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 bmr11227_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -7.60
_LACS_plot.Line_1_terminator_val_y_1 -2.44
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 0.66
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.09
_LACS_plot.Line_2_terminator_val_x_2 3.93
_LACS_plot.Line_2_terminator_val_y_2 2.66
_LACS_plot.Y_axis_chem_shift_offset -0.10
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
64 ASN 3.94 -0.66 0
10 ALA -0.54 -0.28 1
11 VAL 1.46 0.48 1
12 SER -2.98 -0.83 1
13 ASP 1.36 0.26 1
14 ILE 0.47 0.54 1
15 ARG -3.65 -1.70 1
16 VAL -0.68 -0.88 1
17 THR 0.17 -0.09 1
18 ARG 1.68 1.21 1
19 SER -2.64 -1.08 1
20 SER 0.69 1.55 1
22 SER -3.95 -2.22 1
23 SER -4.34 -0.95 1
24 LEU -6.41 -1.36 1
25 SER -0.29 -0.76 1
26 LEU -6.40 -1.90 1
27 ALA -4.94 -0.86 1
28 TRP -2.31 -1.56 1
29 ALA -1.79 -1.11 1
30 VAL 1.01 0.98 1
32 ARG 0.64 -0.31 1
33 ALA -1.41 -0.54 1
35 SER 0.25 0.04 1
37 ALA -1.66 -0.46 1
38 VAL 2.35 1.38 1
39 LEU 0.34 1.08 1
40 ASP -1.64 -1.00 1
41 TYR -5.38 -1.38 1
42 GLU -5.83 -0.99 1
43 VAL -2.00 -1.43 1
44 LYS -5.59 -2.12 1
45 TYR -5.96 -2.71 1
46 HIS -4.53 -0.93 1
47 GLU -0.81 -0.63 1
48 LYS 2.55 2.04 1
50 ALA -0.88 -0.44 1
51 GLU -2.80 -0.99 1
54 SER 1.88 1.05 1
55 SER 0.61 1.00 1
56 VAL 1.25 0.37 1
57 ARG -4.52 -2.25 1
58 PHE -6.00 -1.64 1
59 LEU -4.45 -0.21 1
60 LYS -1.78 -0.65 1
61 THR -2.83 -2.41 1
62 SER 1.12 1.00 1
63 GLU -4.91 -2.12 1
65 ARG -2.88 -1.45 1
66 ALA -4.99 -0.75 1
67 GLU -3.30 -2.02 1
68 LEU -1.07 -1.78 1
69 ARG -3.87 -1.45 1
71 LEU -0.30 -1.76 1
72 LYS -0.43 0.06 1
73 ARG -0.10 0.68 1
75 ALA -3.71 -1.24 1
76 SER -1.17 -0.25 1
77 TYR -3.52 -0.10 1
78 LEU -2.26 -1.69 1
79 VAL -4.24 -1.73 1
80 GLN -7.60 -1.22 1
81 VAL -3.55 -1.25 1
82 ARG -5.44 -2.57 1
83 ALA -6.87 -2.51 1
84 ARG -4.35 -0.81 1
85 SER -6.14 -2.45 1
86 GLU 3.85 2.96 1
87 ALA -0.30 0.10 1
89 TYR -0.29 1.76 1
92 PHE 1.50 2.25 1
94 GLN -0.71 0.09 1
95 GLU -0.77 0.18 1
96 HIS -2.12 1.31 1
97 HIS -1.87 0.54 1
98 SER -1.97 -0.18 1
99 GLN -2.73 -0.65 1
100 THR -0.05 -0.31 1
101 GLN -0.49 0.15 1
102 LEU 0.03 0.48 1
103 ASP -0.85 -0.13 1
104 SER -0.25 0.02 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11227_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -7.60
_LACS_plot.Line_1_terminator_val_y_1 5.16
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -1.34
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.91
_LACS_plot.Line_2_terminator_val_x_2 3.93
_LACS_plot.Line_2_terminator_val_y_2 -1.27
_LACS_plot.Y_axis_chem_shift_offset -0.10
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
64 ASN 3.94 -4.60 0
10 ALA -0.54 0.26 1
11 VAL 1.46 -0.98 1
12 SER -2.98 2.15 1
13 ASP 1.36 -1.10 1
14 ILE 0.47 0.07 1
15 ARG -3.65 1.95 1
16 VAL -0.68 -0.20 1
17 THR 0.17 -0.26 1
18 ARG 1.68 -0.47 1
19 SER -2.64 1.56 1
20 SER 0.69 0.86 1
22 SER -3.95 1.73 1
23 SER -4.34 3.39 1
24 LEU -6.41 5.05 1
25 SER -0.29 -0.47 1
26 LEU -6.40 4.50 1
27 ALA -4.94 4.08 1
28 TRP -2.31 0.75 1
29 ALA -1.79 0.68 1
30 VAL 1.01 -0.03 1
32 ARG 0.64 -0.95 1
33 ALA -1.41 0.87 1
35 SER 0.25 -0.21 1
37 ALA -1.66 1.20 1
38 VAL 2.35 -0.97 1
39 LEU 0.34 0.74 1
40 ASP -1.64 0.64 1
41 TYR -5.38 4.00 1
42 GLU -5.83 4.84 1
43 VAL -2.00 0.57 1
44 LYS -5.59 3.47 1
45 TYR -5.96 3.25 1
46 HIS -4.53 3.60 1
47 GLU -0.81 0.18 1
48 LYS 2.55 -0.51 1
50 ALA -0.88 0.44 1
51 GLU -2.80 1.81 1
54 SER 1.88 -0.83 1
55 SER 0.61 0.39 1
56 VAL 1.25 -0.88 1
57 ARG -4.52 2.27 1
58 PHE -6.00 4.36 1
59 LEU -4.45 4.24 1
60 LYS -1.78 1.13 1
61 THR -2.83 0.42 1
62 SER 1.12 -0.12 1
63 GLU -4.91 2.79 1
65 ARG -2.88 1.43 1
66 ALA -4.99 4.24 1
67 GLU -3.30 1.28 1
68 LEU -1.07 -0.71 1
69 ARG -3.87 2.42 1
71 LEU -0.30 -1.46 1
72 LYS -0.43 0.49 1
73 ARG -0.10 0.78 1
75 ALA -3.71 2.47 1
76 SER -1.17 0.92 1
77 TYR -3.52 3.42 1
78 LEU -2.26 0.57 1
79 VAL -4.24 2.51 1
80 GLN -7.60 6.38 1
81 VAL -3.55 2.30 1
82 ARG -5.44 2.87 1
83 ALA -6.87 4.36 1
84 ARG -4.35 3.54 1
85 SER -6.14 3.69 1
86 GLU 3.85 -0.89 1
87 ALA -0.30 0.40 1
89 TYR -0.29 2.05 1
92 PHE 1.50 0.75 1
94 GLN -0.71 0.80 1
95 GLU -0.77 0.95 1
96 HIS -2.12 3.43 1
97 HIS -1.87 2.41 1
98 SER -1.97 1.79 1
99 GLN -2.73 2.08 1
100 THR -0.05 -0.26 1
101 GLN -0.49 0.64 1
102 LEU 0.03 0.45 1
103 ASP -0.85 0.72 1
104 SER -0.25 0.27 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11227_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -7.60
_LACS_plot.Line_1_terminator_val_y_1 0.93
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.19
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.29
_LACS_plot.Line_2_terminator_val_x_2 3.93
_LACS_plot.Line_2_terminator_val_y_2 -0.46
_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
60 LYS -1.78 1.22 0
64 ASN 3.94 -1.17 0
10 ALA -0.54 -0.06 1
11 VAL 1.46 0.06 1
12 SER -2.98 0.40 1
13 ASP 1.36 -0.14 1
14 ILE 0.47 0.32 1
15 ARG -3.65 0.29 1
16 VAL -0.68 0.59 1
17 THR 0.17 0.04 1
18 ARG 1.68 0.20 1
19 SER -2.64 0.44 1
20 SER 0.69 0.23 1
22 SER -3.95 0.19 1
23 SER -4.34 0.87 1
24 LEU -6.41 0.51 1
25 SER -0.29 0.67 1
26 LEU -6.40 1.22 1
27 ALA -4.94 0.03 1
28 TRP -2.31 0.59 1
29 ALA -1.79 0.23 1
30 VAL 1.01 0.00 1
32 ARG 0.64 -0.04 1
33 ALA -1.41 0.02 1
35 SER 0.25 -0.07 1
37 ALA -1.66 0.05 1
38 VAL 2.35 -0.50 1
39 LEU 0.34 -0.05 1
40 ASP -1.64 -0.33 1
41 TYR -5.38 1.05 1
42 GLU -5.83 1.02 1
43 VAL -2.00 0.59 1
44 LYS -5.59 0.79 1
45 TYR -5.96 1.41 1
46 HIS -4.53 0.28 1
47 GLU -0.81 -0.66 1
48 LYS 2.55 -0.47 1
50 ALA -0.88 0.13 1
51 GLU -2.80 0.00 1
54 SER 1.88 0.01 1
55 SER 0.61 -0.07 1
56 VAL 1.25 -0.14 1
57 ARG -4.52 0.14 1
58 PHE -6.00 1.35 1
59 LEU -4.45 0.56 1
61 THR -2.83 0.79 1
62 SER 1.12 0.34 1
63 GLU -4.91 0.54 1
65 ARG -2.88 -0.45 1
66 ALA -4.99 0.28 1
67 GLU -3.30 0.64 1
68 LEU -1.07 0.04 1
69 ARG -3.87 0.43 1
71 LEU -0.30 -0.17 1
72 LYS -0.43 -0.09 1
73 ARG -0.10 0.19 1
75 ALA -3.71 0.25 1
76 SER -1.17 0.42 1
77 TYR -3.52 0.19 1
78 LEU -2.26 0.57 1
79 VAL -4.24 0.92 1
80 GLN -7.60 0.56 1
81 VAL -3.55 1.13 1
82 ARG -5.44 0.70 1
83 ALA -6.87 0.72 1
84 ARG -4.35 0.21 1
85 SER -6.14 0.59 1
86 GLU 3.85 -0.43 1
87 ALA -0.30 -0.08 1
89 TYR -0.29 0.42 1
92 PHE 1.50 -0.06 1
94 GLN -0.71 -0.02 1
95 GLU -0.77 0.01 1
96 HIS -2.12 0.06 1
97 HIS -1.87 0.34 1
98 SER -1.97 0.10 1
99 GLN -2.73 0.85 1
100 THR -0.05 -0.02 1
101 GLN -0.49 -0.09 1
102 LEU 0.03 -0.04 1
103 ASP -0.85 0.03 1
104 SER -0.25 0.01 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11227_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -7.60
_LACS_plot.Line_1_terminator_val_y_1 -2.50
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.08
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.13
_LACS_plot.Line_2_terminator_val_x_2 3.93
_LACS_plot.Line_2_terminator_val_y_2 0.54
_LACS_plot.Y_axis_chem_shift_offset 0.58
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
89 TYR -0.29 3.48 0
10 ALA -0.54 -0.59 1
11 VAL 1.46 -1.08 1
12 SER -2.98 -2.04 1
13 ASP 1.36 -1.59 1
14 ILE 0.47 -1.06 1
15 ARG -3.65 -1.67 1
16 VAL -0.68 0.55 1
17 THR 0.17 -0.31 1
19 SER -2.64 -1.63 1
20 SER 0.69 -0.17 1
22 SER -3.95 -1.41 1
23 SER -4.34 -2.64 1
24 LEU -6.41 -2.55 1
25 SER -0.29 -1.48 1
26 LEU -6.40 -0.93 1
27 ALA -4.94 -2.98 1
28 TRP -2.31 -2.11 1
29 ALA -1.79 0.56 1
30 VAL 1.01 0.82 1
32 ARG 0.64 -1.14 1
33 ALA -1.41 -0.36 1
35 SER 0.25 0.02 1
37 ALA -1.66 -0.31 1
38 VAL 2.35 -0.28 1
39 LEU 0.34 -0.66 1
40 ASP -1.64 -4.49 1
41 TYR -5.38 0.66 1
42 GLU -5.83 -2.96 1
43 VAL -2.00 -1.83 1
44 LYS -5.59 -1.62 1
45 TYR -5.96 -2.61 1
46 HIS -4.53 -1.32 1
47 GLU -0.81 0.06 1
48 LYS 2.55 0.48 1
50 ALA -0.88 -0.78 1
51 GLU -2.80 0.11 1
54 SER 1.88 0.36 1
55 SER 0.61 -0.88 1
56 VAL 1.25 -1.75 1
57 ARG -4.52 -3.31 1
58 PHE -6.00 0.82 1
59 LEU -4.45 -2.70 1
60 LYS -1.78 -0.41 1
61 THR -2.83 -1.87 1
62 SER 1.12 -0.86 1
63 GLU -4.91 -2.10 1
64 ASN 3.94 -2.04 1
65 ARG -2.88 -2.12 1
66 ALA -4.99 -3.34 1
67 GLU -3.30 -2.08 1
68 LEU -1.07 -2.43 1
69 ARG -3.87 -0.20 1
71 LEU -0.30 -1.66 1
72 LYS -0.43 0.21 1
73 ARG -0.10 1.56 1
75 ALA -3.71 -1.44 1
76 SER -1.17 -1.54 1
77 TYR -3.52 -1.85 1
78 LEU -2.26 -1.19 1
79 VAL -4.24 -1.42 1
80 GLN -7.60 -2.06 1
81 VAL -3.55 -1.75 1
82 ARG -5.44 -3.07 1
83 ALA -6.87 -3.46 1
84 ARG -4.35 -1.31 1
85 SER -6.14 0.60 1
86 GLU 3.85 0.24 1
87 ALA -0.30 -0.68 1
92 PHE 1.50 2.24 1
94 GLN -0.71 0.52 1
95 GLU -0.77 -0.75 1
96 HIS -2.12 0.49 1
98 SER -1.97 -1.37 1
99 GLN -2.73 0.49 1
100 THR -0.05 0.00 1
101 GLN -0.49 -0.39 1
102 LEU 0.03 -0.53 1
103 ASP -0.85 -0.42 1
104 SER -0.25 0.09 1
stop_
save_