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 bmr11260_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -3.87
_LACS_plot.Line_1_terminator_val_y_1 -2.74
_LACS_plot.Line_1_terminator_val_x_2 1.99
_LACS_plot.Line_1_terminator_val_y_2 1.73
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.38
_LACS_plot.Line_2_terminator_val_x_2 6.76
_LACS_plot.Line_2_terminator_val_y_2 5.33
_LACS_plot.Y_axis_chem_shift_offset -0.18
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
31 TYR -3.87 -0.38 0
10 SER 2.33 1.83 1
11 GLU 2.08 1.84 1
12 LEU 2.34 1.85 1
13 GLN 2.33 1.52 1
14 MET 0.23 -0.21 1
15 LEU -0.93 -0.74 1
16 SER 1.33 0.59 1
18 SER 5.58 3.32 1
19 GLU 1.36 2.88 1
20 ARG 4.70 3.46 1
21 GLN 4.03 3.05 1
23 VAL 5.08 4.11 1
24 GLU 3.31 2.91 1
25 THR 6.19 5.32 1
26 VAL 5.51 4.08 1
27 VAL 5.18 3.63 1
28 ASN 2.64 2.08 1
29 MET 1.90 1.57 1
32 SER -2.32 -1.01 1
33 TYR 5.59 5.50 1
34 GLU 4.64 3.90 1
36 VAL 6.76 5.09 1
37 LEU 4.48 3.46 1
38 ARG 4.26 3.64 1
39 ALA 0.93 2.21 1
40 MET 2.56 2.74 1
41 LYS 4.02 2.60 1
42 LYS 0.99 1.21 1
43 LYS -1.85 -2.21 1
45 GLU -0.30 -1.20 1
46 ASN -1.30 -0.42 1
47 ILE 5.94 4.88 1
48 GLU 4.94 3.92 1
49 GLN 3.35 2.86 1
50 ILE 6.01 5.29 1
51 LEU 4.50 3.16 1
52 ASP 3.29 3.53 1
53 TYR 4.02 3.87 1
54 LEU 3.92 2.44 1
55 PHE 3.46 2.40 1
56 ALA 0.82 0.67 1
57 HIS 1.19 1.53 1
58 SER 0.06 0.63 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11260_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -3.87
_LACS_plot.Line_1_terminator_val_y_1 1.13
_LACS_plot.Line_1_terminator_val_x_2 1.99
_LACS_plot.Line_1_terminator_val_y_2 -0.26
_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 6.76
_LACS_plot.Line_2_terminator_val_y_2 -1.43
_LACS_plot.Y_axis_chem_shift_offset -0.18
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
31 TYR -3.87 3.49 0
10 SER 2.33 -0.50 1
11 GLU 2.08 -0.24 1
12 LEU 2.34 -0.49 1
13 GLN 2.33 -0.81 1
14 MET 0.23 -0.44 1
15 LEU -0.93 0.19 1
16 SER 1.33 -0.74 1
18 SER 5.58 -2.26 1
19 GLU 1.36 1.52 1
20 ARG 4.70 -1.24 1
21 GLN 4.03 -0.98 1
23 VAL 5.08 -0.97 1
24 GLU 3.31 -0.40 1
25 THR 6.19 -0.87 1
26 VAL 5.51 -1.43 1
27 VAL 5.18 -1.55 1
28 ASN 2.64 -0.56 1
29 MET 1.90 -0.33 1
32 SER -2.32 1.31 1
33 TYR 5.59 -0.09 1
34 GLU 4.64 -0.74 1
36 VAL 6.76 -1.67 1
37 LEU 4.48 -1.02 1
38 ARG 4.26 -0.62 1
39 ALA 0.93 1.28 1
40 MET 2.56 0.18 1
41 LYS 4.02 -1.42 1
42 LYS 0.99 0.22 1
43 LYS -1.85 -0.36 1
45 GLU -0.30 -0.90 1
46 ASN -1.30 0.88 1
47 ILE 5.94 -1.06 1
48 GLU 4.94 -1.02 1
49 GLN 3.35 -0.49 1
50 ILE 6.01 -0.72 1
51 LEU 4.50 -1.34 1
52 ASP 3.29 0.24 1
53 TYR 4.02 -0.15 1
54 LEU 3.92 -1.48 1
55 PHE 3.46 -1.06 1
56 ALA 0.82 -0.15 1
57 HIS 1.19 0.34 1
58 SER 0.06 0.57 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11260_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -3.87
_LACS_plot.Line_1_terminator_val_y_1 0.28
_LACS_plot.Line_1_terminator_val_x_2 1.99
_LACS_plot.Line_1_terminator_val_y_2 -0.22
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.13
_LACS_plot.Line_2_terminator_val_x_2 6.76
_LACS_plot.Line_2_terminator_val_y_2 -0.64
_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
39 ALA 0.93 -1.02 0
10 SER 2.33 -0.28 1
11 GLU 2.08 -0.26 1
12 LEU 2.34 -0.32 1
13 GLN 2.33 -0.30 1
14 MET 0.23 0.00 1
15 LEU -0.93 0.13 1
16 SER 1.33 -0.01 1
18 SER 5.58 -0.27 1
19 GLU 1.36 -0.56 1
20 ARG 4.70 -0.52 1
21 GLN 4.03 -0.21 1
23 VAL 5.08 -0.61 1
24 GLU 3.31 -0.39 1
25 THR 6.19 -0.45 1
26 VAL 5.51 -0.20 1
27 VAL 5.18 0.12 1
28 ASN 2.64 -0.12 1
29 MET 1.90 -0.05 1
31 TYR -3.87 0.14 1
32 SER -2.32 0.08 1
33 TYR 5.59 -0.80 1
34 GLU 4.64 -0.48 1
36 VAL 6.76 -0.76 1
37 LEU 4.48 -0.48 1
38 ARG 4.26 -0.44 1
40 MET 2.56 -0.47 1
41 LYS 4.02 -0.35 1
42 LYS 0.99 -0.12 1
43 LYS -1.85 0.09 1
45 GLU -0.30 -0.01 1
46 ASN -1.30 0.04 1
47 ILE 5.94 -0.76 1
48 GLU 4.94 -0.46 1
49 GLN 3.35 -0.22 1
50 ILE 6.01 -0.81 1
51 LEU 4.50 -0.62 1
52 ASP 3.29 -0.25 1
53 TYR 4.02 -0.28 1
54 LEU 3.92 -0.44 1
55 PHE 3.46 -0.24 1
56 ALA 0.82 -0.18 1
57 HIS 1.19 -0.14 1
58 SER 0.06 0.12 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11260_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -3.87
_LACS_plot.Line_1_terminator_val_y_1 -1.21
_LACS_plot.Line_1_terminator_val_x_2 1.99
_LACS_plot.Line_1_terminator_val_y_2 1.23
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -0.16
_LACS_plot.Line_2_terminator_val_x_2 6.76
_LACS_plot.Line_2_terminator_val_y_2 2.70
_LACS_plot.Y_axis_chem_shift_offset -0.45
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
27 VAL 5.18 4.75 0
31 TYR -3.87 -1.48 0
47 ILE 5.94 -0.12 0
10 SER 2.33 1.18 1
11 GLU 2.08 1.90 1
12 LEU 2.34 1.07 1
13 GLN 2.33 0.40 1
14 MET 0.23 0.05 1
15 LEU -0.93 -0.27 1
16 SER 1.33 -0.26 1
18 SER 5.58 3.30 1
19 GLU 1.36 2.06 1
20 ARG 4.70 1.71 1
21 GLN 4.03 2.34 1
23 VAL 5.08 1.45 1
24 GLU 3.31 2.31 1
25 THR 6.19 1.40 1
26 VAL 5.51 3.23 1
28 ASN 2.64 1.16 1
29 MET 1.90 -0.64 1
32 SER -2.32 0.74 1
33 TYR 5.59 1.66 1
34 GLU 4.64 2.71 1
36 VAL 6.76 1.06 1
37 LEU 4.48 1.90 1
38 ARG 4.26 2.31 1
39 ALA 0.93 1.15 1
40 MET 2.56 2.92 1
41 LYS 4.02 1.52 1
42 LYS 0.99 1.55 1
43 LYS -1.85 0.54 1
45 GLU -0.30 -1.14 1
46 ASN -1.30 -0.23 1
48 GLU 4.94 2.91 1
49 GLN 3.35 3.53 1
50 ILE 6.01 1.08 1
51 LEU 4.50 1.43 1
52 ASP 3.29 2.38 1
53 TYR 4.02 2.57 1
54 LEU 3.92 2.04 1
55 PHE 3.46 1.98 1
56 ALA 0.82 0.24 1
57 HIS 1.19 0.77 1
58 SER 0.06 -0.02 1
stop_
save_