYS 0.38 0.61 1
91 THR -1.42 -0.13 1
92 ILE -1.04 -0.32 1
93 SER 1.19 1.12 1
94 LEU -5.67 -2.07 1
96 ALA -2.80 -1.47 1
97 GLU 0.63 1.43 1
98 SER -4.81 -1.76 1
99 THR 6.46 4.69 1
100 ASP 4.12 3.40 1
101 ASP 1.57 2.78 1
103 LEU 3.71 2.63 1
104 ALA 3.64 2.68 1
105 TRP 5.00 4.20 1
106 LYS 6.06 5.08 1
107 PHE 4.71 3.43 1
108 THR 5.81 4.55 1
109 LEU 3.33 2.47 1
110 GLN 5.16 3.68 1
111 ASP 3.76 3.11 1
112 SER 2.54 3.04 1
113 ARG 2.46 2.40 1
114 THR 0.12 -0.20 1
115 SER 0.32 0.70 1
118 SER -0.08 0.14 1
119 SER -0.25 0.17 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr10314_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -7.99
_LACS_plot.Line_1_terminator_val_y_1 5.26
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.94
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 1.07
_LACS_plot.Line_2_terminator_val_x_2 9.93
_LACS_plot.Line_2_terminator_val_y_2 -2.68
_LACS_plot.Y_axis_chem_shift_offset -0.37
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
27 ASN -7.99 7.55 0
39 TYR -5.28 -0.31 0
10 LYS -2.42 3.13 1
11 SER -4.67 3.55 1
13 TRP -3.06 2.10 1
14 LEU -4.74 4.84 1
15 LEU -2.57 1.84 1
16 ARG -5.80 3.80 1
17 GLN 1.71 -1.32 1
18 SER -1.46 -0.09 1
19 THR 3.85 -0.88 1
20 ILE 2.52 -0.64 1
21 LEU -0.06 0.05 1
22 LYS 4.55 -3.87 1
23 ARG -3.22 1.79 1
24 TRP -0.72 0.21 1
25 LYS -4.39 2.84 1
26 LYS 1.33 -0.01 1
28 TRP -1.27 0.37 1
29 PHE -3.66 2.67 1
30 ASP -5.04 4.83 1
31 LEU -3.89 2.20 1
32 TRP -3.65 2.65 1
33 SER 3.96 -0.83 1
34 ASP -0.05 -0.67 1
36 HIS 5.89 -0.64 1
37 LEU -3.54 2.28 1
38 ILE -3.25 2.00 1
40 TYR -6.87 5.28 1
41 ASP 2.66 0.88 1
42 ASP -1.86 0.96 1
43 GLN 3.15 -2.12 1
44 THR 1.78 -0.20 1
45 ARG 5.94 -4.41 1
46 GLN 0.94 0.95 1
47 SER -1.67 -0.13 1
48 ILE 1.08 0.56 1
49 GLU 0.38 0.61 1
50 ASP -4.44 2.80 1
51 LYS -4.85 3.39 1
52 VAL -4.81 3.26 1
53 HIS -2.50 1.80 1
54 MET 9.93 -4.62 1
56 VAL -0.40 1.56 1
57 ASP 0.25 1.95 1
59 ILE -0.30 0.63 1
60 ASN -2.63 2.83 1
61 ILE -2.43 1.95 1
62 ARG -5.34 3.13 1
63 THR -3.75 2.48 1
65 HIS 2.82 1.18 1
66 GLU -0.92 1.21 1
68 ARG -2.53 2.01 1
69 ASP 2.62 -1.48 1
70 ILE -5.61 3.32 1
71 GLN -2.78 1.11 1
74 ASP 2.27 -0.48 1
76 LYS -2.15 -0.15 1
78 ARG 4.74 -1.46 1
79 ASP 1.48 0.14 1
81 LEU -2.80 2.71 1
82 LEU -3.63 3.78 1
83 GLN -6.27 4.52 1
84 ILE -0.98 0.86 1
85 VAL 1.14 -0.70 1
87 ARG 2.61 -0.21 1
88 ASP 1.54 -1.44 1
90 LYS 0.38 0.23 1
91 THR -1.42 1.29 1
92 ILE -1.04 0.72 1
93 SER 1.19 -0.07 1
94 LEU -5.67 3.60 1
96 ALA -2.80 1.33 1
97 GLU 0.63 0.80 1
98 SER -4.81 3.05 1
99 THR 6.46 -1.77 1
100 ASP 4.12 -0.72 1
101 ASP 1.57 1.21 1
103 LEU 3.71 -1.08 1
104 ALA 3.64 -0.96 1
105 TRP 5.00 -0.80 1
106 LYS 6.06 -0.98 1
107 PHE 4.71 -1.28 1
108 THR 5.81 -1.26 1
109 LEU 3.33 -0.86 1
110 GLN 5.16 -1.48 1
111 ASP 3.76 -0.65 1
112 SER 2.54 0.50 1
113 ARG 2.46 -0.06 1
114 THR 0.12 -0.32 1
115 SER 0.32 0.38 1
118 SER -0.08 0.22 1
119 SER -0.25 0.42 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr10314_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -7.99
_LACS_plot.Line_1_terminator_val_y_1 1.00
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.17
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.28
_LACS_plot.Line_2_terminator_val_x_2 9.93
_LACS_plot.Line_2_terminator_val_y_2 -1.00
_LACS_plot.Y_axis_chem_shift_offset -0.07
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
50 ASP -4.44 -0.51 0
54 MET 9.93 -0.45 0
43 GLN 3.15 -1.58 0
10 LYS -2.42 -0.08 1
11 SER -4.67 1.47 1
13 TRP -3.06 0.89 1
14 LEU -4.74 0.19 1
15 LEU -2.57 0.78 1
16 ARG -5.80 1.13 1
17 GLN 1.71 -0.88 1
18 SER -1.46 0.22 1
19 THR 3.85 -0.30 1
20 ILE 2.52 -0.15 1
21 LEU -0.06 -0.13 1
22 LYS 4.55 -0.51 1
23 ARG -3.22 0.31 1
24 TRP -0.72 0.15 1
25 LYS -4.39 0.50 1
26 LYS 1.33 0.44 1
27 ASN -7.99 0.89 1
28 TRP -1.27 -0.17 1
29 PHE -3.66 0.38 1
30 ASP -5.04 0.78 1
31 LEU -3.89 1.28 1
32 TRP -3.65 0.78 1
33 SER 3.96 -0.28 1
34 ASP -0.05 0.19 1
36 HIS 5.89 0.27 1
37 LEU -3.54 1.07 1
38 ILE -3.25 0.42 1
39 TYR -5.28 1.28 1
40 TYR -6.87 0.71 1
41 ASP 2.66 0.02 1
42 ASP -1.86 0.34 1
44 THR 1.78 -0.40 1
45 ARG 5.94 -1.57 1
46 GLN 0.94 -0.13 1
47 SER -1.67 0.37 1
48 ILE 1.08 -0.59 1
49 GLU 0.38 -0.01 1
51 LYS -4.85 0.75 1
52 VAL -4.81 0.30 1
53 HIS -2.50 -0.02 1
56 VAL -0.40 -0.01 1
57 ASP 0.25 0.05 1
59 ILE -0.30 0.32 1
60 ASN -2.63 0.03 1
61 ILE -2.43 0.74 1
62 ARG -5.34 0.53 1
63 THR -3.75 0.55 1
65 HIS 2.82 -0.58 1
66 GLU -0.92 -0.26 1
68 ARG -2.53 0.10 1
69 ASP 2.62 -0.37 1
70 ILE -5.61 0.49 1
71 GLN -2.78 0.20 1
74 ASP 2.27 -0.41 1
76 LYS -2.15 0.12 1
78 ARG 4.74 -0.77 1
79 ASP 1.48 -0.33 1
81 LEU -2.80 0.52 1
82 LEU -3.63 0.52 1
83 GLN -6.27 1.15 1
84 ILE -0.98 0.03 1
85 VAL 1.14 0.20 1
87 ARG 2.61 -0.28 1
88 ASP 1.54 -0.21 1
90 LYS 0.38 0.01 1
91 THR -1.42 0.73 1
92 ILE -1.04 0.05 1
93 SER 1.19 0.51 1
94 LEU -5.67 1.50 1
96 ALA -2.80 0.32 1
97 GLU 0.63 -0.28 1
98 SER -4.81 0.18 1
99 THR 6.46 -0.60 1
100 ASP 4.12 -0.25 1
101 ASP 1.57 -0.03 1
103 LEU 3.71 -0.43 1
104 ALA 3.64 -0.09 1
105 TRP 5.00 -0.63 1
106 LYS 6.06 -0.73 1
107 PHE 4.71 -0.27 1
108 THR 5.81 -0.31 1
109 LEU 3.33 -0.12 1
110 GLN 5.16 -0.37 1
111 ASP 3.76 -0.20 1
112 SER 2.54 -0.12 1
113 ARG 2.46 -0.67 1
114 THR 0.12 0.12 1
115 SER 0.32 0.02 1
118 SER -0.08 0.11 1
119 SER -0.25 0.07 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr10314_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -7.99
_LACS_plot.Line_1_terminator_val_y_1 -2.71
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 0.36
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -0.92
_LACS_plot.Line_2_terminator_val_x_2 9.93
_LACS_plot.Line_2_terminator_val_y_2 2.64
_LACS_plot.Y_axis_chem_shift_offset 0.29
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
104 ALA 3.64 4.57 0
54 MET 9.93 0.50 0
32 TRP -3.65 3.31 0
10 LYS -2.42 -3.64 1
11 SER -4.67 -0.96 1
13 TRP -3.06 2.45 1
14 LEU -4.74 -1.41 1
15 LEU -2.57 -1.63 1
16 ARG -5.80 -1.19 1
17 GLN 1.71 -0.94 1
18 SER -1.46 1.22 1
19 THR 3.85 1.09 1
20 ILE 2.52 0.70 1
21 LEU -0.06 -1.06 1
22 LYS 4.55 -1.21 1
23 ARG -3.22 -1.03 1
24 TRP -0.72 -0.12 1
25 LYS -4.39 -1.64 1
26 LYS 1.33 -0.67 1
27 ASN -7.99 -3.23 1
28 TRP -1.27 -1.58 1
29 PHE -3.66 -1.33 1
30 ASP -5.04 -2.35 1
31 LEU -3.89 -1.55 1
34 ASP -0.05 0.89 1
36 HIS 5.89 -1.52 1
37 LEU -3.54 -3.57 1
38 ILE -3.25 -3.32 1
39 TYR -5.28 -0.54 1
40 TYR -6.87 1.01 1
41 ASP 2.66 -0.91 1
42 ASP -1.86 -1.02 1
43 GLN 3.15 -0.22 1
44 THR 1.78 1.22 1
45 ARG 5.94 -1.60 1
46 GLN 0.94 1.02 1
47 SER -1.67 -1.10 1
48 ILE 1.08 -0.02 1
49 GLU 0.38 -1.11 1
50 ASP -4.44 -4.88 1
51 LYS -4.85 -1.86 1
52 VAL -4.81 -2.08 1
53 HIS -2.50 0.85 1
56 VAL -0.40 0.31 1
57 ASP 0.25 0.43 1
59 ILE -0.30 -0.83 1
60 ASN -2.63 -2.50 1
61 ILE -2.43 -1.41 1
62 ARG -5.34 -1.26 1
63 THR -3.75 1.20 1
65 HIS 2.82 1.53 1
66 GLU -0.92 1.49 1
68 ARG -2.53 -0.31 1
69 ASP 2.62 -1.70 1
70 ILE -5.61 -3.28 1
71 GLN -2.78 -1.02 1
74 ASP 2.27 0.78 1
76 LYS -2.15 -1.18 1
78 ARG 4.74 0.98 1
79 ASP 1.48 -0.62 1
81 LEU -2.80 -1.71 1
82 LEU -3.63 -2.66 1
83 GLN -6.27 -1.28 1
84 ILE -0.98 -1.99 1
85 VAL 1.14 0.24 1
90 LYS 0.38 -1.57 1
91 THR -1.42 -0.77 1
92 ILE -1.04 -1.18 1
93 SER 1.19 -2.73 1
94 LEU -5.67 -1.67 1
96 ALA -2.80 -1.90 1
97 GLU 0.63 -0.14 1
98 SER -4.81 0.40 1
99 THR 6.46 1.74 1
100 ASP 4.12 2.64 1
101 ASP 1.57 1.01 1
103 LEU 3.71 0.57 1
105 TRP 5.00 1.54 1
106 LYS 6.06 1.52 1
107 PHE 4.71 3.05 1
108 THR 5.81 3.09 1
109 LEU 3.33 2.80 1
110 GLN 5.16 3.66 1
111 ASP 3.76 2.57 1
112 SER 2.54 1.03 1
113 ARG 2.46 0.13 1
114 THR 0.12 -0.14 1
115 SER 0.32 -0.31 1
118 SER -0.08 0.20 1
119 SER -0.25 -0.58 1
stop_
save_