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 bmr10211_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -8.13
_LACS_plot.Line_1_terminator_val_y_1 -3.64
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 1.13
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.17
_LACS_plot.Line_2_terminator_val_x_2 5.63
_LACS_plot.Line_2_terminator_val_y_2 4.02
_LACS_plot.Y_axis_chem_shift_offset -0.19
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
53 HIS 0.32 2.97 0
10 ASN 0.20 0.13 1
11 ARG 0.27 0.09 1
12 ARG 0.20 -0.08 1
14 LEU 0.33 0.19 1
15 TRP -1.63 -1.39 1
16 GLU 0.56 0.53 1
18 GLU 1.20 0.62 1
19 GLU -0.54 -0.43 1
20 THR 1.81 1.40 1
21 VAL -1.12 -0.78 1
22 VAL -6.81 -4.40 1
23 ILE -4.80 -2.31 1
24 ALA -2.17 -1.04 1
25 LEU -0.69 0.70 1
26 TYR -7.91 -4.32 1
27 ASP -0.52 0.32 1
28 TYR -3.32 0.04 1
29 GLN -2.00 -1.55 1
30 THR -1.23 -2.03 1
31 ASN -1.57 -0.65 1
32 ASP -2.38 -0.20 1
34 GLN 0.29 0.38 1
35 GLU -4.94 -1.45 1
36 LEU -5.01 -1.72 1
37 ALA -0.92 -0.65 1
38 LEU -4.97 -2.15 1
39 ARG -3.80 -2.27 1
40 ARG 2.72 2.30 1
41 ASN 4.11 2.76 1
42 GLU 0.03 0.02 1
43 GLU -4.09 -1.60 1
44 TYR -4.47 -1.05 1
46 LEU -0.23 0.30 1
47 LEU -0.28 0.22 1
48 ASP -1.97 0.45 1
49 SER 0.12 -1.66 1
50 SER 3.99 3.52 1
51 GLU -1.42 -1.21 1
52 ILE 3.81 3.38 1
54 TRP -3.89 -1.53 1
55 TRP -7.12 -4.13 1
56 ARG -2.55 -0.75 1
57 VAL -7.02 -3.57 1
58 GLN -8.13 -2.38 1
59 ASP -4.08 -1.62 1
60 ARG 3.22 1.91 1
61 ASN -0.84 -0.08 1
63 HIS 0.29 0.65 1
64 GLU -7.13 -2.61 1
66 TYR -0.93 1.24 1
67 VAL -3.07 -2.11 1
69 SER 5.64 1.86 1
70 SER 2.21 1.29 1
71 TYR 1.37 0.20 1
72 LEU -5.70 -1.48 1
73 VAL -5.40 -2.49 1
74 GLU 0.88 1.14 1
75 LYS 0.39 0.92 1
76 SER -0.48 -0.20 1
78 ASN 0.29 0.21 1
79 ASN 0.35 0.28 1
80 LEU 0.52 0.42 1
81 GLU -0.26 0.06 1
82 THR -0.36 -0.28 1
83 TYR -0.42 -0.26 1
84 GLU -1.11 -0.50 1
85 TRP 0.45 1.03 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr10211_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -8.13
_LACS_plot.Line_1_terminator_val_y_1 4.49
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.87
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.83
_LACS_plot.Line_2_terminator_val_x_2 5.63
_LACS_plot.Line_2_terminator_val_y_2 -1.61
_LACS_plot.Y_axis_chem_shift_offset -0.19
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
53 HIS 0.32 2.65 0
10 ASN 0.20 -0.07 1
11 ARG 0.27 -0.18 1
12 ARG 0.20 -0.28 1
14 LEU 0.33 -0.14 1
15 TRP -1.63 0.24 1
16 GLU 0.56 -0.03 1
18 GLU 1.20 -0.58 1
19 GLU -0.54 0.11 1
20 THR 1.81 -0.41 1
21 VAL -1.12 0.34 1
22 VAL -6.81 2.41 1
23 ILE -4.80 2.49 1
24 ALA -2.17 1.13 1
25 LEU -0.69 1.39 1
26 TYR -7.91 3.59 1
27 ASP -0.52 0.84 1
28 TYR -3.32 3.36 1
29 GLN -2.00 0.45 1
30 THR -1.23 -0.80 1
31 ASN -1.57 0.92 1
32 ASP -2.38 2.18 1
34 GLN 0.29 0.09 1
35 GLU -4.94 3.49 1
36 LEU -5.01 3.29 1
37 ALA -0.92 0.27 1
38 LEU -4.97 2.82 1
39 ARG -3.80 1.53 1
40 ARG 2.72 -0.42 1
41 ASN 4.11 -1.35 1
42 GLU 0.03 -0.01 1
43 GLU -4.09 2.49 1
44 TYR -4.47 3.42 1
46 LEU -0.23 0.53 1
47 LEU -0.28 0.50 1
48 ASP -1.97 2.42 1
49 SER 0.12 -1.78 1
50 SER 3.99 -0.47 1
51 GLU -1.42 0.21 1
52 ILE 3.81 -0.43 1
54 TRP -3.89 2.36 1
55 TRP -7.12 2.99 1
56 ARG -2.55 1.80 1
57 VAL -7.02 3.45 1
58 GLN -8.13 5.75 1
59 ASP -4.08 2.46 1
60 ARG 3.22 -1.31 1
61 ASN -0.84 0.76 1
63 HIS 0.29 0.36 1
64 GLU -7.13 4.52 1
66 TYR -0.93 2.17 1
67 VAL -3.07 0.96 1
69 SER 5.64 -3.78 1
70 SER 2.21 -0.92 1
71 TYR 1.37 -1.17 1
72 LEU -5.70 4.22 1
73 VAL -5.40 2.91 1
74 GLU 0.88 0.26 1
75 LYS 0.39 0.53 1
76 SER -0.48 0.28 1
78 ASN 0.29 -0.08 1
79 ASN 0.35 -0.07 1
80 LEU 0.52 -0.10 1
81 GLU -0.26 0.32 1
82 THR -0.36 0.08 1
83 TYR -0.42 0.16 1
84 GLU -1.11 0.61 1
85 TRP 0.45 0.58 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr10211_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -8.13
_LACS_plot.Line_1_terminator_val_y_1 1.21
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.34
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.24
_LACS_plot.Line_2_terminator_val_x_2 5.63
_LACS_plot.Line_2_terminator_val_y_2 -0.78
_LACS_plot.Y_axis_chem_shift_offset 0.03
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
69 SER 5.64 -1.68 0
26 TYR -7.91 0.19 0
10 ASN 0.20 -0.09 1
11 ARG 0.27 -0.08 1
12 ARG 0.20 -0.14 1
14 LEU 0.33 -0.27 1
15 TRP -1.63 0.14 1
16 GLU 0.56 -0.16 1
18 GLU 1.20 -0.15 1
19 GLU -0.54 -0.09 1
20 THR 1.81 -0.16 1
21 VAL -1.12 0.43 1
22 VAL -6.81 1.07 1
23 ILE -4.80 0.91 1
24 ALA -2.17 0.66 1
25 LEU -0.69 -0.46 1
27 ASP -0.52 0.00 1
28 TYR -3.32 0.38 1
29 GLN -2.00 0.17 1
30 THR -1.23 -0.03 1
31 ASN -1.57 0.05 1
32 ASP -2.38 -0.10 1
34 GLN 0.29 0.22 1
35 GLU -4.94 1.02 1
36 LEU -5.01 0.08 1
37 ALA -0.92 0.26 1
38 LEU -4.97 0.69 1
39 ARG -3.80 0.64 1
40 ARG 2.72 -0.99 1
41 ASN 4.11 -0.51 1
42 GLU 0.03 0.10 1
43 GLU -4.09 0.76 1
44 TYR -4.47 0.16 1
46 LEU -0.23 -0.12 1
47 LEU -0.28 0.14 1
48 ASP -1.97 0.11 1
49 SER 0.12 -0.45 1
50 SER 3.99 -0.42 1
51 GLU -1.42 0.34 1
52 ILE 3.81 -0.22 1
53 HIS 0.32 -0.40 1
54 TRP -3.89 0.48 1
55 TRP -7.12 0.84 1
56 ARG -2.55 0.38 1
57 VAL -7.02 1.24 1
58 GLN -8.13 1.34 1
59 ASP -4.08 0.62 1
60 ARG 3.22 -0.35 1
61 ASN -0.84 0.11 1
63 HIS 0.29 0.05 1
64 GLU -7.13 1.48 1
66 TYR -0.93 0.77 1
67 VAL -3.07 0.36 1
70 SER 2.21 -0.38 1
71 TYR 1.37 -0.05 1
72 LEU -5.70 1.05 1
73 VAL -5.40 0.48 1
74 GLU 0.88 0.01 1
75 LYS 0.39 -0.16 1
76 SER -0.48 0.03 1
78 ASN 0.29 -0.09 1
79 ASN 0.35 -0.04 1
80 LEU 0.52 -0.04 1
81 GLU -0.26 -0.10 1
82 THR -0.36 -0.14 1
83 TYR -0.42 -0.11 1
84 GLU -1.11 -0.12 1
85 TRP 0.45 -0.21 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr10211_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -8.13
_LACS_plot.Line_1_terminator_val_y_1 -2.31
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 0.07
_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 5.63
_LACS_plot.Line_2_terminator_val_y_2 1.29
_LACS_plot.Y_axis_chem_shift_offset 0.39
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
85 TRP 0.45 4.87 0
10 ASN 0.20 -0.12 1
11 ARG 0.27 -0.26 1
12 ARG 0.20 -0.43 1
14 LEU 0.33 -0.99 1
15 TRP -1.63 -0.01 1
16 GLU 0.56 0.63 1
18 GLU 1.20 0.34 1
19 GLU -0.54 -0.42 1
20 THR 1.81 -2.20 1
21 VAL -1.12 -0.60 1
22 VAL -6.81 -2.84 1
23 ILE -4.80 -0.13 1
24 ALA -2.17 0.86 1
25 LEU -0.69 -1.91 1
26 TYR -7.91 -2.10 1
27 ASP -0.52 -0.30 1
28 TYR -3.32 -2.07 1
29 GLN -2.00 -2.03 1
30 THR -1.23 -2.31 1
31 ASN -1.57 -0.62 1
32 ASP -2.38 1.13 1
34 GLN 0.29 0.81 1
35 GLU -4.94 -2.09 1
36 LEU -5.01 -4.07 1
37 ALA -0.92 0.02 1
38 LEU -4.97 0.24 1
39 ARG -3.80 -1.71 1
40 ARG 2.72 0.13 1
41 ASN 4.11 -0.88 1
42 GLU 0.03 -2.72 1
43 GLU -4.09 -1.32 1
44 TYR -4.47 -2.59 1
46 LEU -0.23 -2.70 1
47 LEU -0.28 -0.06 1
48 ASP -1.97 -1.26 1
49 SER 0.12 -0.65 1
50 SER 3.99 0.91 1
51 GLU -1.42 -0.03 1
52 ILE 3.81 2.28 1
53 HIS 0.32 1.58 1
54 TRP -3.89 -1.81 1
55 TRP -7.12 -1.48 1
56 ARG -2.55 -0.52 1
57 VAL -7.02 -3.54 1
58 GLN -8.13 -0.29 1
59 ASP -4.08 2.32 1
60 ARG 3.22 0.10 1
61 ASN -0.84 0.00 1
63 HIS 0.29 -0.17 1
64 GLU -7.13 -0.24 1
66 TYR -0.93 0.26 1
67 VAL -3.07 -2.76 1
69 SER 5.64 1.64 1
70 SER 2.21 0.69 1
71 TYR 1.37 -1.90 1
72 LEU -5.70 -1.71 1
73 VAL -5.40 -2.11 1
74 GLU 0.88 -0.28 1
75 LYS 0.39 -0.66 1
76 SER -0.48 -0.22 1
78 ASN 0.29 -0.21 1
79 ASN 0.35 -0.07 1
80 LEU 0.52 -0.14 1
81 GLU -0.26 -0.23 1
82 THR -0.36 -0.89 1
83 TYR -0.42 -0.78 1
84 GLU -1.11 -1.89 1
stop_
save_