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 bmr15440_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -7.33
_LACS_plot.Line_1_terminator_val_y_1 -3.02
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 1.03
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.11
_LACS_plot.Line_2_terminator_val_x_2 9.09
_LACS_plot.Line_2_terminator_val_y_2 6.56
_LACS_plot.Y_axis_chem_shift_offset -0.22
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
36 ASN 9.09 3.11 0
10 ALA -0.19 -0.09 1
15 ARG -0.12 -0.02 1
16 ALA -0.12 0.03 1
17 ASP -0.04 -0.01 1
18 LYS 0.62 0.32 1
19 THR 0.45 0.36 1
20 ALA -0.63 -0.30 1
21 ALA 0.07 0.05 1
23 GLN 0.15 0.25 1
24 THR 0.24 0.27 1
25 ARG 0.08 0.12 1
26 LEU -0.05 -0.02 1
27 THR -0.05 -0.26 1
29 TYR -0.00 0.04 1
30 ALA -0.41 -0.01 1
31 GLN 0.18 0.16 1
32 ALA 0.24 0.40 1
34 GLU -0.16 0.37 1
35 ASP 0.41 0.42 1
37 TRP -3.62 -2.27 1
38 ARG 7.68 4.43 1
39 SER 4.14 2.71 1
40 ARG 3.85 3.73 1
41 ILE 6.86 5.77 1
42 SER 5.50 4.25 1
44 ARG 4.67 3.26 1
45 LEU 5.15 3.30 1
46 ASN 3.79 3.21 1
47 ARG 3.26 2.43 1
48 PHE -0.30 1.47 1
49 LYS 1.11 1.81 1
50 ARG -2.99 -1.69 1
51 TYR -0.90 0.64 1
53 LYS 4.07 3.53 1
54 ASP 4.67 2.23 1
55 ALA 2.44 2.16 1
56 LEU 3.18 2.96 1
57 ARG 3.95 2.95 1
58 LEU -1.05 -0.19 1
59 LYS 4.88 1.04 1
60 ARG -1.92 -1.91 1
61 GLN -4.69 -1.30 1
63 VAL -3.25 -1.60 1
65 GLN -4.07 -0.56 1
66 VAL -7.33 -3.36 1
67 ARG -5.69 -2.51 1
68 PHE -5.53 -2.69 1
69 THR -3.04 -1.71 1
70 LEU -6.39 -2.47 1
71 ASP -2.50 -1.99 1
72 ARG 3.55 2.19 1
73 GLN -0.41 -0.20 1
75 HIS 2.05 2.30 1
76 VAL 0.50 0.22 1
77 LEU -0.34 0.16 1
78 ALA -3.14 -0.19 1
79 VAL -3.01 -0.25 1
80 THR -2.12 -0.19 1
81 LEU -0.09 0.47 1
82 VAL 1.42 1.54 1
83 SER -1.64 -0.66 1
84 SER -3.68 -3.17 1
85 ALA -1.35 -0.19 1
87 LEU -6.01 -0.70 1
89 SER 6.10 2.47 1
90 LEU 3.70 2.09 1
91 ASP 5.28 3.78 1
92 ARG 3.84 3.61 1
93 GLU 3.43 1.48 1
94 ILE 7.45 6.03 1
95 GLN 2.41 3.21 1
96 ALA 2.13 2.18 1
97 LEU 4.53 3.02 1
98 VAL 5.19 3.99 1
99 LYS 3.48 3.05 1
100 ARG 2.07 2.55 1
101 ALA -2.82 -1.25 1
102 SER -0.14 0.52 1
104 LEU -1.29 -1.03 1
109 ALA 3.43 3.00 1
110 ASP 2.19 1.05 1
111 ALA 0.22 0.17 1
112 TYR -0.26 1.24 1
113 VAL -1.05 0.12 1
114 ASN 1.32 1.21 1
116 THR -5.30 -1.60 1
117 VAL -3.99 -2.35 1
118 GLU -5.19 -2.29 1
119 LEU -4.51 -1.18 1
120 THR -1.29 -0.67 1
121 LEU -5.63 -1.13 1
123 ILE -1.33 -1.95 1
124 ASP -4.75 -1.54 1
125 PHE 1.42 0.37 1
126 SER -2.97 -1.40 1
127 LEU 0.48 0.27 1
128 ARG 1.18 0.81 1
130 ALA -0.25 0.05 1
132 PHE 0.43 1.26 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr15440_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -7.33
_LACS_plot.Line_1_terminator_val_y_1 4.31
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.97
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.89
_LACS_plot.Line_2_terminator_val_x_2 9.09
_LACS_plot.Line_2_terminator_val_y_2 -2.53
_LACS_plot.Y_axis_chem_shift_offset -0.22
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
36 ASN 9.09 -5.98 0
10 ALA -0.19 0.10 1
15 ARG -0.12 0.10 1
16 ALA -0.12 0.15 1
17 ASP -0.04 0.03 1
18 LYS 0.62 -0.30 1
19 THR 0.45 -0.09 1
20 ALA -0.63 0.33 1
21 ALA 0.07 -0.02 1
23 GLN 0.15 0.10 1
24 THR 0.24 0.03 1
25 ARG 0.08 0.04 1
26 LEU -0.05 0.03 1
27 THR -0.05 -0.21 1
29 TYR -0.00 0.04 1
30 ALA -0.41 0.40 1
31 GLN 0.18 -0.02 1
32 ALA 0.24 0.16 1
34 GLU -0.16 0.53 1
35 ASP 0.41 0.01 1
37 TRP -3.62 1.35 1
38 ARG 7.68 -3.25 1
39 SER 4.14 -1.43 1
40 ARG 3.85 -0.12 1
41 ILE 6.86 -1.09 1
42 SER 5.50 -1.25 1
44 ARG 4.67 -1.41 1
45 LEU 5.15 -1.85 1
46 ASN 3.79 -0.58 1
47 ARG 3.26 -0.83 1
48 PHE -0.30 1.77 1
49 LYS 1.11 0.70 1
50 ARG -2.99 1.30 1
51 TYR -0.90 1.54 1
53 LYS 4.07 -0.54 1
54 ASP 4.67 -2.44 1
55 ALA 2.44 -0.28 1
56 LEU 3.18 -0.22 1
57 ARG 3.95 -1.00 1
58 LEU -1.05 0.86 1
59 LYS 4.88 -3.84 1
60 ARG -1.92 0.01 1
61 GLN -4.69 3.39 1
63 VAL -3.25 1.65 1
65 GLN -4.07 3.51 1
66 VAL -7.33 3.97 1
67 ARG -5.69 3.18 1
68 PHE -5.53 2.84 1
69 THR -3.04 1.33 1
70 LEU -6.39 3.92 1
71 ASP -2.50 0.51 1
72 ARG 3.55 -1.36 1
73 GLN -0.41 0.21 1
75 HIS 2.05 0.25 1
76 VAL 0.50 -0.28 1
77 LEU -0.34 0.50 1
78 ALA -3.14 2.95 1
79 VAL -3.01 2.76 1
80 THR -2.12 1.93 1
81 LEU -0.09 0.56 1
82 VAL 1.42 0.12 1
83 SER -1.64 0.98 1
84 SER -3.68 0.51 1
85 ALA -1.35 1.16 1
87 LEU -6.01 5.31 1
89 SER 6.10 -3.63 1
90 LEU 3.70 -1.61 1
91 ASP 5.28 -1.50 1
92 ARG 3.84 -0.23 1
93 GLU 3.43 -1.95 1
94 ILE 7.45 -1.42 1
95 GLN 2.41 0.80 1
96 ALA 2.13 0.05 1
97 LEU 4.53 -1.51 1
98 VAL 5.19 -1.20 1
99 LYS 3.48 -0.43 1
100 ARG 2.07 0.48 1
101 ALA -2.82 1.57 1
102 SER -0.14 0.66 1
104 LEU -1.29 0.26 1
109 ALA 3.43 -0.43 1
110 ASP 2.19 -1.14 1
111 ALA 0.22 -0.05 1
112 TYR -0.26 1.50 1
113 VAL -1.05 1.17 1
114 ASN 1.32 -0.11 1
116 THR -5.30 3.70 1
117 VAL -3.99 1.64 1
118 GLU -5.19 2.90 1
119 LEU -4.51 3.33 1
120 THR -1.29 0.62 1
121 LEU -5.63 4.50 1
123 ILE -1.33 -0.62 1
124 ASP -4.75 3.21 1
125 PHE 1.42 -1.05 1
126 SER -2.97 1.57 1
127 LEU 0.48 -0.21 1
128 ARG 1.18 -0.37 1
130 ALA -0.25 0.30 1
132 PHE 0.43 0.83 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr15440_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -7.33
_LACS_plot.Line_1_terminator_val_y_1 0.62
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.24
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.10
_LACS_plot.Line_2_terminator_val_x_2 9.09
_LACS_plot.Line_2_terminator_val_y_2 -0.76
_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
38 ARG 7.68 0.47 0
10 ALA -0.19 -0.05 1
15 ARG -0.12 -0.02 1
16 ALA -0.12 -0.02 1
17 ASP -0.04 -0.09 1
18 LYS 0.62 0.01 1
19 THR 0.45 -0.13 1
20 ALA -0.63 -0.03 1
21 ALA 0.07 -0.08 1
23 GLN 0.15 -0.01 1
24 THR 0.24 -0.21 1
25 ARG 0.08 -0.01 1
26 LEU -0.05 0.03 1
27 THR -0.05 -0.05 1
29 TYR -0.00 -0.08 1
30 ALA -0.41 -0.07 1
31 GLN 0.18 -0.10 1
32 ALA 0.24 -0.02 1
34 GLU -0.16 -0.11 1
35 ASP 0.41 -0.07 1
36 ASN 9.09 -0.45 1
37 TRP -3.62 -0.13 1
39 SER 4.14 -0.24 1
40 ARG 3.85 -0.14 1
41 ILE 6.86 -0.52 1
42 SER 5.50 0.15 1
44 ARG 4.67 -0.08 1
45 LEU 5.15 -0.51 1
46 ASN 3.79 -0.35 1
47 ARG 3.26 -0.24 1
48 PHE -0.30 -0.25 1
49 LYS 1.11 -0.26 1
50 ARG -2.99 0.34 1
51 TYR -0.90 -0.02 1
53 LYS 4.07 -0.39 1
54 ASP 4.67 -0.39 1
55 ALA 2.44 -0.55 1
56 LEU 3.18 -0.59 1
57 ARG 3.95 -0.35 1
58 LEU -1.05 -0.16 1
59 LYS 4.88 -0.76 1
60 ARG -1.92 0.20 1
61 GLN -4.69 0.27 1
63 VAL -3.25 0.98 1
65 GLN -4.07 0.88 1
66 VAL -7.33 0.88 1
67 ARG -5.69 1.46 1
68 PHE -5.53 1.06 1
69 THR -3.04 1.16 1
70 LEU -6.39 1.42 1
71 ASP -2.50 0.71 1
72 ARG 3.55 0.20 1
73 GLN -0.41 0.04 1
75 HIS 2.05 -0.48 1
76 VAL 0.50 0.21 1
77 LEU -0.34 0.07 1
78 ALA -3.14 0.21 1
79 VAL -3.01 0.74 1
80 THR -2.12 0.22 1
81 LEU -0.09 0.08 1
82 VAL 1.42 -0.08 1
83 SER -1.64 0.14 1
84 SER -3.68 0.03 1
85 ALA -1.35 0.16 1
87 LEU -6.01 0.16 1
89 SER 6.10 0.15 1
90 LEU 3.70 -0.82 1
91 ASP 5.28 -0.19 1
92 ARG 3.84 -0.28 1
93 GLU 3.43 0.36 1
94 ILE 7.45 -0.61 1
95 GLN 2.41 -0.46 1
96 ALA 2.13 -0.32 1
97 LEU 4.53 -0.46 1
98 VAL 5.19 -1.04 1
99 LYS 3.48 -0.53 1
100 ARG 2.07 -0.45 1
101 ALA -2.82 0.47 1
102 SER -0.14 -0.75 1
104 LEU -1.29 0.34 1
109 ALA 3.43 -0.40 1
110 ASP 2.19 -0.23 1
111 ALA 0.22 -0.15 1
112 TYR -0.26 -0.61 1
113 VAL -1.05 0.03 1
114 ASN 1.32 -0.32 1
116 THR -5.30 -0.03 1
117 VAL -3.99 0.23 1
118 GLU -5.19 0.88 1
119 LEU -4.51 0.21 1
120 THR -1.29 1.04 1
121 LEU -5.63 0.35 1
123 ILE -1.33 -0.01 1
124 ASP -4.75 0.40 1
125 PHE 1.42 -0.16 1
126 SER -2.97 0.53 1
127 LEU 0.48 -0.12 1
128 ARG 1.18 -0.09 1
130 ALA -0.25 -0.04 1
132 PHE 0.43 -0.21 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr15440_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -7.33
_LACS_plot.Line_1_terminator_val_y_1 -2.96
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 0.47
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -0.96
_LACS_plot.Line_2_terminator_val_x_2 9.09
_LACS_plot.Line_2_terminator_val_y_2 2.68
_LACS_plot.Y_axis_chem_shift_offset 0.28
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
71 ASP -2.50 4.94 0
15 ARG -0.12 -0.09 1
16 ALA -0.12 -0.47 1
17 ASP -0.04 0.15 1
18 LYS 0.62 0.22 1
19 THR 0.45 -0.54 1
20 ALA -0.63 -0.86 1
23 GLN 0.15 0.25 1
24 THR 0.24 1.58 1
25 ARG 0.08 -0.36 1
26 LEU -0.05 -0.40 1
29 TYR -0.00 -0.28 1
30 ALA -0.41 -0.48 1
31 GLN 0.18 -0.19 1
32 ALA 0.24 0.49 1
34 GLU -0.16 -0.16 1
36 ASN 9.09 1.02 1
38 ARG 7.68 2.59 1
39 SER 4.14 3.43 1
41 ILE 6.86 0.72 1
42 SER 5.50 2.29 1
44 ARG 4.67 1.80 1
45 LEU 5.15 1.62 1
46 ASN 3.79 2.53 1
47 ARG 3.26 1.04 1
48 PHE -0.30 -1.11 1
49 LYS 1.11 -1.47 1
50 ARG -2.99 -2.06 1
53 LYS 4.07 -1.91 1
54 ASP 4.67 1.12 1
55 ALA 2.44 0.91 1
56 LEU 3.18 2.63 1
57 ARG 3.95 2.03 1
58 LEU -1.05 -1.85 1
59 LYS 4.88 -1.22 1
60 ARG -1.92 -1.23 1
61 GLN -4.69 -1.08 1
63 VAL -3.25 -0.70 1
65 GLN -4.07 -1.56 1
66 VAL -7.33 -6.45 1
67 ARG -5.69 0.11 1
68 PHE -5.53 -3.01 1
69 THR -3.04 -0.34 1
70 LEU -6.39 -0.13 1
72 ARG 3.55 0.16 1
73 GLN -0.41 -0.50 1
75 HIS 2.05 1.73 1
76 VAL 0.50 0.67 1
77 LEU -0.34 -0.54 1
78 ALA -3.14 -2.45 1
79 VAL -3.01 -1.53 1
80 THR -2.12 -2.15 1
81 LEU -0.09 -1.86 1
82 VAL 1.42 -0.34 1
83 SER -1.64 -1.84 1
84 SER -3.68 1.49 1
85 ALA -1.35 0.55 1
89 SER 6.10 3.93 1
90 LEU 3.70 -0.51 1
91 ASP 5.28 3.32 1
92 ARG 3.84 2.85 1
93 GLU 3.43 0.69 1
94 ILE 7.45 -0.87 1
95 GLN 2.41 0.92 1
96 ALA 2.13 3.32 1
97 LEU 4.53 -0.66 1
98 VAL 5.19 -0.04 1
99 LYS 3.48 -2.11 1
100 ARG 2.07 0.19 1
101 ALA -2.82 -2.60 1
109 ALA 3.43 2.00 1
110 ASP 2.19 0.05 1
111 ALA 0.22 -0.18 1
112 TYR -0.26 0.52 1
114 ASN 1.32 0.82 1
116 THR -5.30 -2.19 1
117 VAL -3.99 -4.86 1
118 GLU -5.19 -1.67 1
119 LEU -4.51 -3.45 1
120 THR -1.29 -0.53 1
123 ILE -1.33 -3.16 1
124 ASP -4.75 -2.07 1
125 PHE 1.42 -1.11 1
126 SER -2.97 -0.37 1
127 LEU 0.48 -0.19 1
128 ARG 1.18 0.99 1
130 ALA -0.25 -0.07 1
stop_
save_