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 bmr4431_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -9.60
_LACS_plot.Line_1_terminator_val_y_1 -10.83
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -7.08
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -8.93
_LACS_plot.Line_2_terminator_val_x_2 5.40
_LACS_plot.Line_2_terminator_val_y_2 -3.96
_LACS_plot.Y_axis_chem_shift_offset 7.66
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
49 ASN -6.30 -7.40 0
84 LYS -9.60 -9.80 0
10 ALA 0.80 -7.00 1
12 ILE 1.20 -6.80 1
15 LEU 0.50 -7.10 1
16 LYS 2.60 -7.60 1
18 LYS 0.40 -7.30 1
19 ASP -0.30 -7.80 1
23 GLN 0.30 -7.40 1
25 PHE -0.20 -7.80 1
26 ALA 4.00 -3.20 1
27 ASP -0.60 -8.10 1
28 GLU 0.20 -7.40 1
30 GLN -0.30 -8.00 1
32 VAL 0.20 -7.60 1
33 HIS -0.90 -8.40 1
36 ASP 0.10 -6.60 1
37 THR -0.20 -8.90 1
41 VAL -3.60 -9.40 1
45 SER 5.20 -4.50 1
54 GLU -1.00 -5.60 1
55 ILE -0.50 -9.80 1
58 THR 2.00 -4.90 1
59 ASP 2.20 -5.10 1
62 LYS 0.60 -7.20 1
67 THR -4.20 -7.90 1
69 ASN -3.50 -9.20 1
70 VAL -6.00 -9.80 1
71 GLU -1.10 -9.00 1
72 ASP 2.60 -6.70 1
74 ALA -4.70 -9.00 1
76 TYR -4.30 -9.80 1
77 TRP -5.90 -10.10 1
80 LYS -6.80 -9.50 1
81 ALA -0.60 -7.60 1
82 ASN -4.00 -8.80 1
86 GLU -1.50 -8.60 1
87 VAL 5.40 -4.30 1
90 ASP 3.10 -5.10 1
94 GLU 2.10 -5.50 1
95 LEU -3.50 -9.90 1
98 ARG 0.20 -8.60 1
102 VAL 3.60 -5.10 1
107 VAL 3.00 -6.70 1
109 VAL 0.50 -6.50 1
110 SER -3.30 -9.70 1
118 THR -2.00 -7.70 1
119 LEU -2.60 -9.80 1
121 ASN 3.10 -3.00 1
126 THR 0.10 -7.80 1
133 ASP 0.10 -6.70 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr4431_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -9.60
_LACS_plot.Line_1_terminator_val_y_1 -1.23
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -9.08
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -6.93
_LACS_plot.Line_2_terminator_val_x_2 5.40
_LACS_plot.Line_2_terminator_val_y_2 -9.36
_LACS_plot.Y_axis_chem_shift_offset 7.66
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
49 ASN -6.30 -1.10 0
84 LYS -9.60 -0.20 0
10 ALA 0.80 -7.80 1
12 ILE 1.20 -8.00 1
15 LEU 0.50 -7.60 1
16 LYS 2.60 -10.20 1
18 LYS 0.40 -7.70 1
19 ASP -0.30 -7.50 1
23 GLN 0.30 -7.70 1
25 PHE -0.20 -7.60 1
26 ALA 4.00 -7.20 1
27 ASP -0.60 -7.50 1
28 GLU 0.20 -7.60 1
30 GLN -0.30 -7.70 1
32 VAL 0.20 -7.80 1
33 HIS -0.90 -7.50 1
36 ASP 0.10 -6.70 1
37 THR -0.20 -8.70 1
41 VAL -3.60 -5.80 1
45 SER 5.20 -9.70 1
54 GLU -1.00 -4.60 1
55 ILE -0.50 -9.30 1
58 THR 2.00 -6.90 1
59 ASP 2.20 -7.30 1
62 LYS 0.60 -7.80 1
67 THR -4.20 -3.70 1
69 ASN -3.50 -5.70 1
70 VAL -6.00 -3.80 1
71 GLU -1.10 -7.90 1
72 ASP 2.60 -9.30 1
74 ALA -4.70 -4.30 1
76 TYR -4.30 -5.50 1
77 TRP -5.90 -4.20 1
80 LYS -6.80 -2.70 1
81 ALA -0.60 -7.00 1
82 ASN -4.00 -4.80 1
86 GLU -1.50 -7.10 1
87 VAL 5.40 -9.70 1
90 ASP 3.10 -8.20 1
94 GLU 2.10 -7.60 1
95 LEU -3.50 -6.40 1
98 ARG 0.20 -8.80 1
102 VAL 3.60 -8.70 1
107 VAL 3.00 -9.70 1
109 VAL 0.50 -7.00 1
110 SER -3.30 -6.40 1
118 THR -2.00 -5.70 1
119 LEU -2.60 -7.20 1
121 ASN 3.10 -6.10 1
126 THR 0.10 -7.90 1
133 ASP 0.10 -6.80 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr4431_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -9.60
_LACS_plot.Line_1_terminator_val_y_1 0.59
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.25
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.21
_LACS_plot.Line_2_terminator_val_x_2 5.40
_LACS_plot.Line_2_terminator_val_y_2 -0.66
_LACS_plot.Y_axis_chem_shift_offset 0.07
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
121 ASN 3.10 0.91 0
10 ALA 0.80 -0.23 1
12 ILE 1.20 -0.13 1
15 LEU 0.50 -0.14 1
16 LYS 2.60 -0.11 1
18 LYS 0.40 -0.16 1
19 ASP -0.30 -0.21 1
23 GLN 0.30 -0.28 1
25 PHE -0.20 -0.20 1
26 ALA 4.00 -0.19 1
27 ASP -0.60 -0.20 1
28 GLU 0.20 -0.25 1
30 GLN -0.30 -0.16 1
32 VAL 0.20 -0.18 1
33 HIS -0.90 0.15 1
36 ASP 0.10 0.40 1
37 THR -0.20 0.81 1
41 VAL -3.60 0.02 1
45 SER 5.20 -0.51 1
49 ASN -6.30 0.01 1
54 GLU -1.00 -0.03 1
55 ILE -0.50 -0.05 1
58 THR 2.00 -0.31 1
59 ASP 2.20 -0.44 1
62 LYS 0.60 -0.05 1
67 THR -4.20 0.21 1
69 ASN -3.50 0.98 1
70 VAL -6.00 0.43 1
71 GLU -1.10 0.13 1
72 ASP 2.60 -0.39 1
74 ALA -4.70 0.26 1
76 TYR -4.30 0.78 1
77 TRP -5.90 1.17 1
80 LYS -6.80 0.10 1
81 ALA -0.60 0.38 1
82 ASN -4.00 0.93 1
84 LYS -9.60 0.65 1
86 GLU -1.50 -0.54 1
87 VAL 5.40 -0.05 1
90 ASP 3.10 -0.44 1
94 GLU 2.10 -0.28 1
95 LEU -3.50 0.17 1
98 ARG 0.20 -0.16 1
102 VAL 3.60 -0.52 1
107 VAL 3.00 -0.43 1
109 VAL 0.50 -0.07 1
110 SER -3.30 0.75 1
118 THR -2.00 0.17 1
119 LEU -2.60 0.50 1
126 THR 0.10 -0.21 1
133 ASP 0.10 -0.35 1
stop_
save_