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 bmr11110_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -6.46
_LACS_plot.Line_1_terminator_val_y_1 -2.06
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 0.35
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.06
_LACS_plot.Line_2_terminator_val_x_2 2.41
_LACS_plot.Line_2_terminator_val_y_2 1.26
_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
61 HIS -2.90 2.56 0
10 ALA -1.27 -0.25 1
12 ARG -4.30 -1.37 1
13 ASP 2.37 0.77 1
14 LEU 0.27 0.53 1
15 GLU -5.74 -1.45 1
16 ALA -2.20 -2.20 1
17 LYS -3.66 -1.36 1
18 GLU 0.55 -0.75 1
19 VAL 1.92 1.38 1
20 THR 2.41 1.19 1
22 ARG -5.05 -1.88 1
23 THR -5.75 -2.55 1
24 ALA -3.92 0.00 1
25 LEU -3.10 -1.52 1
26 LEU -2.50 -1.83 1
27 THR -3.82 -1.71 1
28 TRP -1.10 -0.54 1
29 THR -0.33 -0.41 1
30 GLU 0.38 1.64 1
33 VAL -0.88 -1.14 1
34 ARG 0.75 1.21 1
36 ALA 1.11 1.03 1
38 TYR -6.46 -1.44 1
39 LEU -3.01 -1.01 1
40 LEU -3.23 -1.76 1
41 SER -3.86 -2.04 1
42 PHE -3.43 -1.18 1
43 HIS -4.02 0.23 1
44 THR -1.28 -1.59 1
48 GLN -0.36 -0.11 1
49 THR 2.14 1.81 1
50 GLN -2.41 -1.05 1
51 GLU -4.77 -1.59 1
52 ILE -3.65 -0.49 1
53 LEU -1.06 -0.87 1
54 LEU -4.13 -1.62 1
58 ILE -2.94 -1.42 1
59 THR -1.77 -2.39 1
60 SER -3.61 -1.52 1
62 GLN -1.56 -1.28 1
63 LEU -1.31 -0.85 1
64 LEU -4.50 -1.83 1
66 LEU 0.08 -1.69 1
67 PHE -1.46 -0.65 1
69 SER 1.68 -0.06 1
70 THR -0.76 0.87 1
71 SER -0.20 -0.31 1
72 TYR -4.77 -0.33 1
73 ASN -3.60 -0.90 1
74 ALA -5.78 -2.25 1
75 ARG -4.63 -1.56 1
76 LEU -6.24 -1.68 1
77 GLN -5.76 -1.50 1
78 ALA -1.96 -0.65 1
79 MET -3.47 -0.61 1
80 TRP -1.44 0.06 1
82 GLN 0.60 0.22 1
83 SER -1.06 -0.10 1
84 LEU -2.70 -1.00 1
85 LEU 1.41 0.49 1
88 VAL -2.17 -1.33 1
89 SER -3.90 -0.69 1
90 THR 0.18 -0.25 1
91 SER -3.81 -1.34 1
92 PHE -2.18 -1.16 1
93 THR -2.77 -1.12 1
94 THR -0.28 -0.38 1
97 LEU -0.91 -0.29 1
98 ARG 0.14 -0.03 1
99 ILE -0.15 -0.08 1
100 SER -0.32 -0.11 1
103 SER 0.11 0.11 1
104 SER -0.37 -0.06 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11110_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -6.46
_LACS_plot.Line_1_terminator_val_y_1 4.40
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -1.65
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.94
_LACS_plot.Line_2_terminator_val_x_2 2.41
_LACS_plot.Line_2_terminator_val_y_2 -1.15
_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
61 HIS -2.90 5.46 0
10 ALA -1.27 1.02 1
12 ARG -4.30 2.93 1
13 ASP 2.37 -1.60 1
14 LEU 0.27 0.26 1
15 GLU -5.74 4.29 1
16 ALA -2.20 0.00 1
17 LYS -3.66 2.30 1
18 GLU 0.55 -1.30 1
19 VAL 1.92 -0.54 1
20 THR 2.41 -1.22 1
22 ARG -5.05 3.17 1
23 THR -5.75 3.20 1
24 ALA -3.92 3.92 1
25 LEU -3.10 1.58 1
26 LEU -2.50 0.67 1
27 THR -3.82 2.11 1
28 TRP -1.10 0.56 1
29 THR -0.33 -0.08 1
30 GLU 0.38 1.26 1
33 VAL -0.88 -0.26 1
34 ARG 0.75 0.46 1
36 ALA 1.11 -0.08 1
38 TYR -6.46 5.02 1
39 LEU -3.01 2.00 1
40 LEU -3.23 1.47 1
41 SER -3.86 1.82 1
42 PHE -3.43 2.25 1
43 HIS -4.02 4.25 1
44 THR -1.28 -0.31 1
48 GLN -0.36 0.25 1
49 THR 2.14 -0.33 1
50 GLN -2.41 1.36 1
51 GLU -4.77 3.18 1
52 ILE -3.65 3.16 1
53 LEU -1.06 0.19 1
54 LEU -4.13 2.51 1
58 ILE -2.94 1.52 1
59 THR -1.77 -0.62 1
60 SER -3.61 2.09 1
62 GLN -1.56 0.28 1
63 LEU -1.31 0.46 1
64 LEU -4.50 2.67 1
66 LEU 0.08 -1.77 1
67 PHE -1.46 0.81 1
69 SER 1.68 -1.74 1
70 THR -0.76 1.63 1
71 SER -0.20 -0.11 1
72 TYR -4.77 4.44 1
73 ASN -3.60 2.70 1
74 ALA -5.78 3.53 1
75 ARG -4.63 3.07 1
76 LEU -6.24 4.56 1
77 GLN -5.76 4.26 1
78 ALA -1.96 1.31 1
79 MET -3.47 2.86 1
80 TRP -1.44 1.50 1
82 GLN 0.60 -0.38 1
83 SER -1.06 0.96 1
84 LEU -2.70 1.70 1
85 LEU 1.41 -0.92 1
88 VAL -2.17 0.84 1
89 SER -3.90 3.21 1
90 THR 0.18 -0.43 1
91 SER -3.81 2.47 1
92 PHE -2.18 1.02 1
93 THR -2.77 1.65 1
94 THR -0.28 -0.10 1
97 LEU -0.91 0.62 1
98 ARG 0.14 -0.17 1
99 ILE -0.15 0.07 1
100 SER -0.32 0.21 1
103 SER 0.11 0.00 1
104 SER -0.37 0.31 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11110_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -6.46
_LACS_plot.Line_1_terminator_val_y_1 0.74
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.16
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.28
_LACS_plot.Line_2_terminator_val_x_2 2.41
_LACS_plot.Line_2_terminator_val_y_2 -0.21
_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
59 THR -1.77 -1.37 0
10 ALA -1.27 0.01 1
12 ARG -4.30 0.43 1
13 ASP 2.37 -0.36 1
14 LEU 0.27 0.89 1
15 GLU -5.74 0.39 1
16 ALA -2.20 0.56 1
17 LYS -3.66 0.12 1
18 GLU 0.55 -0.43 1
19 VAL 1.92 0.04 1
20 THR 2.41 0.40 1
22 ARG -5.05 0.37 1
23 THR -5.75 0.66 1
24 ALA -3.92 0.01 1
25 LEU -3.10 0.24 1
26 LEU -2.50 0.91 1
27 THR -3.82 0.51 1
28 TRP -1.10 0.25 1
29 THR -0.33 0.09 1
30 GLU 0.38 -0.06 1
33 VAL -0.88 -0.01 1
34 ARG 0.75 -0.42 1
36 ALA 1.11 -0.18 1
38 TYR -6.46 0.68 1
39 LEU -3.01 0.63 1
40 LEU -3.23 0.98 1
41 SER -3.86 1.49 1
42 PHE -3.43 1.32 1
43 HIS -4.02 0.47 1
44 THR -1.28 0.29 1
48 GLN -0.36 0.01 1
49 THR 2.14 0.05 1
50 GLN -2.41 0.10 1
51 GLU -4.77 0.88 1
52 ILE -3.65 0.14 1
53 LEU -1.06 0.67 1
54 LEU -4.13 0.33 1
58 ILE -2.94 0.39 1
60 SER -3.61 0.17 1
61 HIS -2.90 -0.17 1
62 GLN -1.56 0.12 1
63 LEU -1.31 0.01 1
64 LEU -4.50 0.40 1
66 LEU 0.08 -0.18 1
67 PHE -1.46 0.24 1
69 SER 1.68 -0.60 1
70 THR -0.76 0.10 1
71 SER -0.20 0.45 1
72 TYR -4.77 0.05 1
73 ASN -3.60 0.43 1
74 ALA -5.78 1.23 1
75 ARG -4.63 0.79 1
76 LEU -6.24 0.63 1
77 GLN -5.76 0.62 1
78 ALA -1.96 0.08 1
79 MET -3.47 0.49 1
80 TRP -1.44 -0.03 1
82 GLN 0.60 0.01 1
83 SER -1.06 0.17 1
84 LEU -2.70 0.59 1
85 LEU 1.41 -0.01 1
88 VAL -2.17 0.47 1
89 SER -3.90 1.30 1
90 THR 0.18 0.43 1
91 SER -3.81 1.18 1
92 PHE -2.18 0.38 1
93 THR -2.77 1.03 1
94 THR -0.28 -0.22 1
97 LEU -0.91 0.03 1
98 ARG 0.14 0.01 1
99 ILE -0.15 0.04 1
100 SER -0.32 0.03 1
103 SER 0.11 0.03 1
104 SER -0.37 0.01 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11110_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -6.46
_LACS_plot.Line_1_terminator_val_y_1 -2.31
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.48
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.36
_LACS_plot.Line_2_terminator_val_x_2 2.41
_LACS_plot.Line_2_terminator_val_y_2 -0.34
_LACS_plot.Y_axis_chem_shift_offset 0.90
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
90 THR 0.18 -3.24 0
94 THR -0.28 1.49 0
24 ALA -3.92 -4.36 0
10 ALA -1.27 -0.19 1
12 ARG -4.30 -1.53 1
13 ASP 2.37 -1.66 1
14 LEU 0.27 -1.04 1
15 GLU -5.74 -2.86 1
16 ALA -2.20 -1.98 1
17 LYS -3.66 -2.31 1
18 GLU 0.55 -1.50 1
19 VAL 1.92 0.66 1
20 THR 2.41 0.37 1
22 ARG -5.05 -0.24 1
23 THR -5.75 -3.21 1
25 LEU -3.10 -2.79 1
26 LEU -2.50 -1.37 1
27 THR -3.82 -2.02 1
28 TRP -1.10 -2.53 1
29 THR -0.33 0.17 1
30 GLU 0.38 -0.86 1
33 VAL -0.88 -1.12 1
34 ARG 0.75 0.10 1
36 ALA 1.11 0.34 1
38 TYR -6.46 -1.99 1
39 LEU -3.01 -2.04 1
40 LEU -3.23 -3.22 1
41 SER -3.86 -0.98 1
42 PHE -3.43 -2.37 1
48 GLN -0.36 0.81 1
49 THR 2.14 -0.74 1
50 GLN -2.41 -1.93 1
51 GLU -4.77 -0.75 1
52 ILE -3.65 -2.82 1
53 LEU -1.06 -1.22 1
54 LEU -4.13 -0.86 1
58 ILE -2.94 -0.70 1
59 THR -1.77 -2.76 1
60 SER -3.61 -1.38 1
61 HIS -2.90 -1.30 1
62 GLN -1.56 -2.35 1
63 LEU -1.31 -1.57 1
64 LEU -4.50 -0.72 1
66 LEU 0.08 -2.18 1
67 PHE -1.46 -0.12 1
69 SER 1.68 -0.46 1
70 THR -0.76 -2.88 1
71 SER -0.20 -2.29 1
72 TYR -4.77 -1.12 1
73 ASN -3.60 -1.58 1
74 ALA -5.78 -2.96 1
75 ARG -4.63 -2.73 1
76 LEU -6.24 -1.62 1
77 GLN -5.76 -1.22 1
78 ALA -1.96 -3.08 1
79 MET -3.47 -1.82 1
80 TRP -1.44 0.01 1
82 GLN 0.60 -0.25 1
83 SER -1.06 -2.04 1
84 LEU -2.70 -0.33 1
85 LEU 1.41 -1.58 1
88 VAL -2.17 -1.39 1
89 SER -3.90 -0.72 1
91 SER -3.81 -2.03 1
92 PHE -2.18 -3.51 1
93 THR -2.77 0.32 1
97 LEU -0.91 -0.40 1
98 ARG 0.14 -0.14 1
99 ILE -0.15 -0.20 1
100 SER -0.32 -0.21 1
103 SER 0.11 0.02 1
104 SER -0.37 -0.69 1
stop_
save_