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 bmr11218_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -7.58
_LACS_plot.Line_1_terminator_val_y_1 -3.00
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 0.59
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.65
_LACS_plot.Line_2_terminator_val_x_2 9.15
_LACS_plot.Line_2_terminator_val_y_2 6.89
_LACS_plot.Y_axis_chem_shift_offset 0.14
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
37 THR 9.15 6.63 0
42 VAL 5.10 0.92 0
18 ASP -1.17 -3.08 0
10 ARG -1.84 -0.58 1
12 PHE -4.97 -0.27 1
13 ARG -3.66 -1.52 1
14 VAL -4.47 -1.89 1
15 SER -3.47 -0.52 1
16 ASN -0.57 -1.24 1
17 HIS 1.41 3.72 1
19 ARG 6.24 2.05 1
20 SER 1.58 1.53 1
21 SER -2.35 -0.57 1
22 ARG -3.91 -1.38 1
23 ARG -5.96 -2.81 1
25 VAL -5.65 -1.92 1
26 MET -2.97 -2.72 1
27 ALA -5.39 -0.59 1
28 SER -1.50 -0.03 1
29 SER -3.74 -1.40 1
30 LEU 3.84 2.19 1
31 GLN 4.47 3.04 1
32 GLU 1.57 2.14 1
33 LEU 5.24 3.48 1
34 ILE 6.74 5.45 1
35 SER 5.67 4.41 1
36 LYS 2.83 2.92 1
38 LEU 5.32 3.33 1
39 ASP 1.96 2.30 1
40 ALA 2.72 2.28 1
41 LEU -0.37 -0.83 1
43 ILE -1.16 -0.94 1
44 ALA -0.17 0.24 1
45 THR 0.07 -0.14 1
47 LEU 1.03 -0.32 1
48 VAL -6.39 -3.42 1
49 THR -1.96 0.04 1
50 LEU -3.94 -1.64 1
51 VAL -7.58 -5.02 1
52 LEU 2.43 0.06 1
53 GLU 4.41 3.83 1
54 GLU 2.39 2.45 1
55 ASP -2.21 -1.07 1
57 THR 3.87 3.11 1
58 VAL 2.59 1.95 1
59 VAL 1.01 -0.70 1
60 ASP -1.53 -1.20 1
61 THR -6.05 -2.88 1
62 GLU 2.11 1.54 1
63 GLU 4.81 3.81 1
64 PHE 1.84 1.96 1
65 PHE 3.83 3.96 1
66 GLN 3.35 1.82 1
67 THR 0.42 0.73 1
68 LEU 0.99 -0.72 1
70 ASP 2.58 1.43 1
71 ASN 3.62 1.99 1
72 THR 5.48 4.88 1
73 HIS -3.67 -2.09 1
74 PHE -4.93 -0.82 1
75 MET -6.71 -1.61 1
76 ILE -6.79 -3.91 1
77 LEU -3.07 -1.95 1
78 GLU -2.89 -1.29 1
79 LYS 3.56 2.49 1
81 GLN -0.81 -0.95 1
82 LYS -4.29 -1.58 1
83 TRP 3.08 2.54 1
84 MET -3.30 -1.45 1
86 SER 0.66 0.36 1
89 SER 0.01 0.01 1
90 SER -0.25 0.04 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11218_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -7.58
_LACS_plot.Line_1_terminator_val_y_1 4.58
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -1.41
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.35
_LACS_plot.Line_2_terminator_val_x_2 9.15
_LACS_plot.Line_2_terminator_val_y_2 -2.26
_LACS_plot.Y_axis_chem_shift_offset 0.14
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
37 THR 9.15 -2.52 0
42 VAL 5.10 -4.18 0
18 ASP -1.17 -1.91 0
10 ARG -1.84 1.26 1
12 PHE -4.97 4.70 1
13 ARG -3.66 2.14 1
14 VAL -4.47 2.58 1
15 SER -3.47 2.95 1
16 ASN -0.57 -0.67 1
17 HIS 1.41 2.31 1
19 ARG 6.24 -4.19 1
20 SER 1.58 -0.05 1
21 SER -2.35 1.78 1
22 ARG -3.91 2.53 1
23 ARG -5.96 3.15 1
25 VAL -5.65 3.73 1
26 MET -2.97 0.25 1
27 ALA -5.39 4.80 1
28 SER -1.50 1.47 1
29 SER -3.74 2.34 1
30 LEU 3.84 -1.65 1
31 GLN 4.47 -1.43 1
32 GLU 1.57 0.57 1
33 LEU 5.24 -1.76 1
34 ILE 6.74 -1.29 1
35 SER 5.67 -1.26 1
36 LYS 2.83 0.09 1
38 LEU 5.32 -1.99 1
39 ASP 1.96 0.34 1
40 ALA 2.72 -0.44 1
41 LEU -0.37 -0.46 1
43 ILE -1.16 0.22 1
44 ALA -0.17 0.41 1
45 THR 0.07 -0.21 1
47 LEU 1.03 -1.35 1
48 VAL -6.39 2.97 1
49 THR -1.96 2.00 1
50 LEU -3.94 2.30 1
51 VAL -7.58 2.56 1
52 LEU 2.43 -2.37 1
53 GLU 4.41 -0.58 1
54 GLU 2.39 0.06 1
55 ASP -2.21 1.14 1
57 THR 3.87 -0.76 1
58 VAL 2.59 -0.64 1
59 VAL 1.01 -1.71 1
60 ASP -1.53 0.33 1
61 THR -6.05 3.17 1
62 GLU 2.11 -0.57 1
63 GLU 4.81 -1.00 1
64 PHE 1.84 0.12 1
65 PHE 3.83 0.13 1
66 GLN 3.35 -1.53 1
67 THR 0.42 0.31 1
68 LEU 0.99 -1.71 1
70 ASP 2.58 -1.15 1
71 ASN 3.62 -1.63 1
72 THR 5.48 -0.60 1
73 HIS -3.67 1.58 1
74 PHE -4.93 4.11 1
75 MET -6.71 5.10 1
76 ILE -6.79 2.88 1
77 LEU -3.07 1.12 1
78 GLU -2.89 1.60 1
79 LYS 3.56 -1.07 1
81 GLN -0.81 -0.14 1
82 LYS -4.29 2.71 1
83 TRP 3.08 -0.54 1
84 MET -3.30 1.85 1
86 SER 0.66 -0.30 1
89 SER 0.01 0.00 1
90 SER -0.25 0.29 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11218_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -7.58
_LACS_plot.Line_1_terminator_val_y_1 1.02
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.20
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.26
_LACS_plot.Line_2_terminator_val_x_2 9.15
_LACS_plot.Line_2_terminator_val_y_2 -1.01
_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
30 LEU 3.84 -1.63 0
10 ARG -1.84 -0.01 1
12 PHE -4.97 0.26 1
13 ARG -3.66 0.96 1
14 VAL -4.47 1.35 1
15 SER -3.47 1.43 1
16 ASN -0.57 0.24 1
17 HIS 1.41 0.02 1
18 ASP -1.17 -0.14 1
19 ARG 6.24 -0.60 1
20 SER 1.58 -0.17 1
21 SER -2.35 0.26 1
22 ARG -3.91 1.11 1
23 ARG -5.96 0.49 1
25 VAL -5.65 0.41 1
26 MET -2.97 1.08 1
27 ALA -5.39 0.64 1
28 SER -1.50 0.61 1
29 SER -3.74 0.34 1
31 GLN 4.47 -0.59 1
32 GLU 1.57 -0.32 1
33 LEU 5.24 -0.67 1
34 ILE 6.74 -0.96 1
35 SER 5.67 -0.50 1
36 LYS 2.83 -0.12 1
37 THR 9.15 -0.68 1
38 LEU 5.32 -0.44 1
39 ASP 1.96 -0.14 1
40 ALA 2.72 -0.15 1
41 LEU -0.37 0.02 1
42 VAL 5.10 -0.58 1
43 ILE -1.16 -0.03 1
44 ALA -0.17 -0.02 1
45 THR 0.07 -0.07 1
47 LEU 1.03 0.18 1
48 VAL -6.39 1.02 1
49 THR -1.96 0.00 1
50 LEU -3.94 0.74 1
51 VAL -7.58 1.47 1
52 LEU 2.43 0.11 1
53 GLU 4.41 -0.60 1
54 GLU 2.39 -0.22 1
55 ASP -2.21 -0.28 1
57 THR 3.87 -0.73 1
58 VAL 2.59 -0.16 1
59 VAL 1.01 0.23 1
60 ASP -1.53 0.17 1
61 THR -6.05 0.53 1
62 GLU 2.11 0.06 1
63 GLU 4.81 -0.34 1
64 PHE 1.84 0.06 1
65 PHE 3.83 -0.74 1
66 GLN 3.35 -0.43 1
67 THR 0.42 -0.06 1
68 LEU 0.99 -0.12 1
70 ASP 2.58 -0.73 1
71 ASN 3.62 -0.68 1
72 THR 5.48 -0.43 1
73 HIS -3.67 0.79 1
74 PHE -4.93 0.97 1
75 MET -6.71 1.00 1
76 ILE -6.79 0.98 1
77 LEU -3.07 0.49 1
78 GLU -2.89 0.14 1
79 LYS 3.56 -0.35 1
81 GLN -0.81 0.06 1
82 LYS -4.29 0.47 1
83 TRP 3.08 -0.47 1
84 MET -3.30 -0.57 1
86 SER 0.66 -0.38 1
89 SER 0.01 0.03 1
90 SER -0.25 0.03 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11218_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -7.58
_LACS_plot.Line_1_terminator_val_y_1 -2.19
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 0.45
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -0.71
_LACS_plot.Line_2_terminator_val_x_2 9.15
_LACS_plot.Line_2_terminator_val_y_2 2.03
_LACS_plot.Y_axis_chem_shift_offset 0.16
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
72 THR 5.48 -3.33 0
10 ARG -1.84 -2.60 1
12 PHE -4.97 -1.21 1
13 ARG -3.66 -1.10 1
14 VAL -4.47 -1.75 1
15 SER -3.47 -0.68 1
16 ASN -0.57 2.70 1
17 HIS 1.41 0.13 1
18 ASP -1.17 -0.04 1
19 ARG 6.24 -1.69 1
20 SER 1.58 1.14 1
21 SER -2.35 -2.86 1
22 ARG -3.91 -0.04 1
23 ARG -5.96 -1.35 1
25 VAL -5.65 -2.26 1
26 MET -2.97 -0.12 1
27 ALA -5.39 -0.32 1
28 SER -1.50 -1.41 1
29 SER -3.74 -2.07 1
30 LEU 3.84 0.33 1
31 GLN 4.47 2.65 1
32 GLU 1.57 0.61 1
33 LEU 5.24 2.49 1
34 ILE 6.74 0.72 1
35 SER 5.67 3.24 1
36 LYS 2.83 3.72 1
37 THR 9.15 0.93 1
38 LEU 5.32 1.78 1
39 ASP 1.96 2.16 1
40 ALA 2.72 1.28 1
41 LEU -0.37 -2.02 1
42 VAL 5.10 -1.70 1
43 ILE -1.16 -0.24 1
44 ALA -0.17 -0.26 1
45 THR 0.07 -1.16 1
47 LEU 1.03 -1.44 1
48 VAL -6.39 -0.98 1
49 THR -1.96 -3.42 1
50 LEU -3.94 -2.56 1
51 VAL -7.58 0.54 1
52 LEU 2.43 0.01 1
53 GLU 4.41 2.05 1
54 GLU 2.39 0.83 1
55 ASP -2.21 -0.84 1
57 THR 3.87 -0.28 1
58 VAL 2.59 -1.30 1
59 VAL 1.01 -2.05 1
60 ASP -1.53 -0.25 1
61 THR -6.05 -0.46 1
62 GLU 2.11 2.09 1
63 GLU 4.81 2.25 1
64 PHE 1.84 3.51 1
65 PHE 3.83 0.80 1
66 GLN 3.35 0.95 1
67 THR 0.42 0.21 1
68 LEU 0.99 0.53 1
70 ASP 2.58 0.37 1
71 ASN 3.62 -0.60 1
73 HIS -3.67 0.94 1
74 PHE -4.93 -0.92 1
75 MET -6.71 -2.72 1
76 ILE -6.79 -3.38 1
77 LEU -3.07 -0.12 1
78 GLU -2.89 -0.80 1
79 LYS 3.56 1.08 1
81 GLN -0.81 -0.98 1
82 LYS -4.29 -1.18 1
83 TRP 3.08 -1.38 1
84 MET -3.30 -2.78 1
86 SER 0.66 0.18 1
89 SER 0.01 0.08 1
90 SER -0.25 -0.66 1
stop_
save_