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 bmr11105_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -8.04
_LACS_plot.Line_1_terminator_val_y_1 -2.69
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 0.50
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.26
_LACS_plot.Line_2_terminator_val_x_2 9.45
_LACS_plot.Line_2_terminator_val_y_2 6.88
_LACS_plot.Y_axis_chem_shift_offset -0.01
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
45 ALA 9.45 6.78 0
78 LYS 5.21 0.80 0
102 ARG -7.29 -1.45 0
10 LYS -1.58 -1.15 1
11 TYR -0.20 -0.60 1
12 PHE -3.85 -1.50 1
13 ASN -2.56 -1.62 1
14 ASP 2.70 2.38 1
15 LYS 0.31 0.51 1
16 THR 1.44 1.93 1
17 ILE 4.69 2.98 1
18 ASP 3.73 2.77 1
19 GLU 1.93 2.13 1
20 GLU 2.62 2.03 1
21 LEU 3.20 2.21 1
22 GLU -0.45 0.01 1
23 ARG 4.01 3.68 1
24 ASP -1.58 -0.71 1
25 LYS 2.61 1.77 1
26 ARG 1.49 0.84 1
27 VAL -0.75 0.11 1
28 THR 1.63 1.35 1
29 TRP -5.38 -1.19 1
30 ILE -3.49 -1.35 1
31 VAL -4.36 -1.49 1
32 GLU -2.94 -2.07 1
33 PHE -0.99 -1.15 1
34 PHE -8.04 -3.02 1
35 ALA -3.72 -1.41 1
36 ASN 2.98 2.75 1
37 TRP -1.50 -2.33 1
38 SER -0.40 -2.25 1
39 ASN 4.63 3.82 1
40 ASP 3.94 3.23 1
42 GLN 5.43 3.63 1
43 SER 3.75 3.04 1
44 PHE 0.22 0.75 1
47 ILE 4.05 2.59 1
48 TYR 4.48 3.30 1
49 ALA 4.24 2.64 1
50 ASP 4.24 3.52 1
51 LEU 2.74 2.86 1
52 SER 4.10 2.29 1
53 LEU 2.55 2.31 1
54 LYS 1.38 2.31 1
55 TYR 1.09 1.77 1
56 ASN 1.77 2.90 1
58 THR 4.26 3.50 1
60 LEU -2.26 -0.65 1
61 ASN -2.85 -2.43 1
62 PHE -2.53 -0.80 1
64 LYS -4.29 0.08 1
65 VAL -4.76 -2.18 1
66 ASP -1.87 -2.66 1
67 VAL 2.11 0.24 1
69 ARG -0.44 0.59 1
70 TYR 0.97 -1.59 1
71 THR 4.81 3.70 1
72 ASP 3.59 3.13 1
73 VAL 5.57 4.04 1
74 SER 4.79 3.77 1
75 THR 4.96 3.76 1
76 ARG 4.17 3.97 1
77 TYR 2.52 1.03 1
79 VAL -1.47 -0.26 1
80 SER -0.36 -0.38 1
81 THR 0.22 -1.04 1
82 SER -0.14 -0.06 1
84 LEU 1.75 0.73 1
85 THR 0.17 0.28 1
86 LYS 2.79 0.33 1
87 GLN -1.61 0.09 1
88 LEU -5.18 -2.90 1
90 THR -3.47 0.82 1
91 LEU -7.13 -2.05 1
92 ILE -1.40 0.27 1
93 LEU -5.63 -1.86 1
94 PHE -2.74 -0.29 1
95 GLN -3.57 -0.66 1
98 LYS -4.73 -1.87 1
99 GLU 2.34 1.12 1
100 ALA -1.86 0.18 1
101 MET -1.43 0.33 1
103 ARG -6.09 -2.09 1
105 GLN -0.77 0.36 1
106 ILE -2.32 -2.10 1
107 ASP -1.61 -1.42 1
108 LYS 3.25 2.27 1
109 LYS -0.04 -0.84 1
111 ARG -0.97 -0.91 1
112 ALA -0.70 -0.37 1
113 VAL 0.54 -0.28 1
114 SER 2.72 2.47 1
115 TRP -0.72 1.46 1
116 THR 1.09 0.51 1
117 PHE 2.79 0.31 1
118 SER -5.40 -3.03 1
119 GLU 4.36 4.59 1
120 GLU 3.50 2.97 1
121 ASN 4.46 2.38 1
122 VAL 6.10 4.97 1
123 ILE 5.37 5.71 1
124 ARG 3.16 3.63 1
125 GLU 5.47 3.96 1
126 PHE 3.44 0.57 1
127 ASN 2.53 0.80 1
128 LEU 5.65 3.28 1
129 ASN 4.26 3.05 1
130 GLU 1.77 1.67 1
131 LEU 0.15 1.23 1
132 SER -0.72 -0.02 1
135 SER -0.07 0.17 1
136 SER -0.10 0.19 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11105_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -8.04
_LACS_plot.Line_1_terminator_val_y_1 5.35
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -1.50
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.74
_LACS_plot.Line_2_terminator_val_x_2 9.45
_LACS_plot.Line_2_terminator_val_y_2 -2.57
_LACS_plot.Y_axis_chem_shift_offset -0.01
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
45 ALA 9.45 -2.67 0
78 LYS 5.21 -4.41 0
102 ARG -7.29 5.84 0
10 LYS -1.58 0.43 1
11 TYR -0.20 -0.40 1
12 PHE -3.85 2.35 1
13 ASN -2.56 0.94 1
14 ASP 2.70 -0.32 1
15 LYS 0.31 0.20 1
16 THR 1.44 0.49 1
17 ILE 4.69 -1.71 1
18 ASP 3.73 -0.96 1
19 GLU 1.93 0.20 1
20 GLU 2.62 -0.59 1
21 LEU 3.20 -0.99 1
22 GLU -0.45 0.46 1
23 ARG 4.01 -0.33 1
24 ASP -1.58 0.87 1
25 LYS 2.61 -0.84 1
26 ARG 1.49 -0.65 1
27 VAL -0.75 0.86 1
28 THR 1.63 -0.28 1
29 TRP -5.38 4.19 1
30 ILE -3.49 2.14 1
31 VAL -4.36 2.87 1
32 GLU -2.94 0.87 1
33 PHE -0.99 -0.16 1
34 PHE -8.04 5.02 1
35 ALA -3.72 2.31 1
36 ASN 2.98 -0.23 1
37 TRP -1.50 -0.83 1
38 SER -0.40 -1.85 1
39 ASN 4.63 -0.81 1
40 ASP 3.94 -0.71 1
42 GLN 5.43 -1.80 1
43 SER 3.75 -0.71 1
44 PHE 0.22 0.53 1
47 ILE 4.05 -1.46 1
48 TYR 4.48 -1.18 1
49 ALA 4.24 -1.60 1
50 ASP 4.24 -0.72 1
51 LEU 2.74 0.12 1
52 SER 4.10 -1.81 1
53 LEU 2.55 -0.24 1
54 LYS 1.38 0.93 1
55 TYR 1.09 0.68 1
56 ASN 1.77 1.13 1
58 THR 4.26 -0.76 1
60 LEU -2.26 1.61 1
61 ASN -2.85 0.42 1
62 PHE -2.53 1.73 1
64 LYS -4.29 4.37 1
65 VAL -4.76 2.58 1
66 ASP -1.87 -0.79 1
67 VAL 2.11 -1.87 1
69 ARG -0.44 1.03 1
70 TYR 0.97 -2.56 1
71 THR 4.81 -1.11 1
72 ASP 3.59 -0.46 1
73 VAL 5.57 -1.53 1
74 SER 4.79 -1.02 1
75 THR 4.96 -1.20 1
76 ARG 4.17 -0.20 1
77 TYR 2.52 -1.49 1
79 VAL -1.47 1.21 1
80 SER -0.36 -0.02 1
81 THR 0.22 -1.26 1
82 SER -0.14 0.08 1
84 LEU 1.75 -1.02 1
85 THR 0.17 0.11 1
86 LYS 2.79 -2.46 1
87 GLN -1.61 1.70 1
88 LEU -5.18 2.28 1
90 THR -3.47 4.29 1
91 LEU -7.13 5.08 1
92 ILE -1.40 1.67 1
93 LEU -5.63 3.77 1
94 PHE -2.74 2.45 1
95 GLN -3.57 2.91 1
98 LYS -4.73 2.86 1
99 GLU 2.34 -1.22 1
100 ALA -1.86 2.04 1
101 MET -1.43 1.76 1
103 ARG -6.09 4.00 1
105 GLN -0.77 1.13 1
106 ILE -2.32 0.22 1
107 ASP -1.61 0.19 1
108 LYS 3.25 -0.98 1
109 LYS -0.04 -0.80 1
111 ARG -0.97 0.06 1
112 ALA -0.70 0.33 1
113 VAL 0.54 -0.82 1
114 SER 2.72 -0.25 1
115 TRP -0.72 2.18 1
116 THR 1.09 -0.58 1
117 PHE 2.79 -2.48 1
118 SER -5.40 2.37 1
119 GLU 4.36 0.23 1
120 GLU 3.50 -0.53 1
121 ASN 4.46 -2.08 1
122 VAL 6.10 -1.13 1
123 ILE 5.37 0.34 1
124 ARG 3.16 0.47 1
125 GLU 5.47 -1.51 1
126 PHE 3.44 -2.87 1
127 ASN 2.53 -1.73 1
128 LEU 5.65 -2.37 1
129 ASN 4.26 -1.21 1
130 GLU 1.77 -0.10 1
131 LEU 0.15 1.08 1
132 SER -0.72 0.70 1
135 SER -0.07 0.24 1
136 SER -0.10 0.29 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11105_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -8.04
_LACS_plot.Line_1_terminator_val_y_1 0.97
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.14
_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 9.45
_LACS_plot.Line_2_terminator_val_y_2 -0.90
_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
52 SER 4.10 -2.48 0
10 LYS -1.58 0.11 1
11 TYR -0.20 0.30 1
12 PHE -3.85 0.10 1
13 ASN -2.56 -0.71 1
14 ASP 2.70 -0.80 1
15 LYS 0.31 0.08 1
16 THR 1.44 -0.21 1
17 ILE 4.69 -1.69 1
18 ASP 3.73 -0.75 1
19 GLU 1.93 -0.55 1
20 GLU 2.62 -0.39 1
21 LEU 3.20 -0.74 1
22 GLU -0.45 -0.27 1
23 ARG 4.01 -0.41 1
24 ASP -1.58 0.14 1
25 LYS 2.61 -0.01 1
26 ARG 1.49 0.01 1
27 VAL -0.75 -0.11 1
28 THR 1.63 0.53 1
29 TRP -5.38 0.69 1
30 ILE -3.49 1.12 1
31 VAL -4.36 0.58 1
32 GLU -2.94 0.74 1
33 PHE -0.99 0.53 1
34 PHE -8.04 0.71 1
35 ALA -3.72 -0.15 1
36 ASN 2.98 -0.26 1
37 TRP -1.50 -0.05 1
38 SER -0.40 0.32 1
39 ASN 4.63 -0.30 1
40 ASP 3.94 -0.14 1
42 GLN 5.43 -0.23 1
43 SER 3.75 -0.16 1
44 PHE 0.22 0.17 1
45 ALA 9.45 -0.76 1
47 ILE 4.05 -0.37 1
48 TYR 4.48 -0.71 1
49 ALA 4.24 -0.59 1
50 ASP 4.24 -0.34 1
51 LEU 2.74 -0.32 1
53 LEU 2.55 -0.57 1
54 LYS 1.38 -0.46 1
55 TYR 1.09 0.03 1
56 ASN 1.77 0.13 1
58 THR 4.26 -0.32 1
60 LEU -2.26 0.63 1
61 ASN -2.85 0.32 1
62 PHE -2.53 0.71 1
64 LYS -4.29 1.07 1
65 VAL -4.76 0.73 1
66 ASP -1.87 -1.07 1
67 VAL 2.11 0.08 1
69 ARG -0.44 -0.17 1
70 TYR 0.97 0.51 1
71 THR 4.81 -0.18 1
72 ASP 3.59 0.02 1
73 VAL 5.57 -0.32 1
74 SER 4.79 -0.33 1
75 THR 4.96 -0.30 1
76 ARG 4.17 -0.38 1
77 TYR 2.52 -0.27 1
78 LYS 5.21 -0.46 1
79 VAL -1.47 -0.19 1
80 SER -0.36 -0.09 1
81 THR 0.22 0.10 1
84 LEU 1.75 -0.02 1
85 THR 0.17 -0.02 1
86 LYS 2.79 0.18 1
87 GLN -1.61 -0.17 1
88 LEU -5.18 0.15 1
90 THR -3.47 1.17 1
91 LEU -7.13 1.22 1
92 ILE -1.40 0.49 1
93 LEU -5.63 1.05 1
94 PHE -2.74 0.64 1
95 GLN -3.57 0.68 1
98 LYS -4.73 0.60 1
99 GLU 2.34 -0.74 1
100 ALA -1.86 0.29 1
101 MET -1.43 0.22 1
102 ARG -7.29 1.27 1
103 ARG -6.09 -0.50 1
105 GLN -0.77 -0.20 1
106 ILE -2.32 0.46 1
107 ASP -1.61 -0.05 1
108 LYS 3.25 -0.21 1
109 LYS -0.04 0.10 1
111 ARG -0.97 0.07 1
112 ALA -0.70 0.39 1
113 VAL 0.54 -0.06 1
114 SER 2.72 -0.20 1
115 TRP -0.72 0.03 1
116 THR 1.09 -0.15 1
117 PHE 2.79 -0.78 1
118 SER -5.40 0.32 1
119 GLU 4.36 -0.60 1
120 GLU 3.50 -0.34 1
121 ASN 4.46 -0.18 1
122 VAL 6.10 0.07 1
123 ILE 5.37 -0.88 1
124 ARG 3.16 -0.14 1
125 GLU 5.47 -0.22 1
126 PHE 3.44 -0.16 1
127 ASN 2.53 -0.23 1
128 LEU 5.65 -0.65 1
129 ASN 4.26 -0.12 1
130 GLU 1.77 -0.09 1
131 LEU 0.15 -0.07 1
132 SER -0.72 0.18 1
135 SER -0.07 0.05 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11105_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -8.04
_LACS_plot.Line_1_terminator_val_y_1 -2.82
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 0.67
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -0.72
_LACS_plot.Line_2_terminator_val_x_2 9.45
_LACS_plot.Line_2_terminator_val_y_2 3.07
_LACS_plot.Y_axis_chem_shift_offset 0.04
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
17 ILE 4.69 -2.33 0
34 PHE -8.04 -4.56 0
65 VAL -4.76 -5.35 0
45 ALA 9.45 0.52 0
10 LYS -1.58 -2.37 1
11 TYR -0.20 0.88 1
12 PHE -3.85 -0.85 1
13 ASN -2.56 -1.40 1
14 ASP 2.70 -0.19 1
15 LYS 0.31 2.93 1
16 THR 1.44 1.95 1
18 ASP 3.73 2.07 1
19 GLU 1.93 2.66 1
20 GLU 2.62 2.55 1
21 LEU 3.20 1.34 1
22 GLU -0.45 0.78 1
23 ARG 4.01 0.37 1
24 ASP -1.58 0.97 1
25 LYS 2.61 -0.02 1
26 ARG 1.49 0.59 1
27 VAL -0.75 -0.69 1
28 THR 1.63 -1.79 1
29 TRP -5.38 -0.83 1
30 ILE -3.49 -2.43 1
31 VAL -4.36 -2.54 1
32 GLU -2.94 -2.09 1
33 PHE -0.99 -1.41 1
35 ALA -3.72 0.69 1
36 ASN 2.98 0.35 1
37 TRP -1.50 0.20 1
38 SER -0.40 1.37 1
40 ASP 3.94 3.57 1
42 GLN 5.43 3.26 1
43 SER 3.75 0.54 1
44 PHE 0.22 0.23 1
47 ILE 4.05 1.52 1
48 TYR 4.48 1.75 1
49 ALA 4.24 2.88 1
50 ASP 4.24 2.92 1
51 LEU 2.74 0.76 1
52 SER 4.10 0.84 1
53 LEU 2.55 1.41 1
54 LYS 1.38 1.66 1
55 TYR 1.09 -0.53 1
56 ASN 1.77 -0.12 1
58 THR 4.26 1.10 1
60 LEU -2.26 -4.23 1
61 ASN -2.85 -3.12 1
62 PHE -2.53 0.71 1
64 LYS -4.29 -3.32 1
66 ASP -1.87 0.71 1
67 VAL 2.11 -0.02 1
69 ARG -0.44 0.76 1
70 TYR 0.97 0.98 1
71 THR 4.81 2.75 1
72 ASP 3.59 2.51 1
73 VAL 5.57 1.39 1
74 SER 4.79 2.48 1
75 THR 4.96 2.86 1
76 ARG 4.17 1.44 1
77 TYR 2.52 -2.42 1
78 LYS 5.21 -1.46 1
79 VAL -1.47 -1.95 1
80 SER -0.36 1.54 1
81 THR 0.22 -0.31 1
82 SER -0.14 1.82 1
84 LEU 1.75 0.51 1
85 THR 0.17 -0.15 1
86 LYS 2.79 0.04 1
87 GLN -1.61 -2.53 1
88 LEU -5.18 -2.24 1
90 THR -3.47 -0.87 1
91 LEU -7.13 -2.00 1
92 ILE -1.40 -2.79 1
93 LEU -5.63 -2.77 1
94 PHE -2.74 -0.23 1
95 GLN -3.57 1.38 1
98 LYS -4.73 -0.95 1
99 GLU 2.34 -0.82 1
100 ALA -1.86 -0.22 1
101 MET -1.43 -3.51 1
102 ARG -7.29 -0.96 1
103 ARG -6.09 -1.34 1
105 GLN -0.77 -1.76 1
106 ILE -2.32 0.50 1
107 ASP -1.61 2.13 1
108 LYS 3.25 1.13 1
109 LYS -0.04 0.22 1
111 ARG -0.97 -0.75 1
112 ALA -0.70 0.22 1
113 VAL 0.54 -0.33 1
114 SER 2.72 -1.21 1
115 TRP -0.72 -1.59 1
116 THR 1.09 -1.74 1
117 PHE 2.79 -0.80 1
118 SER -5.40 -0.46 1
119 GLU 4.36 1.20 1
120 GLU 3.50 2.21 1
121 ASN 4.46 2.93 1
122 VAL 6.10 1.43 1
123 ILE 5.37 2.65 1
124 ARG 3.16 3.48 1
125 GLU 5.47 0.79 1
126 PHE 3.44 -2.00 1
127 ASN 2.53 1.13 1
128 LEU 5.65 1.16 1
129 ASN 4.26 1.78 1
130 GLU 1.77 1.91 1
131 LEU 0.15 -0.15 1
132 SER -0.72 -0.15 1
135 SER -0.07 0.21 1
136 SER -0.10 -0.61 1
stop_
save_