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 bmr7324_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -6.46
_LACS_plot.Line_1_terminator_val_y_1 -3.46
_LACS_plot.Line_1_terminator_val_x_2 1.99
_LACS_plot.Line_1_terminator_val_y_2 1.10
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.53
_LACS_plot.Line_2_terminator_val_x_2 6.44
_LACS_plot.Line_2_terminator_val_y_2 4.97
_LACS_plot.Y_axis_chem_shift_offset -0.02
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
66 TYR 3.98 -0.94 0
57 VAL -4.22 1.52 0
10 SER 1.47 0.94 1
12 ALA -1.18 -0.30 1
15 TYR 2.16 2.78 1
16 LYS 3.62 2.57 1
18 LYS 5.00 3.13 1
19 TYR 4.28 2.69 1
20 LEU 3.73 2.79 1
21 GLN 3.65 2.69 1
22 LEU 4.07 4.04 1
23 LYS 3.15 2.65 1
24 GLU 3.68 3.69 1
25 LYS 2.93 3.01 1
26 LEU 3.69 2.73 1
27 GLU 4.06 3.17 1
28 HIS 0.84 0.92 1
29 GLU -1.67 -1.18 1
30 PHE -3.57 -1.69 1
34 LEU -2.00 -1.68 1
35 ASP -0.21 -0.15 1
36 ILE -4.76 -2.05 1
39 GLU 4.31 3.69 1
41 THR -0.56 -0.28 1
45 THR 0.07 -0.59 1
47 PHE 4.60 4.31 1
48 PHE -5.57 -2.79 1
49 GLU -1.60 -0.75 1
50 VAL -3.03 -2.07 1
51 THR -2.33 -1.05 1
52 VAL 2.58 0.56 1
53 ALA -2.22 -1.58 1
55 LYS 1.17 0.33 1
56 LEU -0.30 0.41 1
58 HIS -2.98 -3.06 1
59 SER 2.52 3.93 1
60 LYS 4.56 2.81 1
61 LYS 0.60 0.04 1
62 ARG 2.55 1.05 1
64 ASP -0.09 -0.61 1
67 VAL -0.71 -1.27 1
68 ASP -6.46 -3.16 1
69 THR 3.69 2.56 1
70 GLU 4.84 3.28 1
71 SER 1.23 3.47 1
72 LYS 5.01 4.34 1
73 PHE 4.76 2.84 1
74 ARG 4.84 3.72 1
75 LYS 3.81 2.99 1
76 LEU 6.45 5.32 1
77 VAL 6.26 5.21 1
78 THR 3.27 2.51 1
79 ALA 6.08 4.71 1
80 ILE 5.37 4.67 1
81 LYS 3.63 2.19 1
82 ALA 2.07 2.02 1
83 ALA 3.27 2.45 1
84 LEU 3.22 1.87 1
85 ALA 2.81 1.82 1
86 GLN 2.18 1.26 1
88 GLN 1.24 0.97 1
89 LEU 0.44 0.31 1
90 GLU 0.45 0.58 1
91 HIS 0.13 0.55 1
92 HIS 0.33 0.55 1
93 HIS 0.12 0.44 1
94 HIS 0.20 0.57 1
95 HIS 1.45 1.96 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr7324_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -6.46
_LACS_plot.Line_1_terminator_val_y_1 3.00
_LACS_plot.Line_1_terminator_val_x_2 1.99
_LACS_plot.Line_1_terminator_val_y_2 -0.89
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.47
_LACS_plot.Line_2_terminator_val_x_2 6.44
_LACS_plot.Line_2_terminator_val_y_2 -1.47
_LACS_plot.Y_axis_chem_shift_offset -0.02
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
66 TYR 3.98 -4.92 0
57 VAL -4.22 5.74 0
10 SER 1.47 -0.53 1
12 ALA -1.18 0.88 1
15 TYR 2.16 0.62 1
16 LYS 3.62 -1.05 1
18 LYS 5.00 -1.87 1
19 TYR 4.28 -1.59 1
20 LEU 3.73 -0.94 1
21 GLN 3.65 -0.96 1
22 LEU 4.07 -0.03 1
23 LYS 3.15 -0.50 1
24 GLU 3.68 0.01 1
25 LYS 2.93 0.08 1
26 LEU 3.69 -0.96 1
27 GLU 4.06 -0.89 1
28 HIS 0.84 0.08 1
29 GLU -1.67 0.49 1
30 PHE -3.57 1.88 1
34 LEU -2.00 0.32 1
35 ASP -0.21 0.06 1
36 ILE -4.76 2.71 1
39 GLU 4.31 -0.62 1
41 THR -0.56 0.28 1
45 THR 0.07 -0.66 1
47 PHE 4.60 -0.29 1
48 PHE -5.57 2.78 1
49 GLU -1.60 0.85 1
50 VAL -3.03 0.96 1
51 THR -2.33 1.28 1
52 VAL 2.58 -2.02 1
53 ALA -2.22 0.64 1
55 LYS 1.17 -0.84 1
56 LEU -0.30 0.71 1
58 HIS -2.98 -0.08 1
59 SER 2.52 1.41 1
60 LYS 4.56 -1.75 1
61 LYS 0.60 -0.56 1
62 ARG 2.55 -1.50 1
64 ASP -0.09 -0.52 1
67 VAL -0.71 -0.56 1
68 ASP -6.46 3.30 1
69 THR 3.69 -1.13 1
70 GLU 4.84 -1.56 1
71 SER 1.23 2.24 1
72 LYS 5.01 -0.67 1
73 PHE 4.76 -1.92 1
74 ARG 4.84 -1.12 1
75 LYS 3.81 -0.82 1
76 LEU 6.45 -1.13 1
77 VAL 6.26 -1.05 1
78 THR 3.27 -0.76 1
79 ALA 6.08 -1.37 1
80 ILE 5.37 -0.70 1
81 LYS 3.63 -1.44 1
82 ALA 2.07 -0.05 1
83 ALA 3.27 -0.82 1
84 LEU 3.22 -1.35 1
85 ALA 2.81 -0.99 1
86 GLN 2.18 -0.92 1
88 GLN 1.24 -0.27 1
89 LEU 0.44 -0.13 1
90 GLU 0.45 0.13 1
91 HIS 0.13 0.42 1
92 HIS 0.33 0.22 1
93 HIS 0.12 0.32 1
94 HIS 0.20 0.37 1
95 HIS 1.45 0.51 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr7324_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -6.46
_LACS_plot.Line_1_terminator_val_y_1 0.32
_LACS_plot.Line_1_terminator_val_x_2 1.99
_LACS_plot.Line_1_terminator_val_y_2 -0.19
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.07
_LACS_plot.Line_2_terminator_val_x_2 6.44
_LACS_plot.Line_2_terminator_val_y_2 -0.51
_LACS_plot.Y_axis_chem_shift_offset 0.07
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
36 ILE -4.76 -0.03 0
68 ASP -6.46 0.40 0
48 PHE -5.57 1.02 0
50 VAL -3.03 1.01 0
49 GLU -1.60 0.96 0
57 VAL -4.22 -0.21 0
35 ASP -0.21 0.89 0
10 SER 1.47 -0.17 1
12 ALA -1.18 0.10 1
15 TYR 2.16 -0.10 1
16 LYS 3.62 -0.40 1
18 LYS 5.00 -0.17 1
19 TYR 4.28 -1.02 1
20 LEU 3.73 -0.38 1
21 GLN 3.65 -0.22 1
22 LEU 4.07 -0.61 1
23 LYS 3.15 -0.35 1
24 GLU 3.68 -0.33 1
25 LYS 2.93 -0.06 1
26 LEU 3.69 -0.35 1
27 GLU 4.06 -0.45 1
28 HIS 0.84 -0.51 1
29 GLU -1.67 0.04 1
30 PHE -3.57 0.70 1
34 LEU -2.00 0.15 1
39 GLU 4.31 -0.12 1
41 THR -0.56 -0.24 1
45 THR 0.07 0.01 1
47 PHE 4.60 0.16 1
51 THR -2.33 0.26 1
52 VAL 2.58 -0.25 1
53 ALA -2.22 0.18 1
55 LYS 1.17 0.04 1
56 LEU -0.30 0.24 1
58 HIS -2.98 0.65 1
59 SER 2.52 -0.24 1
60 LYS 4.56 -0.42 1
61 LYS 0.60 -0.08 1
62 ARG 2.55 -0.25 1
64 ASP -0.09 -0.32 1
66 TYR 3.98 -0.31 1
67 VAL -0.71 -0.03 1
69 THR 3.69 -0.12 1
70 GLU 4.84 -0.31 1
71 SER 1.23 -0.16 1
72 LYS 5.01 -0.65 1
73 PHE 4.76 -0.52 1
74 ARG 4.84 -0.30 1
75 LYS 3.81 -0.27 1
76 LEU 6.45 -0.67 1
77 VAL 6.26 -0.54 1
78 THR 3.27 -0.11 1
79 ALA 6.08 -0.85 1
80 ILE 5.37 -0.49 1
81 LYS 3.63 -0.15 1
82 ALA 2.07 -0.16 1
83 ALA 3.27 -0.34 1
84 LEU 3.22 -0.16 1
85 ALA 2.81 -0.22 1
86 GLN 2.18 -0.16 1
88 GLN 1.24 -0.18 1
89 LEU 0.44 -0.27 1
90 GLU 0.45 -0.15 1
91 HIS 0.13 -0.17 1
92 HIS 0.12 -0.13 1
94 HIS 0.20 -0.15 1
95 HIS 1.45 -0.33 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr7324_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -6.46
_LACS_plot.Line_1_terminator_val_y_1 -2.11
_LACS_plot.Line_1_terminator_val_x_2 1.99
_LACS_plot.Line_1_terminator_val_y_2 1.09
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -0.50
_LACS_plot.Line_2_terminator_val_x_2 6.44
_LACS_plot.Line_2_terminator_val_y_2 2.62
_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
15 TYR 2.16 -5.71 0
10 SER 1.47 2.63 1
18 LYS 3.62 4.09 1
19 TYR 5.00 -0.54 1
20 LEU 4.28 2.47 1
21 GLN 3.73 2.21 1
22 LEU 3.65 0.10 1
23 LYS 4.07 0.46 1
24 GLU 3.15 2.71 1
25 LYS 3.68 4.35 1
26 LEU 2.93 1.21 1
27 GLU 3.69 2.09 1
28 HIS 4.06 1.84 1
29 GLU 0.84 -0.66 1
30 PHE -1.67 1.59 1
34 LEU -3.57 -1.78 1
35 ASP -2.00 -1.61 1
36 ILE -0.21 -1.08 1
45 THR -0.56 0.48 1
47 PHE 0.07 0.76 1
49 GLU -5.57 -0.40 1
50 VAL -1.60 -1.36 1
51 THR -3.03 -0.84 1
52 VAL -2.33 -0.76 1
53 ALA 2.58 -0.88 1
55 LYS -2.22 -1.28 1
56 LEU 1.17 -1.14 1
57 VAL -0.30 -1.48 1
58 HIS -4.22 -0.77 1
59 SER -2.98 -0.48 1
60 LYS 2.52 4.59 1
61 LYS 4.56 1.70 1
62 ARG 0.60 -0.05 1
64 ASP 2.55 -0.98 1
66 TYR -0.09 -0.44 1
67 VAL 3.98 -0.38 1
68 ASP -0.71 -0.60 1
69 THR -6.46 0.38 1
70 GLU 3.69 2.33 1
71 SER 4.84 3.27 1
72 LYS 1.23 2.97 1
73 PHE 5.01 1.28 1
74 ARG 4.76 2.65 1
75 LYS 4.84 2.97 1
76 LEU 3.81 0.40 1
77 VAL 6.45 1.77 1
78 THR 6.26 1.83 1
79 ALA 3.27 3.27 1
80 ILE 6.08 0.56 1
81 LYS 5.37 3.21 1
82 ALA 3.63 2.27 1
83 ALA 2.07 3.27 1
84 LEU 3.27 1.97 1
85 ALA 3.22 2.23 1
86 GLN 2.81 1.70 1
88 GLN 2.18 0.94 1
89 LEU 1.24 0.47 1
90 GLU 0.44 0.10 1
91 HIS 0.45 0.33 1
92 HIS 0.13 0.22 1
93 HIS 0.33 0.09 1
94 HIS 0.12 0.21 1
95 HIS 0.20 -0.53 1
96 HIS 1.45 4.85 1
stop_
save_