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 bmr11352_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -6.36
_LACS_plot.Line_1_terminator_val_y_1 -2.84
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 1.02
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.05
_LACS_plot.Line_2_terminator_val_x_2 6.31
_LACS_plot.Line_2_terminator_val_y_2 3.89
_LACS_plot.Y_axis_chem_shift_offset -0.12
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
40 GLU 6.31 6.22 0
10 ALA -0.72 -0.40 1
11 ILE -0.72 -0.45 1
12 ASP -1.10 -0.48 1
14 ASN -0.07 0.03 1
15 GLU -0.67 0.19 1
17 THR -3.36 -2.27 1
18 TYR -5.72 -0.80 1
20 LEU 1.69 1.95 1
22 ASN 3.06 1.69 1
23 GLN -5.13 -1.57 1
24 VAL -0.89 -0.71 1
25 SER 1.78 1.26 1
26 TYR -0.58 0.06 1
28 GLU 1.57 -0.02 1
29 MET -3.96 -2.58 1
30 ILE -6.36 -2.78 1
33 ASP 3.10 2.67 1
34 ASN 1.11 -0.02 1
35 GLU 3.21 2.49 1
36 GLN 0.12 -1.19 1
39 ILE -0.01 1.88 1
41 TRP -5.15 -1.55 1
42 PHE -4.60 -1.57 1
43 HIS 1.19 2.96 1
44 PHE 4.94 3.08 1
45 SER 4.58 3.07 1
47 VAL -0.54 -2.30 1
48 SER 3.54 0.79 1
49 LEU -3.50 -1.67 1
50 THR 0.44 0.40 1
51 TYR -3.52 -2.06 1
52 LYS -0.08 0.40 1
54 LYS 0.72 0.31 1
56 LYS -0.85 -0.19 1
57 TRP -0.34 1.31 1
58 TYR -5.52 -3.52 1
61 LYS 2.15 1.42 1
63 ARG 1.83 0.81 1
65 ASP -0.04 0.14 1
66 SER 0.14 0.15 1
69 SER 0.03 0.10 1
70 SER -0.55 -0.07 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11352_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -6.36
_LACS_plot.Line_1_terminator_val_y_1 3.52
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.98
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.95
_LACS_plot.Line_2_terminator_val_x_2 6.31
_LACS_plot.Line_2_terminator_val_y_2 -2.42
_LACS_plot.Y_axis_chem_shift_offset -0.12
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
40 GLU 6.31 -0.09 0
10 ALA -0.72 0.32 1
11 ILE -0.72 0.27 1
12 ASP -1.10 0.62 1
14 ASN -0.07 0.10 1
15 GLU -0.67 0.86 1
17 THR -3.36 1.09 1
18 TYR -5.72 4.92 1
20 LEU 1.69 0.26 1
22 ASN 3.06 -1.37 1
23 GLN -5.13 3.56 1
24 VAL -0.89 0.18 1
25 SER 1.78 -0.52 1
26 TYR -0.58 0.64 1
28 GLU 1.57 -1.59 1
29 MET -3.96 1.38 1
30 ILE -6.36 3.58 1
33 ASP 3.10 -0.43 1
34 ASN 1.11 -1.13 1
35 GLU 3.21 -0.72 1
36 GLN 0.12 -1.31 1
39 ILE -0.01 1.89 1
41 TRP -5.15 3.60 1
42 PHE -4.60 3.03 1
43 HIS 1.19 1.77 1
44 PHE 4.94 -1.86 1
45 SER 4.58 -1.51 1
47 VAL -0.54 -1.76 1
48 SER 3.54 -2.75 1
49 LEU -3.50 1.83 1
50 THR 0.44 -0.04 1
51 TYR -3.52 1.46 1
52 LYS -0.08 0.48 1
54 LYS 0.72 -0.41 1
56 LYS -0.85 0.66 1
57 TRP -0.34 1.65 1
58 TYR -5.52 2.00 1
61 LYS 2.15 -0.73 1
63 ARG 1.83 -1.02 1
65 ASP -0.04 0.18 1
66 SER 0.14 0.01 1
69 SER 0.03 0.07 1
70 SER -0.55 0.48 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11352_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -6.36
_LACS_plot.Line_1_terminator_val_y_1 0.53
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.18
_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 6.31
_LACS_plot.Line_2_terminator_val_y_2 -0.55
_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
29 MET -3.96 1.04 0
10 ALA -0.72 -0.01 1
11 ILE -0.72 -0.08 1
12 ASP -1.10 -0.07 1
14 ASN -0.07 -0.07 1
15 GLU -0.67 -0.11 1
17 THR -3.36 -0.24 1
18 TYR -5.72 0.54 1
20 LEU 1.69 0.06 1
22 ASN 3.06 -0.21 1
23 GLN -5.13 0.65 1
24 VAL -0.89 0.39 1
25 SER 1.78 -0.43 1
26 TYR -0.58 0.05 1
28 GLU 1.57 -0.37 1
30 ILE -6.36 0.57 1
33 ASP 3.10 0.03 1
34 ASN 1.11 0.24 1
35 GLU 3.21 -0.24 1
36 GLN 0.12 0.11 1
39 ILE -0.01 -0.03 1
40 GLU 6.31 -0.57 1
41 TRP -5.15 0.70 1
42 PHE -4.60 0.21 1
43 HIS 1.19 0.27 1
44 PHE 4.94 -0.68 1
45 SER 4.58 -0.14 1
47 VAL -0.54 0.63 1
48 SER 3.54 -0.46 1
49 LEU -3.50 0.21 1
50 THR 0.44 -0.04 1
51 TYR -3.52 0.16 1
52 LYS -0.08 -0.56 1
54 LYS 0.72 0.00 1
56 LYS -0.85 0.00 1
57 TRP -0.34 -0.30 1
58 TYR -5.52 0.41 1
61 LYS 2.15 -0.08 1
63 ARG 1.83 -0.44 1
65 ASP -0.04 -0.03 1
66 SER 0.14 -0.04 1
69 SER 0.03 -0.01 1
70 SER -0.55 0.08 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11352_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -6.36
_LACS_plot.Line_1_terminator_val_y_1 -1.95
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 0.21
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -0.71
_LACS_plot.Line_2_terminator_val_x_2 6.31
_LACS_plot.Line_2_terminator_val_y_2 0.57
_LACS_plot.Y_axis_chem_shift_offset 0.35
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
30 ILE -6.36 -4.33 0
40 GLU 6.31 -0.53 0
57 TRP -0.34 -4.08 0
45 SER 4.58 3.88 0
43 HIS 1.19 3.94 0
10 ALA -0.72 -0.83 1
11 ILE -0.72 -0.65 1
12 ASP -1.10 0.13 1
14 ASN -0.07 -0.35 1
15 GLU -0.67 -0.96 1
17 THR -3.36 -1.74 1
18 TYR -5.72 -1.79 1
20 LEU 1.69 0.52 1
22 ASN 3.06 -1.67 1
23 GLN -5.13 0.11 1
24 VAL -0.89 -0.01 1
25 SER 1.78 -0.68 1
26 TYR -0.58 -1.34 1
28 GLU 1.57 -0.70 1
29 MET -3.96 -1.10 1
33 ASP 3.10 0.00 1
34 ASN 1.11 1.17 1
35 GLU 3.21 0.47 1
36 GLN 0.12 -1.21 1
39 ILE -0.01 0.91 1
41 TRP -5.15 -1.29 1
42 PHE -4.60 0.20 1
44 PHE 4.94 2.94 1
47 VAL -0.54 -2.08 1
48 SER 3.54 -0.83 1
49 LEU -3.50 -0.59 1
50 THR 0.44 -1.32 1
51 TYR -3.52 -2.32 1
52 LYS -0.08 -0.64 1
54 LYS 0.72 0.72 1
56 LYS -0.85 -0.11 1
58 TYR -5.52 -1.52 1
61 LYS 2.15 1.90 1
63 ARG 1.83 0.00 1
65 ASP -0.04 0.21 1
66 SER 0.14 -0.02 1
69 SER 0.03 -0.08 1
70 SER -0.55 -0.86 1
stop_
save_