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 bmr19792_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -9.18
_LACS_plot.Line_1_terminator_val_y_1 -6.50
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -2.02
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -4.06
_LACS_plot.Line_2_terminator_val_x_2 6.22
_LACS_plot.Line_2_terminator_val_y_2 1.90
_LACS_plot.Y_axis_chem_shift_offset 2.71
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
54 ALA -9.18 -5.45 0
11 LYS -1.74 -2.78 1
12 LEU -4.48 -4.80 1
13 PHE -2.58 -3.66 1
14 ILE -3.34 -5.69 1
17 LEU -1.29 -3.52 1
18 ASN 0.41 -2.80 1
19 THR 5.07 0.71 1
20 GLU -0.60 -3.42 1
21 THR 4.48 0.08 1
22 ASN -3.86 -5.39 1
23 GLU 6.22 2.18 1
24 LYS 3.26 -0.47 1
25 ALA 2.33 -0.63 1
26 LEU 2.56 -0.14 1
27 GLU 3.30 0.47 1
28 ALA 3.10 -0.59 1
29 VAL 2.82 -0.20 1
30 PHE 6.14 1.93 1
32 LYS 2.67 -1.50 1
33 TYR 1.78 -1.29 1
35 ARG 1.72 -1.22 1
36 ILE -1.57 -3.36 1
37 VAL -0.33 -2.85 1
38 GLU -4.17 -2.96 1
39 VAL -1.32 -3.14 1
40 LEU -4.03 -4.36 1
41 LEU -3.37 -4.22 1
42 MET 1.66 -3.54 1
43 LYS -4.94 -4.59 1
44 ASP -2.00 -2.92 1
45 ARG 3.00 -0.36 1
46 GLU 1.33 -0.97 1
47 THR -1.26 -3.09 1
48 ASN 2.28 -0.97 1
49 LYS -1.38 -3.44 1
50 SER -0.41 -2.69 1
51 ARG -0.49 -2.61 1
53 PHE -4.92 -5.61 1
55 PHE -5.05 -4.62 1
56 VAL -3.98 -4.35 1
57 THR 0.00 -3.14 1
58 PHE -0.56 -2.25 1
59 GLU 1.80 -0.31 1
60 SER -4.31 -6.26 1
62 ALA 3.25 -0.23 1
63 ASP 3.34 -0.39 1
64 ALA 2.44 -1.10 1
65 LYS 4.40 0.48 1
66 ASP 3.61 0.23 1
67 ALA 0.65 -1.20 1
68 ALA 4.03 -0.22 1
69 ARG 3.38 -0.27 1
70 ASP 0.37 -0.89 1
71 MET -1.17 -5.02 1
72 ASN 3.75 0.73 1
74 LYS -0.90 -3.87 1
75 SER -1.02 -3.58 1
76 LEU -2.82 -3.33 1
77 ASP 3.37 -1.32 1
79 LYS -4.77 -5.92 1
80 ALA -0.23 -4.12 1
81 ILE -1.93 -3.18 1
82 LYS -3.71 -4.86 1
83 VAL -3.33 -4.25 1
84 GLU -7.09 -5.30 1
85 GLN 1.44 -1.44 1
86 ALA 0.28 -2.48 1
87 THR -1.18 -3.58 1
88 LYS 0.14 -2.59 1
90 SER -0.46 -3.28 1
91 PHE -0.64 -3.23 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr19792_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -9.18
_LACS_plot.Line_1_terminator_val_y_1 2.68
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -4.02
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -2.06
_LACS_plot.Line_2_terminator_val_x_2 6.22
_LACS_plot.Line_2_terminator_val_y_2 -4.32
_LACS_plot.Y_axis_chem_shift_offset 2.71
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
54 ALA -9.18 3.73 0
11 LYS -1.74 -1.04 1
12 LEU -4.48 -0.32 1
13 PHE -2.58 -1.08 1
14 ILE -3.34 -2.35 1
17 LEU -1.29 -2.23 1
18 ASN 0.41 -3.21 1
19 THR 5.07 -4.36 1
20 GLU -0.60 -2.82 1
21 THR 4.48 -4.40 1
22 ASN -3.86 -1.53 1
23 GLU 6.22 -4.04 1
24 LYS 3.26 -3.73 1
25 ALA 2.33 -2.96 1
26 LEU 2.56 -2.70 1
27 GLU 3.30 -2.83 1
28 ALA 3.10 -3.69 1
29 VAL 2.82 -3.02 1
30 PHE 6.14 -4.21 1
32 LYS 2.67 -4.17 1
33 TYR 1.78 -3.07 1
35 ARG 1.72 -2.94 1
36 ILE -1.57 -1.79 1
37 VAL -0.33 -2.52 1
38 GLU -4.17 1.21 1
39 VAL -1.32 -1.82 1
40 LEU -4.03 -0.33 1
41 LEU -3.37 -0.85 1
42 MET 1.66 -5.20 1
43 LYS -4.94 0.35 1
44 ASP -2.00 -0.92 1
45 ARG 3.00 -3.36 1
46 GLU 1.33 -2.30 1
47 THR -1.26 -1.83 1
48 ASN 2.28 -3.25 1
49 LYS -1.38 -2.06 1
50 SER -0.41 -2.28 1
51 ARG -0.49 -2.12 1
53 PHE -4.92 -0.69 1
55 PHE -5.05 0.43 1
56 VAL -3.98 -0.37 1
57 THR 0.00 -3.14 1
58 PHE -0.56 -1.69 1
59 GLU 1.80 -2.11 1
60 SER -4.31 -1.95 1
62 ALA 3.25 -3.48 1
63 ASP 3.34 -3.73 1
64 ALA 2.44 -3.54 1
65 LYS 4.40 -3.92 1
66 ASP 3.61 -3.38 1
67 ALA 0.65 -1.85 1
68 ALA 4.03 -4.25 1
69 ARG 3.38 -3.65 1
70 ASP 0.37 -1.26 1
71 MET -1.17 -3.85 1
72 ASN 3.75 -3.02 1
74 LYS -0.90 -2.97 1
75 SER -1.02 -2.56 1
76 LEU -2.82 -0.51 1
77 ASP 3.37 -4.69 1
79 LYS -4.77 -1.15 1
80 ALA -0.23 -3.89 1
81 ILE -1.93 -1.25 1
82 LYS -3.71 -1.15 1
83 VAL -3.33 -0.92 1
84 GLU -7.09 1.79 1
85 GLN 1.44 -2.88 1
86 ALA 0.28 -2.76 1
87 THR -1.18 -2.40 1
88 LYS 0.14 -2.73 1
90 SER -0.46 -2.82 1
91 PHE -0.64 -2.59 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr19792_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -9.18
_LACS_plot.Line_1_terminator_val_y_1 0.77
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.29
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.12
_LACS_plot.Line_2_terminator_val_x_2 6.22
_LACS_plot.Line_2_terminator_val_y_2 -0.73
_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
67 ALA 0.65 -2.16 0
11 LYS -1.74 0.54 1
12 LEU -4.48 0.60 1
13 PHE -2.58 0.09 1
14 ILE -3.34 0.65 1
17 LEU -1.29 -0.43 1
18 ASN 0.41 -0.35 1
19 THR 5.07 -0.65 1
20 GLU -0.60 -0.17 1
21 THR 4.48 -0.42 1
22 ASN -3.86 0.03 1
23 GLU 6.22 -0.78 1
24 LYS 3.26 -0.32 1
25 ALA 2.33 -0.15 1
26 LEU 2.56 -0.32 1
27 GLU 3.30 -0.76 1
28 ALA 3.10 -0.28 1
29 VAL 2.82 -0.29 1
30 PHE 6.14 -0.14 1
32 LYS 2.67 -0.39 1
33 TYR 1.78 -0.43 1
35 ARG 1.72 -0.22 1
36 ILE -1.57 -0.34 1
37 VAL -0.33 -0.04 1
38 GLU -4.17 0.02 1
39 VAL -1.32 0.20 1
40 LEU -4.03 0.33 1
41 LEU -3.37 0.00 1
42 MET 1.66 -0.12 1
43 LYS -4.94 0.44 1
44 ASP -2.00 -0.17 1
45 ARG 3.00 -0.36 1
46 GLU 1.33 -0.17 1
47 THR -1.26 -0.07 1
48 ASN 2.28 -0.41 1
49 LYS -1.38 -0.02 1
50 SER -0.41 -0.27 1
51 ARG -0.49 -0.03 1
53 PHE -4.92 0.62 1
54 ALA -9.18 0.57 1
55 PHE -5.05 1.15 1
56 VAL -3.98 0.35 1
57 THR 0.00 0.62 1
58 PHE -0.56 0.06 1
59 GLU 1.80 -0.58 1
60 SER -4.31 0.38 1
62 ALA 3.25 -0.39 1
63 ASP 3.34 -0.55 1
64 ALA 2.44 -1.18 1
65 LYS 4.40 -0.59 1
66 ASP 3.61 -0.46 1
68 ALA 4.03 -0.62 1
69 ARG 3.38 -0.41 1
70 ASP 0.37 -0.09 1
71 MET -1.17 0.26 1
72 ASN 3.75 -0.46 1
74 LYS -0.90 -0.08 1
75 SER -1.02 0.47 1
76 LEU -2.82 0.10 1
77 ASP 3.37 -0.47 1
79 LYS -4.77 0.23 1
80 ALA -0.23 0.05 1
81 ILE -1.93 0.44 1
82 LYS -3.71 0.53 1
83 VAL -3.33 0.95 1
84 GLU -7.09 0.33 1
85 GLN 1.44 -0.09 1
86 ALA 0.28 0.11 1
87 THR -1.18 -0.01 1
88 LYS 0.14 -0.14 1
90 SER -0.46 -0.24 1
91 PHE -0.64 -0.09 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr19792_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -9.18
_LACS_plot.Line_1_terminator_val_y_1 -6.30
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -1.91
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -3.49
_LACS_plot.Line_2_terminator_val_x_2 6.14
_LACS_plot.Line_2_terminator_val_y_2 -0.33
_LACS_plot.Y_axis_chem_shift_offset 2.70
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
18 ASN 0.41 1.00 0
54 ALA -9.18 -6.74 0
11 LYS -1.74 -4.18 1
12 LEU -4.48 -4.41 1
13 PHE -2.58 -5.47 1
14 ILE -3.34 -4.96 1
17 LEU -1.29 -1.58 1
19 THR 5.07 -2.51 1
20 GLU -0.60 -1.77 1
21 THR 4.48 -3.01 1
22 ASN -3.86 -3.17 1
24 LYS 3.26 0.24 1
25 ALA 2.33 0.25 1
26 LEU 2.56 -1.22 1
27 GLU 3.30 -0.39 1
28 ALA 3.10 -0.29 1
29 VAL 2.82 -1.30 1
30 PHE 6.14 -1.08 1
32 LYS 2.67 -1.82 1
33 TYR 1.78 -3.96 1
35 ARG 1.72 -2.03 1
36 ILE -1.57 -2.68 1
37 VAL -0.33 -3.38 1
38 GLU -4.17 -5.95 1
39 VAL -1.32 -5.61 1
40 LEU -4.03 -5.97 1
41 LEU -3.37 -4.66 1
42 MET 1.66 -3.69 1
43 LYS -4.94 -3.01 1
44 ASP -2.00 -1.51 1
45 ARG 3.00 -1.72 1
46 GLU 1.33 -0.98 1
47 THR -1.26 -1.46 1
48 ASN 2.28 -4.09 1
49 LYS -1.38 -2.69 1
50 SER -0.41 -1.18 1
51 ARG -0.49 -1.64 1
53 PHE -4.92 -6.25 1
55 PHE -5.05 -2.20 1
56 VAL -3.98 -4.90 1
57 THR 0.00 -3.36 1
58 PHE -0.56 -3.43 1
59 GLU 1.80 -2.93 1
62 ALA 3.25 -0.97 1
63 ASP 3.34 -1.80 1
64 ALA 2.44 -1.76 1
65 LYS 4.40 0.12 1
66 ASP 3.61 -1.19 1
67 ALA 0.65 -1.35 1
68 ALA 4.03 -1.18 1
69 ARG 3.38 -0.44 1
70 ASP 0.37 -1.43 1
71 MET -1.17 -1.13 1
72 ASN 3.75 -1.39 1
74 LYS -0.90 -4.47 1
75 SER -1.02 -2.76 1
76 LEU -2.82 -3.75 1
77 ASP 3.37 -2.89 1
79 LYS -4.77 -5.09 1
80 ALA -0.23 -2.79 1
81 ILE -1.93 -4.01 1
82 LYS -3.71 -4.03 1
83 VAL -3.33 -4.47 1
84 GLU -7.09 -4.46 1
85 GLN 1.44 -2.74 1
86 ALA 0.28 -3.31 1
87 THR -1.18 -3.37 1
90 SER -0.46 -3.48 1
91 PHE -0.64 -4.00 1
stop_
save_