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 bmr16139_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -8.44
_LACS_plot.Line_1_terminator_val_y_1 -4.11
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 1.48
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -0.43
_LACS_plot.Line_2_terminator_val_x_2 3.92
_LACS_plot.Line_2_terminator_val_y_2 1.99
_LACS_plot.Y_axis_chem_shift_offset -0.40
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
50 GLN 3.93 -0.58 0
59 HIS -8.44 -1.10 0
51 HIS -4.87 1.54 0
81 VAL -5.17 -5.48 0
19 SER -1.32 -0.65 1
20 LEU -0.76 0.68 1
21 LYS -2.73 -1.36 1
22 VAL -6.12 -3.61 1
23 ARG -5.66 -3.03 1
24 ALA -0.68 -0.29 1
25 LEU -0.91 -0.09 1
26 LYS -5.54 -2.30 1
27 ASP -1.17 -0.30 1
28 PHE -2.60 0.89 1
29 TRP -2.84 -1.72 1
31 LEU -1.75 -0.79 1
32 HIS -2.99 1.54 1
35 THR -0.27 0.02 1
36 ALA -2.34 -0.47 1
37 LEU -2.98 -1.20 1
38 ASN 1.11 -0.13 1
39 VAL -3.31 -0.80 1
40 ARG -4.16 -3.03 1
41 ALA 2.73 1.40 1
43 ASP 0.92 1.58 1
44 VAL 0.45 0.14 1
45 ILE -4.35 -1.18 1
46 THR 2.12 1.48 1
47 VAL 3.26 2.02 1
48 LEU 2.05 1.62 1
49 GLU -1.82 -1.94 1
53 ASP 0.39 -0.30 1
55 ARG -0.27 0.72 1
56 TRP -5.83 -3.60 1
57 LYS -4.83 -1.36 1
60 ILE -2.72 -0.49 1
61 HIS -0.94 0.78 1
67 THR -2.32 -1.09 1
68 ASP -2.11 -0.30 1
69 ARG -1.91 -0.22 1
70 ILE -4.74 -1.57 1
72 TYR -2.48 -0.25 1
73 PHE -1.17 -0.76 1
77 ILE 0.64 0.06 1
78 VAL -6.31 -3.61 1
79 GLU -6.68 -3.05 1
80 VAL 0.36 0.12 1
83 LYS 0.09 0.52 1
84 ARG -0.04 0.72 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr16139_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -8.44
_LACS_plot.Line_1_terminator_val_y_1 4.33
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.52
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 1.57
_LACS_plot.Line_2_terminator_val_x_2 3.92
_LACS_plot.Line_2_terminator_val_y_2 -1.93
_LACS_plot.Y_axis_chem_shift_offset -0.40
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
50 GLN 3.93 -4.51 0
59 HIS -8.44 7.34 0
51 HIS -4.87 6.41 0
81 VAL -5.17 -0.31 0
19 SER -1.32 0.67 1
20 LEU -0.76 1.44 1
21 LYS -2.73 1.37 1
22 VAL -6.12 2.51 1
23 ARG -5.66 2.63 1
24 ALA -0.68 0.39 1
25 LEU -0.91 0.82 1
26 LYS -5.54 3.24 1
27 ASP -1.17 0.87 1
28 PHE -2.60 3.49 1
29 TRP -2.84 1.12 1
31 LEU -1.75 0.96 1
32 HIS -2.99 4.53 1
35 THR -0.27 0.29 1
36 ALA -2.34 1.87 1
37 LEU -2.98 1.78 1
38 ASN 1.11 -1.24 1
39 VAL -3.31 2.51 1
40 ARG -4.16 1.13 1
41 ALA 2.73 -1.33 1
43 ASP 0.92 0.66 1
44 VAL 0.45 -0.31 1
45 ILE -4.35 3.17 1
46 THR 2.12 -0.64 1
47 VAL 3.26 -1.24 1
48 LEU 2.05 -0.43 1
49 GLU -1.82 -0.12 1
53 ASP 0.39 -0.69 1
55 ARG -0.27 0.99 1
56 TRP -5.83 2.23 1
57 LYS -4.83 3.47 1
60 ILE -2.72 2.23 1
61 HIS -0.94 1.72 1
67 THR -2.32 1.23 1
68 ASP -2.11 1.81 1
69 ARG -1.91 1.69 1
70 ILE -4.74 3.17 1
72 TYR -2.48 2.23 1
73 PHE -1.17 0.41 1
77 ILE 0.64 -0.58 1
78 VAL -6.31 2.70 1
79 GLU -6.68 3.63 1
80 VAL 0.36 -0.24 1
83 LYS 0.09 0.43 1
84 ARG -0.04 0.76 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr16139_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -8.44
_LACS_plot.Line_1_terminator_val_y_1 1.04
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.02
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.36
_LACS_plot.Line_2_terminator_val_x_2 3.92
_LACS_plot.Line_2_terminator_val_y_2 -0.10
_LACS_plot.Y_axis_chem_shift_offset -0.19
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
56 TRP -5.83 -1.75 0
19 SER -1.32 -0.51 1
20 LEU -0.76 0.25 1
21 LYS -2.73 1.23 1
22 VAL -6.12 1.20 1
23 ARG -5.66 1.18 1
24 ALA -0.68 0.13 1
25 LEU -0.91 0.12 1
26 LYS -5.54 0.38 1
27 ASP -1.17 0.14 1
28 PHE -2.60 -1.38 1
29 TRP -2.84 0.30 1
31 LEU -1.75 0.94 1
35 THR -0.27 0.43 1
36 ALA -2.34 0.65 1
37 LEU -2.98 0.00 1
38 ASN 1.11 0.31 1
39 VAL -3.31 0.15 1
40 ARG -4.16 0.69 1
41 ALA 2.73 -0.89 1
43 ASP 0.92 -0.05 1
44 VAL 0.45 0.68 1
45 ILE -4.35 0.26 1
46 THR 2.12 0.50 1
47 VAL 3.26 0.11 1
48 LEU 2.05 -0.50 1
49 GLU -1.82 -0.14 1
50 GLN 3.93 0.28 1
53 ASP 0.39 0.04 1
55 ARG -0.27 0.05 1
57 LYS -4.83 0.50 1
59 HIS -8.44 1.10 1
60 ILE -2.72 0.27 1
61 HIS -0.94 -1.37 1
67 THR -2.32 0.28 1
69 ARG -1.91 0.47 1
70 ILE -4.74 1.34 1
72 TYR -2.48 1.54 1
77 ILE 0.64 0.50 1
78 VAL -6.31 1.41 1
79 GLU -6.68 0.65 1
80 VAL 0.36 0.13 1
81 VAL -5.17 0.33 1
83 LYS 0.09 0.15 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr16139_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -8.44
_LACS_plot.Line_1_terminator_val_y_1 -1.84
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.96
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.27
_LACS_plot.Line_2_terminator_val_x_2 3.92
_LACS_plot.Line_2_terminator_val_y_2 -0.80
_LACS_plot.Y_axis_chem_shift_offset 1.12
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
26 LYS -5.54 -4.24 0
28 PHE -2.60 -4.45 0
59 HIS -8.44 -0.13 0
19 SER -1.32 -1.40 1
20 LEU -0.76 -0.69 1
21 LYS -2.73 -0.88 1
22 VAL -6.12 -3.87 1
23 ARG -5.66 -0.61 1
24 ALA -0.68 0.59 1
25 LEU -0.91 -1.61 1
27 ASP -1.17 -0.06 1
29 TRP -2.84 -1.39 1
31 LEU -1.75 -2.22 1
35 THR -0.27 -0.37 1
36 ALA -2.34 -1.01 1
37 LEU -2.98 -3.63 1
38 ASN 1.11 -0.78 1
39 VAL -3.31 -1.93 1
40 ARG -4.16 -0.96 1
41 ALA 2.73 0.08 1
43 ASP 0.92 -1.48 1
44 VAL 0.45 -1.23 1
45 ILE -4.35 -0.60 1
46 THR 2.12 -0.54 1
47 VAL 3.26 -1.31 1
48 LEU 2.05 -0.50 1
49 GLU -1.82 -2.60 1
50 GLN 3.93 -1.80 1
53 ASP 0.39 0.52 1
55 ARG -0.27 -1.20 1
56 TRP -5.83 -2.53 1
57 LYS -4.83 -0.32 1
60 ILE -2.72 -2.45 1
61 HIS -0.94 0.03 1
67 THR -2.32 -1.84 1
69 ARG -1.91 -2.68 1
70 ILE -4.74 -0.40 1
72 TYR -2.48 0.95 1
77 ILE 0.64 -2.13 1
78 VAL -6.31 -2.42 1
79 GLU -6.68 -1.64 1
80 VAL 0.36 -1.39 1
81 VAL -5.17 -0.07 1
83 LYS 0.09 -1.45 1
stop_
save_