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 bmr11312_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -4.73
_LACS_plot.Line_1_terminator_val_y_1 -2.24
_LACS_plot.Line_1_terminator_val_x_2 1.99
_LACS_plot.Line_1_terminator_val_y_2 0.95
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.29
_LACS_plot.Line_2_terminator_val_x_2 5.83
_LACS_plot.Line_2_terminator_val_y_2 4.46
_LACS_plot.Y_axis_chem_shift_offset -0.10
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
47 THR 0.02 -1.39 0
10 GLU -1.92 -1.99 1
11 LYS -3.05 -1.22 1
13 SER 2.36 2.37 1
14 GLU -1.00 -0.08 1
16 SER 1.59 1.37 1
17 TYR 1.52 2.93 1
18 SER -4.48 -2.08 1
20 SER 0.75 1.19 1
21 SER -4.14 -1.75 1
22 LYS 4.48 3.44 1
23 ALA 3.81 2.80 1
24 ALA 2.75 2.11 1
25 LEU 4.14 3.02 1
26 ARG 3.29 2.84 1
27 ILE 4.13 3.53 1
28 HIS 5.74 4.84 1
29 GLU 3.07 3.03 1
30 ARG 3.45 2.64 1
31 ILE 3.22 2.07 1
32 HIS 0.34 -0.11 1
34 THR 0.21 0.04 1
35 ASP 0.39 0.40 1
36 ARG -0.88 -0.53 1
38 PHE 1.35 0.17 1
39 LYS -3.09 -1.54 1
41 ASN 1.91 1.53 1
42 TYR 0.01 0.42 1
44 SER 1.27 1.22 1
45 PHE 1.63 2.81 1
46 ASP -4.73 -2.17 1
48 LYS 0.31 1.17 1
49 GLN -2.60 -1.16 1
51 SER 4.60 2.86 1
52 ASN 3.06 2.15 1
53 LEU 4.80 3.01 1
54 SER 5.69 3.94 1
55 LYS 3.99 3.73 1
56 HIS 5.84 5.16 1
57 MET 4.93 3.13 1
58 LYS 2.97 2.58 1
59 LYS 2.03 2.10 1
60 PHE 2.36 1.95 1
61 HIS -1.73 -1.97 1
63 ASP 0.82 0.13 1
64 MET 0.14 -0.45 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11312_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -4.73
_LACS_plot.Line_1_terminator_val_y_1 2.49
_LACS_plot.Line_1_terminator_val_x_2 1.99
_LACS_plot.Line_1_terminator_val_y_2 -1.04
_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 5.83
_LACS_plot.Line_2_terminator_val_y_2 -1.37
_LACS_plot.Y_axis_chem_shift_offset -0.10
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
47 THR 0.02 -1.41 0
10 GLU -1.92 -0.07 1
11 LYS -3.05 1.83 1
13 SER 2.36 0.01 1
14 GLU -1.00 0.92 1
16 SER 1.59 -0.22 1
17 TYR 1.52 1.41 1
18 SER -4.48 2.40 1
20 SER 0.75 0.44 1
21 SER -4.14 2.39 1
22 LYS 4.48 -1.04 1
23 ALA 3.81 -1.01 1
24 ALA 2.75 -0.64 1
25 LEU 4.14 -1.12 1
26 ARG 3.29 -0.45 1
27 ILE 4.13 -0.60 1
28 HIS 5.74 -0.90 1
29 GLU 3.07 -0.04 1
30 ARG 3.45 -0.81 1
31 ILE 3.22 -1.15 1
32 HIS 0.34 -0.45 1
34 THR 0.21 -0.17 1
35 ASP 0.39 0.01 1
36 ARG -0.88 0.35 1
38 PHE 1.35 -1.18 1
39 LYS -3.09 1.55 1
41 ASN 1.91 -0.38 1
42 TYR 0.01 0.41 1
44 SER 1.27 -0.05 1
45 PHE 1.63 1.18 1
46 ASP -4.73 2.56 1
48 LYS 0.31 0.86 1
49 GLN -2.60 1.44 1
51 SER 4.60 -1.74 1
52 ASN 3.06 -0.91 1
53 LEU 4.80 -1.79 1
54 SER 5.69 -1.75 1
55 LYS 3.99 -0.26 1
56 HIS 5.84 -0.68 1
57 MET 4.93 -1.80 1
58 LYS 2.97 -0.39 1
59 LYS 2.03 0.07 1
60 PHE 2.36 -0.41 1
61 HIS -1.73 -0.24 1
63 ASP 0.82 -0.69 1
64 MET 0.14 -0.59 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11312_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -4.73
_LACS_plot.Line_1_terminator_val_y_1 0.53
_LACS_plot.Line_1_terminator_val_x_2 1.99
_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 0.26
_LACS_plot.Line_2_terminator_val_x_2 5.83
_LACS_plot.Line_2_terminator_val_y_2 -0.51
_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
46 ASP -4.73 0.13 0
53 LEU 4.80 0.17 0
10 GLU -1.92 0.23 1
11 LYS -3.05 0.42 1
13 SER 2.36 -0.04 1
14 GLU -1.00 0.05 1
16 SER 1.59 -0.06 1
17 TYR 1.52 -0.43 1
18 SER -4.48 0.59 1
20 SER 0.75 0.10 1
21 SER -4.14 0.55 1
22 LYS 4.48 -0.42 1
23 ALA 3.81 -0.24 1
24 ALA 2.75 -0.11 1
25 LEU 4.14 0.00 1
26 ARG 3.29 -0.12 1
27 ILE 4.13 -0.48 1
28 HIS 5.74 -0.75 1
29 GLU 3.07 -0.70 1
30 ARG 3.45 -0.22 1
31 ILE 3.22 -0.26 1
32 HIS 0.34 0.05 1
34 THR 0.21 0.01 1
35 ASP 0.39 -0.10 1
36 ARG -0.88 -0.19 1
38 PHE 1.35 -0.05 1
39 LYS -3.09 0.38 1
41 ASN 1.91 -0.17 1
42 TYR 0.01 0.03 1
44 SER 1.27 -0.03 1
45 PHE 1.63 -0.49 1
47 THR 0.02 0.11 1
48 LYS 0.31 0.39 1
49 GLN -2.60 0.39 1
51 SER 4.60 -0.20 1
52 ASN 3.06 0.05 1
54 SER 5.69 -0.48 1
55 LYS 3.99 -0.30 1
56 HIS 5.84 -0.55 1
57 MET 4.93 -0.29 1
58 LYS 2.97 -0.35 1
59 LYS 2.03 -0.41 1
60 PHE 2.36 -0.42 1
61 HIS -1.73 0.49 1
63 ASP 0.82 -0.09 1
64 MET 0.14 0.06 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11312_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -4.73
_LACS_plot.Line_1_terminator_val_y_1 -3.20
_LACS_plot.Line_1_terminator_val_x_2 1.99
_LACS_plot.Line_1_terminator_val_y_2 0.59
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.66
_LACS_plot.Line_2_terminator_val_x_2 5.83
_LACS_plot.Line_2_terminator_val_y_2 2.76
_LACS_plot.Y_axis_chem_shift_offset 0.53
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
61 HIS -1.73 2.16 0
10 GLU -1.92 -1.60 1
11 LYS -3.05 -1.33 1
13 SER 2.36 0.88 1
14 GLU -1.00 -1.04 1
16 SER 1.59 -0.74 1
17 TYR 1.52 -2.37 1
18 SER -4.48 -2.79 1
22 LYS 4.48 2.02 1
23 ALA 3.81 2.72 1
24 ALA 2.75 3.19 1
25 LEU 4.14 0.49 1
26 ARG 3.29 3.30 1
27 ILE 4.13 2.43 1
28 HIS 5.74 2.25 1
29 GLU 3.07 1.52 1
30 ARG 3.45 2.64 1
31 ILE 3.22 0.70 1
32 HIS 0.34 0.96 1
34 THR 0.21 -0.53 1
35 ASP 0.39 -0.78 1
36 ARG -0.88 -0.80 1
38 PHE 1.35 -1.96 1
39 LYS -3.09 -1.11 1
41 ASN 1.91 0.39 1
42 TYR 0.01 -1.11 1
44 SER 1.27 -0.60 1
45 PHE 1.63 -2.76 1
46 ASP -4.73 -3.41 1
47 THR 0.02 -2.79 1
54 SER 5.69 2.84 1
55 LYS 3.99 2.03 1
56 HIS 5.84 2.71 1
57 MET 4.93 2.59 1
58 LYS 2.97 1.09 1
59 LYS 2.03 1.47 1
60 PHE 2.36 0.22 1
63 ASP 0.82 0.24 1
64 MET 0.14 -2.57 1
stop_
save_