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 bmr4401_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -7.53
_LACS_plot.Line_1_terminator_val_y_1 -3.72
_LACS_plot.Line_1_terminator_val_x_2 1.99
_LACS_plot.Line_1_terminator_val_y_2 1.25
_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 6.86
_LACS_plot.Line_2_terminator_val_y_2 5.37
_LACS_plot.Y_axis_chem_shift_offset -0.29
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
72 THR -7.53 -3.51 0
30 ASP 0.41 -1.83 0
10 ALA 3.75 3.03 1
11 ARG 4.11 3.69 1
12 ALA 1.90 1.28 1
13 PHE 0.14 1.60 1
14 LEU -4.24 -1.37 1
15 SER -3.77 -1.88 1
16 GLU 3.99 3.59 1
17 GLU 4.20 3.53 1
19 ILE 6.87 5.96 1
20 ALA 4.02 2.84 1
21 GLU 2.49 1.68 1
22 PHE 4.67 2.86 1
23 LYS 4.21 2.36 1
24 ALA 3.92 2.57 1
25 ALA 2.01 1.37 1
26 PHE 4.56 4.79 1
27 ASP 4.07 3.00 1
31 ALA 2.22 2.56 1
32 ASP -0.15 -1.30 1
36 ASP -1.74 -1.48 1
37 ILE -2.11 -0.92 1
38 SER -5.08 -2.26 1
39 THR 6.83 5.46 1
40 LYS 1.31 3.35 1
41 GLU 2.49 2.43 1
42 LEU 2.69 2.93 1
44 THR 6.11 5.42 1
45 VAL 5.77 4.42 1
47 ARG 4.08 3.18 1
48 MET 3.97 3.58 1
49 LEU 0.32 -0.32 1
51 GLN -3.10 -1.54 1
52 ASN -0.50 -0.01 1
54 THR -3.10 -1.22 1
55 LYS 4.76 4.16 1
56 GLU 4.95 4.00 1
58 LEU 3.23 3.18 1
59 ASP 4.37 3.27 1
60 ALA 3.25 2.57 1
61 ILE 4.94 4.31 1
62 ILE 5.55 4.29 1
63 GLU 2.76 2.79 1
65 VAL -1.41 -1.14 1
66 ASP -0.28 -0.44 1
67 GLU 0.89 2.76 1
68 ASP -0.92 -1.65 1
70 SER 0.73 1.95 1
73 ILE -2.46 -0.54 1
74 ASP -1.14 -0.90 1
75 PHE 4.99 4.00 1
76 GLU 4.12 2.52 1
77 GLU 1.49 1.48 1
78 PHE 3.15 3.64 1
79 LEU 4.37 3.06 1
80 VAL 6.78 5.08 1
81 MET 3.46 4.03 1
82 MET 1.23 0.83 1
83 VAL 6.42 5.05 1
84 ARG 2.84 2.06 1
86 MET 6.79 4.00 1
87 LYS 1.75 1.84 1
88 GLU 0.42 0.82 1
89 ASP 0.03 0.44 1
90 ALA 0.59 1.66 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr4401_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -7.53
_LACS_plot.Line_1_terminator_val_y_1 3.81
_LACS_plot.Line_1_terminator_val_x_2 1.99
_LACS_plot.Line_1_terminator_val_y_2 -0.74
_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 6.86
_LACS_plot.Line_2_terminator_val_y_2 -1.49
_LACS_plot.Y_axis_chem_shift_offset -0.29
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
72 THR -7.53 4.02 0
30 ASP 0.41 -2.24 0
10 ALA 3.75 -0.72 1
11 ARG 4.11 -0.42 1
12 ALA 1.90 -0.62 1
13 PHE 0.14 1.46 1
14 LEU -4.24 2.87 1
15 SER -3.77 1.89 1
16 GLU 3.99 -0.40 1
17 GLU 4.20 -0.67 1
19 ILE 6.87 -0.91 1
20 ALA 4.02 -1.18 1
21 GLU 2.49 -0.81 1
22 PHE 4.67 -1.81 1
23 LYS 4.21 -1.85 1
24 ALA 3.92 -1.35 1
25 ALA 2.01 -0.64 1
26 PHE 4.56 0.23 1
27 ASP 4.07 -1.07 1
31 ALA 2.22 0.34 1
32 ASP -0.15 -1.15 1
36 ASP -1.74 0.26 1
37 ILE -2.11 1.19 1
38 SER -5.08 2.82 1
39 THR 6.83 -1.37 1
40 LYS 1.31 2.04 1
41 GLU 2.49 -0.06 1
42 LEU 2.69 0.24 1
44 THR 6.11 -0.69 1
45 VAL 5.77 -1.35 1
47 ARG 4.08 -0.90 1
48 MET 3.97 -0.39 1
49 LEU 0.32 -0.64 1
51 GLN -3.10 1.56 1
52 ASN -0.50 0.49 1
54 THR -3.10 1.88 1
55 LYS 4.76 -0.60 1
56 GLU 4.95 -0.95 1
58 LEU 3.23 -0.05 1
59 ASP 4.37 -1.10 1
60 ALA 3.25 -0.68 1
61 ILE 4.94 -0.63 1
62 ILE 5.55 -1.26 1
63 GLU 2.76 0.03 1
65 VAL -1.41 0.27 1
66 ASP -0.28 -0.16 1
67 GLU 0.89 1.87 1
68 ASP -0.92 -0.73 1
70 SER 0.73 1.22 1
73 ILE -2.46 1.92 1
74 ASP -1.14 0.24 1
75 PHE 4.99 -0.99 1
76 GLU 4.12 -1.60 1
77 GLU 1.49 -0.01 1
78 PHE 3.15 0.49 1
79 LEU 4.37 -1.31 1
80 VAL 6.78 -1.70 1
81 MET 3.46 0.57 1
82 MET 1.23 -0.40 1
83 VAL 6.42 -1.37 1
84 ARG 2.84 -0.78 1
86 MET 6.79 -2.79 1
87 LYS 1.75 0.09 1
88 GLU 0.42 0.40 1
89 ASP 0.03 0.41 1
90 ALA 0.59 1.07 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr4401_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -7.53
_LACS_plot.Line_1_terminator_val_y_1 0.55
_LACS_plot.Line_1_terminator_val_x_2 1.99
_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 0.10
_LACS_plot.Line_2_terminator_val_x_2 6.86
_LACS_plot.Line_2_terminator_val_y_2 -0.56
_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
72 THR -7.53 0.56 0
26 PHE 4.56 -1.40 0
10 ALA 3.75 -0.20 1
11 ARG 4.11 -0.48 1
12 ALA 1.90 -0.09 1
13 PHE 0.14 -0.18 1
14 LEU -4.24 0.22 1
15 SER -3.77 0.15 1
16 GLU 3.99 -0.33 1
17 GLU 4.20 -0.23 1
19 ILE 6.87 -0.42 1
20 ALA 4.02 -0.07 1
21 GLU 2.49 -0.19 1
22 PHE 4.67 0.39 1
23 LYS 4.21 -0.33 1
24 ALA 3.92 -0.07 1
25 ALA 2.01 -0.23 1
27 ASP 4.07 -0.42 1
30 ASP 0.41 -0.13 1
31 ALA 2.22 -0.23 1
32 ASP -0.15 -0.01 1
36 ASP -1.74 0.50 1
37 ILE -2.11 0.78 1
38 SER -5.08 0.37 1
39 THR 6.83 -0.52 1
40 LYS 1.31 -0.18 1
41 GLU 2.49 -0.22 1
42 LEU 2.69 -0.33 1
44 THR 6.11 -0.43 1
45 VAL 5.77 -0.54 1
47 ARG 4.08 0.38 1
48 MET 3.97 -0.23 1
49 LEU 0.32 0.05 1
51 GLN -3.10 0.17 1
52 ASN -0.50 0.11 1
54 THR -3.10 0.11 1
55 LYS 4.76 -0.42 1
56 GLU 4.95 -0.24 1
58 LEU 3.23 -0.34 1
59 ASP 4.37 -0.32 1
60 ALA 3.25 -0.15 1
61 ILE 4.94 -0.50 1
62 ILE 5.55 -0.75 1
63 GLU 2.76 -0.35 1
65 VAL -1.41 0.48 1
66 ASP -0.28 0.07 1
67 GLU 0.89 -0.12 1
68 ASP -0.92 0.12 1
70 SER 0.73 -0.24 1
73 ILE -2.46 0.92 1
74 ASP -1.14 0.64 1
75 PHE 4.99 -1.15 1
76 GLU 4.12 -0.56 1
77 GLU 1.49 -0.20 1
78 PHE 3.15 -0.62 1
79 LEU 4.37 -0.90 1
80 VAL 6.78 -0.85 1
81 MET 3.46 -0.79 1
82 MET 1.23 -0.40 1
83 VAL 6.42 -0.47 1
84 ARG 2.84 -0.31 1
86 MET 6.79 -0.47 1
87 LYS 1.75 -0.16 1
88 GLU 0.42 -0.12 1
89 ASP 0.03 0.01 1
90 ALA 0.59 -0.19 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr4401_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -7.53
_LACS_plot.Line_1_terminator_val_y_1 -1.64
_LACS_plot.Line_1_terminator_val_x_2 1.99
_LACS_plot.Line_1_terminator_val_y_2 1.31
_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 6.86
_LACS_plot.Line_2_terminator_val_y_2 2.61
_LACS_plot.Y_axis_chem_shift_offset -0.68
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
90 ALA 0.59 -7.26 0
10 ALA 3.75 1.33 1
11 ARG 4.11 1.73 1
12 ALA 1.90 0.78 1
13 PHE 0.14 -0.18 1
14 LEU -4.24 -1.62 1
15 SER -3.77 0.72 1
16 GLU 3.99 3.04 1
17 GLU 4.20 2.55 1
19 ILE 6.87 1.23 1
20 ALA 4.02 2.46 1
21 GLU 2.49 2.22 1
22 PHE 4.67 2.85 1
23 LYS 4.21 0.62 1
26 PHE 4.56 0.91 1
27 ASP 4.07 1.62 1
30 ASP 0.41 0.34 1
31 ALA 2.22 1.30 1
32 ASP -0.15 1.49 1
36 ASP -1.74 -3.13 1
37 ILE -2.11 -0.59 1
38 SER -5.08 1.16 1
39 THR 6.83 2.36 1
40 LYS 1.31 3.43 1
41 GLU 2.49 3.14 1
42 LEU 2.69 1.17 1
44 THR 6.11 1.84 1
45 VAL 5.77 1.28 1
47 ARG 4.08 4.90 1
48 MET 3.97 2.34 1
49 LEU 0.32 -0.30 1
51 GLN -3.10 -1.78 1
52 ASN -0.50 -1.44 1
54 THR -3.10 0.58 1
55 LYS 4.76 1.74 1
56 GLU 4.95 3.49 1
58 LEU 3.23 0.96 1
59 ASP 4.37 2.70 1
60 ALA 3.25 2.47 1
61 ILE 4.94 1.89 1
62 ILE 5.55 1.36 1
63 GLU 2.76 1.69 1
65 VAL -1.41 -0.45 1
66 ASP -0.28 1.01 1
67 GLU 0.89 0.36 1
68 ASP -0.92 1.39 1
70 SER 0.73 1.65 1
72 THR -7.53 -1.08 1
73 ILE -2.46 -0.09 1
74 ASP -1.14 -0.46 1
75 PHE 4.99 0.67 1
76 GLU 4.12 3.70 1
77 GLU 1.49 2.20 1
78 PHE 3.15 1.51 1
79 LEU 4.37 1.55 1
80 VAL 6.78 1.88 1
81 MET 3.46 2.01 1
82 MET 1.23 2.86 1
83 VAL 6.42 1.87 1
84 ARG 2.84 2.41 1
86 MET 6.79 3.07 1
87 LYS 1.75 0.72 1
88 GLU 0.42 -0.01 1
89 ASP 0.03 -1.28 1
stop_
save_