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 bmr10088_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -6.84
_LACS_plot.Line_1_terminator_val_y_1 -2.58
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 0.81
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.42
_LACS_plot.Line_2_terminator_val_x_2 6.16
_LACS_plot.Line_2_terminator_val_y_2 4.65
_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
52 HIS 1.13 4.01 0
76 HIS 6.12 6.24 0
10 VAL -2.24 -1.39 1
11 ALA -4.99 -1.80 1
13 LEU -4.43 -1.70 1
14 ALA -2.09 -1.47 1
15 ARG 1.30 1.01 1
16 SER -2.93 -1.20 1
17 GLU 3.01 2.30 1
18 ARG 0.64 0.10 1
20 LEU 0.50 1.44 1
22 PHE -2.69 -1.41 1
23 SER -3.71 -1.70 1
24 ILE -6.16 -2.58 1
25 ALA -6.81 -1.72 1
28 LYS 2.52 2.08 1
30 SER -3.30 -2.01 1
31 THR 1.64 1.58 1
33 TYR 0.60 1.85 1
34 ARG -4.91 -2.58 1
35 ALA 2.49 1.38 1
37 ASP -4.27 -0.93 1
38 ALA -0.34 -0.32 1
40 ILE -0.33 -1.22 1
41 PHE -6.84 -2.56 1
42 VAL 2.57 1.22 1
43 SER -1.50 0.09 1
44 ARG -2.74 0.45 1
45 ILE -2.43 -0.35 1
46 ALA -0.55 -0.51 1
47 GLU 2.45 1.60 1
50 ALA 3.53 3.01 1
51 ALA 2.50 2.33 1
53 ARG 3.00 2.38 1
54 ALA 1.48 1.61 1
56 THR 0.05 -0.30 1
57 LEU -4.00 -0.40 1
58 GLN -4.41 -1.63 1
59 VAL 4.99 3.26 1
61 ASP 1.24 1.60 1
62 ARG -2.99 -0.93 1
63 VAL 1.65 0.09 1
64 LEU 0.62 0.45 1
65 SER -3.37 -1.38 1
66 ILE -2.29 -0.46 1
67 ASN 3.11 1.02 1
69 VAL 1.00 0.07 1
70 ASP 0.60 0.95 1
71 VAL -0.26 -2.12 1
72 THR 4.60 4.37 1
73 GLU -2.30 -2.12 1
74 ALA -2.61 -0.94 1
75 ARG -0.80 0.39 1
77 ASP 4.83 2.65 1
78 HIS 0.30 2.86 1
79 ALA 4.29 3.28 1
80 VAL 6.17 4.97 1
81 SER 4.89 3.70 1
82 LEU 2.53 2.36 1
83 LEU 1.89 1.59 1
84 THR -0.08 -0.25 1
85 ALA -0.34 -0.09 1
86 ALA 1.41 0.16 1
87 SER -0.84 -0.21 1
89 THR -4.50 -2.10 1
90 ILE -3.13 -1.79 1
91 ALA -3.26 -2.11 1
92 LEU -4.26 -1.63 1
93 LEU -1.39 -0.32 1
94 LEU -5.33 -2.19 1
95 GLU -5.72 -1.48 1
96 ARG -3.95 -0.85 1
97 GLU -0.83 -0.06 1
98 ALA -0.06 0.27 1
103 SER -0.03 0.10 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr10088_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -6.84
_LACS_plot.Line_1_terminator_val_y_1 4.26
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -1.19
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.58
_LACS_plot.Line_2_terminator_val_x_2 6.16
_LACS_plot.Line_2_terminator_val_y_2 -1.51
_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
52 HIS 1.13 2.88 0
76 HIS 6.12 0.12 0
10 VAL -2.24 0.85 1
11 ALA -4.99 3.19 1
13 LEU -4.43 2.73 1
14 ALA -2.09 0.62 1
15 ARG 1.30 -0.29 1
16 SER -2.93 1.73 1
17 GLU 3.01 -0.71 1
18 ARG 0.64 -0.54 1
20 LEU 0.50 0.94 1
22 PHE -2.69 1.28 1
23 SER -3.71 2.01 1
24 ILE -6.16 3.58 1
25 ALA -6.81 5.09 1
28 LYS 2.52 -0.44 1
30 SER -3.30 1.29 1
31 THR 1.64 -0.06 1
33 TYR 0.60 1.25 1
34 ARG -4.91 2.33 1
35 ALA 2.49 -1.11 1
37 ASP -4.27 3.34 1
38 ALA -0.34 0.02 1
40 ILE -0.33 -0.89 1
41 PHE -6.84 4.28 1
42 VAL 2.57 -1.35 1
43 SER -1.50 1.59 1
44 ARG -2.74 3.19 1
45 ILE -2.43 2.08 1
46 ALA -0.55 0.04 1
47 GLU 2.45 -0.85 1
50 ALA 3.53 -0.52 1
51 ALA 2.50 -0.17 1
53 ARG 3.00 -0.62 1
54 ALA 1.48 0.13 1
56 THR 0.05 -0.35 1
57 LEU -4.00 3.60 1
58 GLN -4.41 2.78 1
59 VAL 4.99 -1.73 1
61 ASP 1.24 0.36 1
62 ARG -2.99 2.06 1
63 VAL 1.65 -1.56 1
64 LEU 0.62 -0.17 1
65 SER -3.37 1.99 1
66 ILE -2.29 1.83 1
67 ASN 3.11 -2.09 1
69 VAL 1.00 -0.93 1
70 ASP 0.60 0.35 1
71 VAL -0.26 -1.86 1
72 THR 4.60 -0.23 1
73 GLU -2.30 0.18 1
74 ALA -2.61 1.67 1
75 ARG -0.80 1.19 1
77 ASP 4.83 -2.18 1
78 HIS 0.30 2.56 1
79 ALA 4.29 -1.01 1
80 VAL 6.17 -1.20 1
81 SER 4.89 -1.19 1
82 LEU 2.53 -0.17 1
83 LEU 1.89 -0.30 1
84 THR -0.08 -0.17 1
85 ALA -0.34 0.25 1
86 ALA 1.41 -1.25 1
87 SER -0.84 0.63 1
89 THR -4.50 2.40 1
90 ILE -3.13 1.34 1
91 ALA -3.26 1.15 1
92 LEU -4.26 2.63 1
93 LEU -1.39 1.07 1
94 LEU -5.33 3.14 1
95 GLU -5.72 4.24 1
96 ARG -3.95 3.10 1
97 GLU -0.83 0.77 1
98 ALA -0.06 0.33 1
103 SER -0.03 0.13 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr10088_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -6.84
_LACS_plot.Line_1_terminator_val_y_1 0.79
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.15
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.28
_LACS_plot.Line_2_terminator_val_x_2 6.16
_LACS_plot.Line_2_terminator_val_y_2 -0.64
_LACS_plot.Y_axis_chem_shift_offset -0.06
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
24 ILE -6.16 1.44 0
34 ARG -4.91 -0.12 0
10 VAL -2.24 0.88 1
11 ALA -4.99 0.42 1
13 LEU -4.43 0.42 1
14 ALA -2.09 0.42 1
15 ARG 1.30 -0.26 1
16 SER -2.93 0.34 1
17 GLU 3.01 -0.11 1
18 ARG 0.64 0.05 1
20 LEU 0.50 -0.02 1
22 PHE -2.69 0.74 1
23 SER -3.71 0.39 1
25 ALA -6.81 0.60 1
28 LYS 2.52 -0.03 1
30 SER -3.30 0.27 1
31 THR 1.64 -0.19 1
33 TYR 0.60 -0.34 1
35 ALA 2.49 -0.33 1
37 ASP -4.27 0.31 1
38 ALA -0.34 0.48 1
40 ILE -0.33 0.51 1
41 PHE -6.84 0.83 1
42 VAL 2.57 0.12 1
43 SER -1.50 0.16 1
44 ARG -2.74 0.11 1
45 ILE -2.43 0.28 1
46 ALA -0.55 -0.02 1
47 GLU 2.45 -0.81 1
50 ALA 3.53 -0.23 1
51 ALA 2.50 -0.18 1
52 HIS 1.13 -0.49 1
53 ARG 3.00 -0.42 1
54 ALA 1.48 -0.07 1
56 THR 0.05 -0.12 1
57 LEU -4.00 0.14 1
58 GLN -4.41 0.09 1
59 VAL 4.99 -0.76 1
61 ASP 1.24 0.05 1
62 ARG -2.99 -0.22 1
63 VAL 1.65 -0.17 1
64 LEU 0.62 0.02 1
65 SER -3.37 0.91 1
66 ILE -2.29 0.32 1
67 ASN 3.11 -0.16 1
69 VAL 1.00 -0.11 1
70 ASP 0.60 -0.08 1
71 VAL -0.26 0.62 1
72 THR 4.60 -0.19 1
73 GLU -2.30 0.37 1
74 ALA -2.61 0.25 1
75 ARG -0.80 0.28 1
76 HIS 6.12 -0.84 1
77 ASP 4.83 -0.37 1
78 HIS 0.30 -0.13 1
79 ALA 4.29 -0.56 1
80 VAL 6.17 -0.73 1
81 SER 4.89 -0.31 1
82 LEU 2.53 -0.24 1
83 LEU 1.89 -0.26 1
84 THR -0.08 -0.02 1
85 ALA -0.34 -0.05 1
86 ALA 1.41 -0.07 1
89 THR -4.50 0.65 1
90 ILE -3.13 0.52 1
91 ALA -3.26 0.93 1
92 LEU -4.26 0.84 1
93 LEU -1.39 0.58 1
94 LEU -5.33 1.18 1
95 GLU -5.72 0.70 1
96 ARG -3.95 0.51 1
97 GLU -0.83 0.10 1
98 ALA -0.06 0.05 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr10088_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -6.84
_LACS_plot.Line_1_terminator_val_y_1 -2.43
_LACS_plot.Line_1_terminator_val_x_2 2.00
_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 -0.80
_LACS_plot.Line_2_terminator_val_x_2 6.16
_LACS_plot.Line_2_terminator_val_y_2 2.46
_LACS_plot.Y_axis_chem_shift_offset -0.01
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
52 HIS 1.13 3.77 0
41 PHE -6.84 0.43 0
10 VAL -2.24 -0.33 1
11 ALA -4.99 -2.44 1
13 LEU -4.43 -2.72 1
14 ALA -2.09 -0.83 1
15 ARG 1.30 -0.42 1
16 SER -2.93 1.08 1
17 GLU 3.01 0.66 1
18 ARG 0.64 0.34 1
20 LEU 0.50 0.85 1
22 PHE -2.69 -3.28 1
23 SER -3.71 -1.42 1
24 ILE -6.16 -1.15 1
25 ALA -6.81 -1.84 1
28 LYS 2.52 2.40 1
30 SER -3.30 -0.63 1
31 THR 1.64 -0.35 1
33 TYR 0.60 -0.44 1
34 ARG -4.91 -2.10 1
35 ALA 2.49 1.28 1
37 ASP -4.27 -1.17 1
38 ALA -0.34 0.79 1
40 ILE -0.33 -1.67 1
42 VAL 2.57 -0.77 1
43 SER -1.50 0.74 1
44 ARG -2.74 -2.38 1
45 ILE -2.43 -1.54 1
46 ALA -0.55 0.40 1
47 GLU 2.45 1.53 1
50 ALA 3.53 2.80 1
51 ALA 2.50 1.56 1
53 ARG 3.00 1.72 1
54 ALA 1.48 2.13 1
56 THR 0.05 -1.03 1
57 LEU -4.00 -3.08 1
58 GLN -4.41 -1.09 1
59 VAL 4.99 1.73 1
61 ASP 1.24 -0.92 1
62 ARG -2.99 -0.52 1
63 VAL 1.65 -2.19 1
64 LEU 0.62 0.79 1
65 SER -3.37 -1.61 1
66 ILE -2.29 -1.04 1
67 ASN 3.11 0.02 1
69 VAL 1.00 -1.09 1
70 ASP 0.60 1.52 1
71 VAL -0.26 0.70 1
72 THR 4.60 1.26 1
73 GLU -2.30 -0.90 1
74 ALA -2.61 1.37 1
75 ARG -0.80 1.30 1
76 HIS 6.12 2.33 1
77 ASP 4.83 2.60 1
78 HIS 0.30 3.25 1
79 ALA 4.29 0.78 1
80 VAL 6.17 2.97 1
81 SER 4.89 2.31 1
82 LEU 2.53 1.51 1
83 LEU 1.89 0.08 1
84 THR -0.08 -0.51 1
85 ALA -0.34 -0.73 1
86 ALA 1.41 -0.48 1
87 SER -0.84 0.39 1
89 THR -4.50 -1.39 1
90 ILE -3.13 -3.01 1
91 ALA -3.26 -0.80 1
92 LEU -4.26 -2.54 1
93 LEU -1.39 -2.83 1
94 LEU -5.33 -1.86 1
95 GLU -5.72 -2.29 1
96 ARG -3.95 -0.82 1
97 GLU -0.83 -0.42 1
98 ALA -0.06 0.50 1
103 SER -0.03 0.09 1
stop_
save_