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 bmr11128_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -6.82
_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 -1.79
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -3.74
_LACS_plot.Line_2_terminator_val_x_2 4.68
_LACS_plot.Line_2_terminator_val_y_2 0.99
_LACS_plot.Y_axis_chem_shift_offset 2.35
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
86 MET -6.29 -2.17 0
71 HIS -4.57 -0.95 0
10 ALA -0.02 -2.09 1
13 TYR -4.03 -3.23 1
14 ILE 2.81 -0.06 1
15 THR 0.75 -2.08 1
16 PHE -3.34 -1.86 1
17 THR -4.25 -4.27 1
18 ASP -4.91 -2.83 1
19 ALA -0.66 -2.82 1
20 VAL 1.14 -0.75 1
21 ASN 1.79 -2.44 1
22 GLU 2.29 -0.55 1
23 THR -3.38 -3.89 1
24 THR -2.19 -2.71 1
25 ILE -5.02 -3.09 1
26 MET -3.43 -3.79 1
27 LEU -4.85 -2.93 1
28 LYS -4.93 -3.35 1
29 TRP -4.64 -3.53 1
30 MET -5.36 -4.02 1
31 TYR -1.76 -1.53 1
32 ILE -0.99 -3.67 1
34 ALA 1.02 -1.42 1
35 SER 2.12 -0.70 1
36 ASN 1.42 -1.67 1
37 ASN -0.24 -2.32 1
38 ASN 1.66 -1.54 1
39 THR 0.32 -1.92 1
41 ILE -1.93 -3.97 1
42 HIS -3.55 -2.25 1
44 PHE -4.79 -4.28 1
45 TYR -6.82 -5.67 1
46 ILE -1.47 -2.58 1
47 TYR -2.83 -3.96 1
48 TYR -4.57 -5.27 1
49 ARG -2.40 -2.75 1
51 THR 2.82 1.03 1
52 ASP 1.23 -2.27 1
53 SER 0.06 -2.12 1
54 ASP -0.96 -2.81 1
55 ASN -0.21 -1.89 1
56 ASP 2.27 -0.86 1
57 SER 1.42 -1.25 1
58 ASP 0.37 -1.88 1
59 TYR 1.42 -0.47 1
60 LYS -1.16 -2.92 1
61 LYS -4.90 -4.15 1
62 ASP -3.65 -4.11 1
63 MET -2.15 -2.56 1
64 VAL -4.42 -3.95 1
65 GLU 0.59 -1.24 1
67 ASP -0.53 -3.86 1
68 ARG -2.54 -3.40 1
69 TYR -0.47 -4.13 1
70 TRP -4.18 -4.36 1
72 SER -2.08 -4.14 1
73 ILE -0.82 -2.65 1
74 SER -3.34 -3.68 1
75 HIS 4.56 -0.09 1
76 LEU -0.49 -3.98 1
77 GLN -2.22 -3.20 1
79 GLU -0.25 -2.67 1
80 THR -1.53 -1.65 1
81 SER 0.05 -2.42 1
82 TYR -1.23 -1.05 1
83 ASP -1.99 -3.49 1
84 ILE -4.55 -3.38 1
85 LYS -4.30 -3.35 1
87 GLN -6.42 -3.25 1
89 PHE -4.50 -3.53 1
90 ASN -0.61 -3.38 1
91 GLU 3.37 0.04 1
94 GLU -4.45 -3.99 1
95 SER -3.76 -2.46 1
96 GLU -0.50 -2.30 1
97 PHE 0.53 -0.26 1
98 SER -3.52 -2.53 1
99 ASN 4.68 -0.71 1
100 VAL -0.57 -3.21 1
101 MET -5.57 -4.92 1
102 ILE -2.64 -3.75 1
104 GLU -5.05 -4.98 1
105 THR 0.04 -2.65 1
106 LYS -0.47 -2.35 1
107 ALA -1.36 -3.17 1
108 ARG 1.03 -1.47 1
109 SER -0.24 -2.25 1
112 SER -0.18 -2.32 1
113 SER -0.29 -2.39 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11128_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -6.82
_LACS_plot.Line_1_terminator_val_y_1 2.42
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -3.79
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.74
_LACS_plot.Line_2_terminator_val_x_2 4.68
_LACS_plot.Line_2_terminator_val_y_2 -3.69
_LACS_plot.Y_axis_chem_shift_offset 2.35
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
86 MET -6.29 4.12 0
71 HIS -4.57 3.62 0
10 ALA -0.02 -2.07 1
13 TYR -4.03 0.80 1
14 ILE 2.81 -2.87 1
15 THR 0.75 -2.83 1
16 PHE -3.34 1.48 1
17 THR -4.25 -0.02 1
18 ASP -4.91 2.08 1
19 ALA -0.66 -2.16 1
20 VAL 1.14 -1.89 1
21 ASN 1.79 -4.23 1
22 GLU 2.29 -2.84 1
23 THR -3.38 -0.51 1
24 THR -2.19 -0.52 1
25 ILE -5.02 1.93 1
26 MET -3.43 -0.36 1
27 LEU -4.85 1.92 1
28 LYS -4.93 1.58 1
29 TRP -4.64 1.11 1
30 MET -5.36 1.34 1
31 TYR -1.76 0.23 1
32 ILE -0.99 -2.68 1
34 ALA 1.02 -2.44 1
35 SER 2.12 -2.82 1
36 ASN 1.42 -3.09 1
37 ASN -0.24 -2.08 1
38 ASN 1.66 -3.20 1
39 THR 0.32 -2.24 1
41 ILE -1.93 -2.04 1
42 HIS -3.55 1.30 1
44 PHE -4.79 0.51 1
45 TYR -6.82 1.15 1
46 ILE -1.47 -1.11 1
47 TYR -2.83 -1.13 1
48 TYR -4.57 -0.70 1
49 ARG -2.40 -0.35 1
51 THR 2.82 -1.79 1
52 ASP 1.23 -3.50 1
53 SER 0.06 -2.18 1
54 ASP -0.96 -1.85 1
55 ASN -0.21 -1.68 1
56 ASP 2.27 -3.13 1
57 SER 1.42 -2.67 1
58 ASP 0.37 -2.25 1
59 TYR 1.42 -1.89 1
60 LYS -1.16 -1.76 1
61 LYS -4.90 0.75 1
62 ASP -3.65 -0.46 1
63 MET -2.15 -0.41 1
64 VAL -4.42 0.47 1
65 GLU 0.59 -1.83 1
67 ASP -0.53 -3.33 1
68 ARG -2.54 -0.86 1
69 TYR -0.47 -3.66 1
70 TRP -4.18 -0.18 1
72 SER -2.08 -2.06 1
73 ILE -0.82 -1.83 1
74 SER -3.34 -0.34 1
75 HIS 4.56 -4.65 1
76 LEU -0.49 -3.49 1
77 GLN -2.22 -0.98 1
79 GLU -0.25 -2.42 1
80 THR -1.53 -0.12 1
81 SER 0.05 -2.47 1
82 TYR -1.23 0.18 1
83 ASP -1.99 -1.50 1
84 ILE -4.55 1.17 1
85 LYS -4.30 0.95 1
87 GLN -6.42 3.17 1
89 PHE -4.50 0.97 1
90 ASN -0.61 -2.77 1
91 GLU 3.37 -3.33 1
94 GLU -4.45 0.46 1
95 SER -3.76 1.30 1
96 GLU -0.50 -1.80 1
97 PHE 0.53 -0.79 1
98 SER -3.52 0.99 1
99 ASN 4.68 -5.39 1
100 VAL -0.57 -2.64 1
101 MET -5.57 0.65 1
102 ILE -2.64 -1.11 1
104 GLU -5.05 0.07 1
105 THR 0.04 -2.69 1
106 LYS -0.47 -1.88 1
107 ALA -1.36 -1.81 1
108 ARG 1.03 -2.50 1
109 SER -0.24 -2.01 1
112 SER -0.18 -2.14 1
113 SER -0.29 -2.10 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11128_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -6.82
_LACS_plot.Line_1_terminator_val_y_1 0.76
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.32
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.15
_LACS_plot.Line_2_terminator_val_x_2 4.68
_LACS_plot.Line_2_terminator_val_y_2 -0.63
_LACS_plot.Y_axis_chem_shift_offset 0.08
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
48 TYR -4.57 1.75 0
69 TYR -0.47 -1.45 0
10 ALA -0.02 -0.05 1
13 TYR -4.03 0.39 1
14 ILE 2.81 0.10 1
15 THR 0.75 -0.13 1
16 PHE -3.34 0.15 1
17 THR -4.25 0.69 1
18 ASP -4.91 -0.08 1
19 ALA -0.66 0.21 1
20 VAL 1.14 -0.37 1
21 ASN 1.79 -0.40 1
22 GLU 2.29 0.03 1
23 THR -3.38 0.10 1
24 THR -2.19 1.16 1
25 ILE -5.02 0.22 1
26 MET -3.43 0.80 1
27 LEU -4.85 1.24 1
28 LYS -4.93 0.76 1
29 TRP -4.64 0.94 1
30 MET -5.36 0.42 1
31 TYR -1.76 0.29 1
32 ILE -0.99 -0.15 1
34 ALA 1.02 -0.25 1
35 SER 2.12 -0.33 1
36 ASN 1.42 -0.25 1
37 ASN -0.24 0.09 1
38 ASN 1.66 -0.46 1
39 THR 0.32 -0.15 1
41 ILE -1.93 -0.24 1
42 HIS -3.55 -0.26 1
44 PHE -4.79 0.29 1
45 TYR -6.82 0.98 1
46 ILE -1.47 0.09 1
47 TYR -2.83 1.11 1
49 ARG -2.40 0.56 1
51 THR 2.82 -0.66 1
52 ASP 1.23 -0.28 1
53 SER 0.06 -0.26 1
54 ASP -0.96 -0.14 1
55 ASN -0.21 -0.17 1
56 ASP 2.27 -0.23 1
57 SER 1.42 -0.21 1
58 ASP 0.37 -0.13 1
59 TYR 1.42 -0.32 1
60 LYS -1.16 -0.17 1
61 LYS -4.90 0.80 1
62 ASP -3.65 0.37 1
63 MET -2.15 0.73 1
64 VAL -4.42 0.12 1
65 GLU 0.59 -0.15 1
67 ASP -0.53 0.02 1
68 ARG -2.54 -0.16 1
70 TRP -4.18 0.23 1
71 HIS -4.57 -0.24 1
72 SER -2.08 0.66 1
73 ILE -0.82 -0.52 1
74 SER -3.34 0.57 1
75 HIS 4.56 -0.65 1
76 LEU -0.49 -0.02 1
77 GLN -2.22 0.00 1
79 GLU -0.25 -0.72 1
80 THR -1.53 0.06 1
81 SER 0.05 0.04 1
82 TYR -1.23 0.15 1
83 ASP -1.99 0.38 1
84 ILE -4.55 1.11 1
85 LYS -4.30 0.42 1
86 MET -6.29 1.37 1
87 GLN -6.42 0.17 1
89 PHE -4.50 0.67 1
90 ASN -0.61 -0.87 1
91 GLU 3.37 -0.28 1
94 GLU -4.45 0.51 1
95 SER -3.76 -0.09 1
96 GLU -0.50 -0.19 1
97 PHE 0.53 0.08 1
98 SER -3.52 0.25 1
99 ASN 4.68 -0.31 1
100 VAL -0.57 0.49 1
101 MET -5.57 0.35 1
102 ILE -2.64 1.16 1
104 GLU -5.05 1.13 1
105 THR 0.04 -0.45 1
106 LYS -0.47 -0.25 1
107 ALA -1.36 -0.09 1
108 ARG 1.03 -0.26 1
109 SER -0.24 -0.09 1
112 SER -0.18 -0.06 1
113 SER -0.29 -0.10 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11128_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -6.82
_LACS_plot.Line_1_terminator_val_y_1 -4.42
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -2.36
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -3.35
_LACS_plot.Line_2_terminator_val_x_2 4.68
_LACS_plot.Line_2_terminator_val_y_2 -1.58
_LACS_plot.Y_axis_chem_shift_offset 2.83
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
97 PHE 0.53 -0.12 0
22 GLU 2.29 -4.64 0
99 ASN 4.68 -3.30 0
10 ALA -0.02 -2.09 1
13 TYR -4.03 -2.98 1
14 ILE 2.81 -2.49 1
15 THR 0.75 -1.26 1
16 PHE -3.34 -3.89 1
17 THR -4.25 -4.65 1
18 ASP -4.91 -4.16 1
19 ALA -0.66 -3.55 1
20 VAL 1.14 -2.09 1
21 ASN 1.79 -3.03 1
23 THR -3.38 -2.49 1
24 THR -2.19 -3.32 1
25 ILE -5.02 -5.66 1
26 MET -3.43 -4.97 1
27 LEU -4.85 -5.23 1
28 LYS -4.93 -3.83 1
29 TRP -4.64 -5.06 1
30 MET -5.36 -3.86 1
31 TYR -1.76 -5.56 1
32 ILE -0.99 -3.43 1
34 ALA 1.02 -1.49 1
35 SER 2.12 -2.52 1
37 ASN -0.24 -2.63 1
38 ASN 1.66 -2.97 1
39 THR 0.32 -3.08 1
41 ILE -1.93 -2.84 1
42 HIS -3.55 -1.10 1
44 PHE -4.79 -3.58 1
45 TYR -6.82 -3.18 1
46 ILE -1.47 -4.92 1
47 TYR -2.83 -2.40 1
48 TYR -4.57 -3.01 1
49 ARG -2.40 -5.33 1
51 THR 2.82 -2.12 1
52 ASP 1.23 -2.85 1
53 SER 0.06 -2.82 1
54 ASP -0.96 -2.22 1
55 ASN -0.21 -1.25 1
56 ASP 2.27 -1.61 1
57 SER 1.42 -2.64 1
58 ASP 0.37 -1.88 1
59 TYR 1.42 -0.95 1
60 LYS -1.16 -4.92 1
61 LYS -4.90 -3.65 1
62 ASP -3.65 -3.82 1
63 MET -2.15 -3.76 1
64 VAL -4.42 -4.23 1
65 GLU 0.59 -2.45 1
67 ASP -0.53 -3.37 1
68 ARG -2.54 -4.92 1
69 TYR -0.47 -5.10 1
70 TRP -4.18 -4.35 1
71 HIS -4.57 -4.00 1
72 SER -2.08 -4.51 1
73 ILE -0.82 -4.11 1
74 SER -3.34 -3.72 1
75 HIS 4.56 -1.24 1
76 LEU -0.49 -4.11 1
77 GLN -2.22 -2.32 1
79 GLU -0.25 -4.41 1
80 THR -1.53 -4.96 1
81 SER 0.05 -2.72 1
82 TYR -1.23 -4.93 1
83 ASP -1.99 -2.18 1
84 ILE -4.55 -4.41 1
85 LYS -4.30 -5.07 1
86 MET -6.29 -4.13 1
87 GLN -6.42 -2.83 1
89 PHE -4.50 -5.07 1
90 ASN -0.61 -2.66 1
91 GLU 3.37 -1.79 1
94 GLU -4.45 -2.69 1
95 SER -3.76 -2.21 1
96 GLU -0.50 -1.01 1
98 SER -3.52 -4.08 1
100 VAL -0.57 -1.55 1
101 MET -5.57 -4.82 1
102 ILE -2.64 -1.84 1
104 GLU -5.05 -1.70 1
105 THR 0.04 -2.10 1
106 LYS -0.47 -3.60 1
107 ALA -1.36 -2.40 1
108 ARG 1.03 -1.74 1
109 SER -0.24 -2.35 1
112 SER -0.18 -2.35 1
113 SER -0.29 -2.29 1
stop_
save_