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 bmr11305_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -7.20
_LACS_plot.Line_1_terminator_val_y_1 -3.79
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 1.36
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.44
_LACS_plot.Line_2_terminator_val_x_2 5.58
_LACS_plot.Line_2_terminator_val_y_2 4.68
_LACS_plot.Y_axis_chem_shift_offset -0.21
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
48 ARG 5.58 0.21 0
10 TYR 1.54 1.29 1
11 GLN 1.46 1.08 1
12 ARG 1.29 0.85 1
13 LEU 0.13 0.42 1
14 TYR -0.79 -0.53 1
16 THR 0.37 0.51 1
17 ARG -2.84 -0.96 1
19 PHE 3.11 2.93 1
20 SER 1.64 2.22 1
22 ASP 2.15 2.15 1
23 GLN -2.77 -1.77 1
24 PHE 2.40 1.97 1
25 ILE 0.36 0.41 1
26 GLU -1.60 -0.75 1
28 GLU 0.26 1.02 1
29 VAL -3.93 -1.62 1
30 VAL -1.07 -0.50 1
31 SER -2.40 -2.05 1
32 ALA -3.42 -0.32 1
33 LEU 3.81 0.24 1
35 LYS -4.52 -2.51 1
36 THR -4.52 -2.85 1
37 TYR -6.15 -1.03 1
38 HIS 3.51 4.87 1
40 ASP 2.42 1.57 1
42 PHE 1.28 -1.11 1
43 VAL -7.20 -4.48 1
45 ALA 1.29 2.21 1
46 VAL 3.85 3.03 1
49 LEU -0.30 -0.47 1
51 PHE 1.32 0.74 1
55 ASP -0.57 0.57 1
56 ARG 0.75 0.06 1
57 VAL -0.43 -0.41 1
58 THR -1.26 -0.33 1
59 PHE -2.79 -0.98 1
60 ASN -1.27 -1.03 1
62 LYS 0.21 1.12 1
63 GLU -3.03 -0.69 1
65 MET -5.66 -1.10 1
67 GLN 4.05 3.64 1
68 LYS 3.80 3.37 1
70 SER 0.91 1.11 1
71 LEU 0.63 0.73 1
73 VAL 0.31 0.22 1
74 SER -0.30 -0.18 1
75 VAL 0.03 0.02 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11305_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -7.20
_LACS_plot.Line_1_terminator_val_y_1 3.41
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.64
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.56
_LACS_plot.Line_2_terminator_val_x_2 5.58
_LACS_plot.Line_2_terminator_val_y_2 -0.90
_LACS_plot.Y_axis_chem_shift_offset -0.21
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
48 ARG 5.58 -5.37 0
10 TYR 1.54 -0.25 1
11 GLN 1.46 -0.38 1
12 ARG 1.29 -0.44 1
13 LEU 0.13 0.29 1
14 TYR -0.79 0.26 1
16 THR 0.37 0.14 1
17 ARG -2.84 1.88 1
19 PHE 3.11 -0.18 1
20 SER 1.64 0.58 1
22 ASP 2.15 0.00 1
23 GLN -2.77 1.00 1
24 PHE 2.40 -0.43 1
25 ILE 0.36 0.05 1
26 GLU -1.60 0.85 1
28 GLU 0.26 0.76 1
29 VAL -3.93 2.31 1
30 VAL -1.07 0.57 1
31 SER -2.40 0.35 1
32 ALA -3.42 3.10 1
33 LEU 3.81 -3.57 1
35 LYS -4.52 2.01 1
36 THR -4.52 1.67 1
37 TYR -6.15 5.12 1
38 HIS 3.51 1.36 1
40 ASP 2.42 -0.85 1
42 PHE 1.28 -2.39 1
43 VAL -7.20 2.72 1
45 ALA 1.29 0.92 1
46 VAL 3.85 -0.82 1
49 LEU -0.30 -0.17 1
51 PHE 1.32 -0.58 1
55 ASP -0.57 1.14 1
56 ARG 0.75 -0.69 1
57 VAL -0.43 0.02 1
58 THR -1.26 0.93 1
59 PHE -2.79 1.81 1
60 ASN -1.27 0.24 1
62 LYS 0.21 0.91 1
63 GLU -3.03 2.34 1
65 MET -5.66 4.56 1
67 GLN 4.05 -0.41 1
68 LYS 3.80 -0.43 1
70 SER 0.91 0.20 1
71 LEU 0.63 0.10 1
73 VAL 0.31 -0.09 1
74 SER -0.30 0.12 1
75 VAL 0.03 -0.01 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11305_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -7.20
_LACS_plot.Line_1_terminator_val_y_1 0.47
_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 0.12
_LACS_plot.Line_2_terminator_val_x_2 5.58
_LACS_plot.Line_2_terminator_val_y_2 -0.39
_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
43 VAL -7.20 -0.38 0
10 TYR 1.54 -0.17 1
11 GLN 1.46 -0.23 1
12 ARG 1.29 -0.20 1
13 LEU 0.13 -0.15 1
14 TYR -0.79 0.05 1
16 THR 0.37 0.02 1
17 ARG -2.84 -0.05 1
19 PHE 3.11 -0.43 1
20 SER 1.64 0.23 1
22 ASP 2.15 -0.13 1
23 GLN -2.77 0.22 1
24 PHE 2.40 -0.05 1
25 ILE 0.36 -0.25 1
26 GLU -1.60 0.17 1
28 GLU 0.26 -0.29 1
29 VAL -3.93 0.22 1
30 VAL -1.07 0.16 1
31 SER -2.40 0.89 1
32 ALA -3.42 0.14 1
33 LEU 3.81 -0.47 1
35 LYS -4.52 0.10 1
36 THR -4.52 0.73 1
37 TYR -6.15 1.42 1
38 HIS 3.51 -0.24 1
40 ASP 2.42 -0.14 1
42 PHE 1.28 -0.07 1
45 ALA 1.29 -0.16 1
46 VAL 3.85 -0.10 1
48 ARG 5.58 -0.24 1
49 LEU -0.30 0.10 1
51 PHE 1.32 -0.38 1
55 ASP -0.57 -0.06 1
56 ARG 0.75 -0.02 1
57 VAL -0.43 -0.15 1
58 THR -1.26 0.14 1
59 PHE -2.79 0.71 1
60 ASN -1.27 0.14 1
62 LYS 0.21 0.22 1
63 GLU -3.03 0.40 1
65 MET -5.66 1.46 1
67 GLN 4.05 -0.34 1
68 LYS 3.80 -0.19 1
70 SER 0.91 -0.13 1
71 LEU 0.63 -0.12 1
73 VAL 0.31 0.00 1
74 SER -0.30 0.06 1
75 VAL 0.03 0.13 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11305_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -7.20
_LACS_plot.Line_1_terminator_val_y_1 -1.78
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 0.13
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -0.62
_LACS_plot.Line_2_terminator_val_x_2 5.58
_LACS_plot.Line_2_terminator_val_y_2 0.60
_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
37 TYR -6.15 2.12 0
10 TYR 1.54 0.43 1
11 GLN 1.46 0.46 1
12 ARG 1.29 0.05 1
13 LEU 0.13 -0.44 1
14 TYR -0.79 0.05 1
16 THR 0.37 -1.53 1
17 ARG -2.84 -1.14 1
19 PHE 3.11 -0.08 1
20 SER 1.64 1.19 1
22 ASP 2.15 -1.71 1
23 GLN -2.77 0.54 1
24 PHE 2.40 0.64 1
25 ILE 0.36 -0.67 1
26 GLU -1.60 -0.19 1
28 GLU 0.26 -1.99 1
29 VAL -3.93 0.25 1
30 VAL -1.07 -1.71 1
31 SER -2.40 -0.93 1
32 ALA -3.42 -1.47 1
33 LEU 3.81 -0.84 1
35 LYS -4.52 -1.43 1
36 THR -4.52 -1.00 1
38 HIS 3.51 3.78 1
40 ASP 2.42 0.45 1
42 PHE 1.28 -3.41 1
43 VAL -7.20 -2.71 1
45 ALA 1.29 0.23 1
46 VAL 3.85 0.74 1
48 ARG 5.58 -1.59 1
49 LEU -0.30 -0.31 1
51 PHE 1.32 1.98 1
55 ASP -0.57 0.59 1
56 ARG 0.75 -0.95 1
57 VAL -0.43 -0.45 1
58 THR -1.26 -1.85 1
59 PHE -2.79 -0.01 1
60 ASN -1.27 0.59 1
62 LYS 0.21 -0.77 1
63 GLU -3.03 -1.73 1
65 MET -5.66 -1.05 1
67 GLN 4.05 2.57 1
68 LYS 3.80 2.72 1
70 SER 0.91 -0.73 1
71 LEU 0.63 -0.55 1
73 VAL 0.31 0.04 1
74 SER -0.30 -0.03 1
75 VAL 0.03 -0.12 1
stop_
save_