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 bmr15089_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -4.30
_LACS_plot.Line_1_terminator_val_y_1 -2.30
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 1.46
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.42
_LACS_plot.Line_2_terminator_val_x_2 7.80
_LACS_plot.Line_2_terminator_val_y_2 6.03
_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
87 ILE -4.30 -2.10 0
95 PHE -0.80 -2.70 0
11 THR 1.80 1.70 1
12 ALA 3.00 3.10 1
13 ILE 4.80 3.70 1
14 GLU 3.60 3.10 1
15 LYS 3.00 0.80 1
16 ALA 3.40 3.40 1
17 LEU 4.10 2.80 1
18 ASP 4.50 3.10 1
19 PHE 2.20 0.90 1
20 ILE 4.50 3.90 1
23 MET 2.20 0.70 1
24 ASN 2.30 -0.40 1
25 THR 0.80 0.10 1
26 SER 0.27 0.50 1
27 ALA -1.20 -0.10 1
28 SER 1.90 1.60 1
29 VAL -1.10 -0.50 1
31 HIS -0.30 1.30 1
32 SER 4.00 3.50 1
34 ASP 3.00 2.60 1
35 GLU 3.80 2.80 1
36 SER 5.50 5.00 1
37 THR 7.80 6.10 1
38 ALA 4.40 3.30 1
39 LYS 4.00 5.00 1
41 ILE 4.50 4.50 1
42 LEU 2.90 2.80 1
43 LYS 3.60 3.40 1
44 TYR 2.50 3.90 1
45 LEU 5.90 3.00 1
46 HIS 6.20 5.90 1
47 ASP 4.60 2.90 1
48 LEU -0.20 0.10 1
50 VAL -0.80 -1.10 1
52 VAL -1.00 -1.00 1
53 SER -0.20 -0.20 1
55 GLU 5.10 4.00 1
56 VAL 4.50 2.90 1
57 VAL 6.00 4.70 1
58 VAL 5.00 4.00 1
59 ALA 3.30 2.30 1
60 ARG 3.40 1.00 1
62 GLU 2.70 2.30 1
63 GLN 3.20 3.10 1
64 GLU -1.70 -0.40 1
66 TRP -3.30 -2.40 1
67 ASN 1.00 1.40 1
69 GLU 2.50 2.20 1
70 PHE 5.90 4.80 1
71 THR 7.00 5.30 1
72 LYS 3.80 3.60 1
73 LYS 3.90 2.00 1
74 VAL 5.60 3.40 1
75 ALA 4.20 3.10 1
77 TRP 3.00 1.30 1
78 ALA 5.00 2.80 1
79 GLU 3.10 3.00 1
80 LYS 3.70 3.20 1
81 VAL 4.40 3.50 1
82 ALA 3.30 2.20 1
83 SER 0.60 0.90 1
85 ASN -1.10 0.20 1
86 ARG 1.10 0.50 1
88 LEU -0.30 -0.40 1
89 ILE -0.50 -0.40 1
90 LYS 2.60 2.50 1
91 ASN -0.50 1.00 1
93 GLU 3.70 1.60 1
94 TYR 2.00 0.70 1
96 SER -2.20 -0.20 1
97 THR 5.60 4.20 1
98 TYR 3.50 2.80 1
99 MET 3.30 4.10 1
100 GLN 4.80 3.70 1
101 GLU 3.40 2.80 1
102 GLN 3.20 3.40 1
103 LEU 3.60 3.00 1
104 LYS 5.00 4.20 1
105 GLU 3.10 2.60 1
106 LEU 2.40 1.90 1
107 VAL 5.10 4.00 1
108 LEU 2.80 2.10 1
109 GLU 1.70 1.50 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr15089_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -4.30
_LACS_plot.Line_1_terminator_val_y_1 2.00
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.54
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.58
_LACS_plot.Line_2_terminator_val_x_2 7.80
_LACS_plot.Line_2_terminator_val_y_2 -1.77
_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
87 ILE -4.30 2.20 0
95 PHE -0.80 -1.90 0
11 THR 1.80 -0.10 1
12 ALA 3.00 0.10 1
13 ILE 4.80 -1.10 1
14 GLU 3.60 -0.50 1
15 LYS 3.00 -2.20 1
16 ALA 3.40 0.00 1
17 LEU 4.10 -1.30 1
18 ASP 4.50 -1.40 1
19 PHE 2.20 -1.30 1
20 ILE 4.50 -0.60 1
23 MET 2.20 -1.50 1
24 ASN 2.30 -2.70 1
25 THR 0.80 -0.70 1
26 SER 0.27 0.23 1
27 ALA -1.20 1.10 1
28 SER 1.90 -0.30 1
29 VAL -1.10 0.60 1
31 HIS -0.30 1.60 1
32 SER 4.00 -0.50 1
34 ASP 3.00 -0.40 1
35 GLU 3.80 -1.00 1
36 SER 5.50 -0.50 1
37 THR 7.80 -1.70 1
38 ALA 4.40 -1.10 1
39 LYS 4.00 1.00 1
41 ILE 4.50 0.00 1
42 LEU 2.90 -0.10 1
43 LYS 3.60 -0.20 1
44 TYR 2.50 1.40 1
45 LEU 5.90 -2.90 1
46 HIS 6.20 -0.30 1
47 ASP 4.60 -1.70 1
48 LEU -0.20 0.30 1
50 VAL -0.80 -0.30 1
52 VAL -1.00 0.00 1
53 SER -0.20 0.00 1
55 GLU 5.10 -1.10 1
56 VAL 4.50 -1.60 1
57 VAL 6.00 -1.30 1
58 VAL 5.00 -1.00 1
59 ALA 3.30 -1.00 1
60 ARG 3.40 -2.40 1
62 GLU 2.70 -0.40 1
63 GLN 3.20 -0.10 1
64 GLU -1.70 1.30 1
66 TRP -3.30 0.90 1
67 ASN 1.00 0.40 1
69 GLU 2.50 -0.30 1
70 PHE 5.90 -1.10 1
71 THR 7.00 -1.70 1
72 LYS 3.80 -0.20 1
73 LYS 3.90 -1.90 1
74 VAL 5.60 -2.20 1
75 ALA 4.20 -1.10 1
77 TRP 3.00 -1.70 1
78 ALA 5.00 -2.20 1
79 GLU 3.10 -0.10 1
80 LYS 3.70 -0.50 1
81 VAL 4.40 -0.90 1
82 ALA 3.30 -1.10 1
83 SER 0.60 0.30 1
85 ASN -1.10 1.30 1
86 ARG 1.10 -0.60 1
88 LEU -0.30 -0.10 1
89 ILE -0.50 0.10 1
90 LYS 2.60 -0.10 1
91 ASN -0.50 1.50 1
93 GLU 3.70 -2.10 1
94 TYR 2.00 -1.30 1
96 SER -2.20 2.00 1
97 THR 5.60 -1.40 1
98 TYR 3.50 -0.70 1
99 MET 3.30 0.80 1
100 GLN 4.80 -1.10 1
101 GLU 3.40 -0.60 1
102 GLN 3.20 0.20 1
103 LEU 3.60 -0.60 1
104 LYS 5.00 -0.80 1
105 GLU 3.10 -0.50 1
106 LEU 2.40 -0.50 1
107 VAL 5.10 -1.10 1
108 LEU 2.80 -0.70 1
109 GLU 1.70 -0.20 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr15089_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -4.30
_LACS_plot.Line_1_terminator_val_y_1 0.18
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.23
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.06
_LACS_plot.Line_2_terminator_val_x_2 7.80
_LACS_plot.Line_2_terminator_val_y_2 -0.68
_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
25 THR 0.80 -0.90 0
11 THR 1.80 -0.16 1
12 ALA 3.00 -0.36 1
13 ILE 4.80 -0.65 1
14 GLU 3.60 -0.53 1
15 LYS 3.00 -0.39 1
16 ALA 3.40 -0.31 1
17 LEU 4.10 -0.12 1
18 ASP 4.50 -0.12 1
19 PHE 2.20 0.12 1
20 ILE 4.50 -0.17 1
23 MET 2.20 -0.04 1
24 ASN 2.30 -0.01 1
26 SER 0.27 0.05 1
27 ALA -1.20 -0.04 1
28 SER 1.90 -0.24 1
29 VAL -1.10 -0.12 1
31 HIS -0.30 -0.18 1
32 SER 4.00 -0.23 1
34 ASP 3.00 -0.04 1
35 GLU 3.80 -0.63 1
36 SER 5.50 -0.47 1
37 THR 7.80 -0.69 1
38 ALA 4.40 -0.47 1
39 LYS 4.00 -0.77 1
41 ILE 4.50 -1.10 1
42 LEU 2.90 -0.34 1
43 LYS 3.60 -0.40 1
44 TYR 2.50 -0.20 1
45 LEU 5.90 -0.52 1
46 HIS 6.20 -0.97 1
47 ASP 4.60 -0.36 1
48 LEU -0.20 -0.13 1
50 VAL -0.80 -0.07 1
52 VAL -1.00 -0.29 1
53 SER -0.20 -0.04 1
55 GLU 5.10 -0.45 1
56 VAL 4.50 -0.20 1
57 VAL 6.00 -0.67 1
58 VAL 5.00 -0.79 1
59 ALA 3.30 -0.26 1
60 ARG 3.40 -0.41 1
62 GLU 2.70 -0.36 1
63 GLN 3.20 -0.37 1
64 GLU -1.70 -0.12 1
66 TRP -3.30 -0.11 1
67 ASN 1.00 -0.23 1
69 GLU 2.50 -0.20 1
70 PHE 5.90 -0.81 1
71 THR 7.00 -0.74 1
72 LYS 3.80 -0.57 1
73 LYS 3.90 -0.77 1
74 VAL 5.60 -1.07 1
75 ALA 4.20 -0.47 1
77 TRP 3.00 -0.02 1
78 ALA 5.00 -0.20 1
79 GLU 3.10 -0.36 1
80 LYS 3.70 -0.26 1
81 VAL 4.40 -0.54 1
82 ALA 3.30 -0.24 1
83 SER 0.60 0.00 1
85 ASN -1.10 -0.10 1
86 ARG 1.10 -0.09 1
87 ILE -4.30 0.25 1
88 LEU -0.30 -0.02 1
89 ILE -0.50 -0.08 1
90 LYS 2.60 -0.37 1
91 ASN -0.50 0.03 1
93 GLU 3.70 -0.25 1
94 TYR 2.00 -0.04 1
95 PHE -0.80 0.43 1
96 SER -2.20 -0.25 1
97 THR 5.60 -0.77 1
98 TYR 3.50 -0.24 1
99 MET 3.30 -0.79 1
100 GLN 4.80 -1.05 1
101 GLU 3.40 -0.39 1
102 GLN 3.20 -0.28 1
103 LEU 3.60 -0.15 1
104 LYS 5.00 -0.48 1
105 GLU 3.10 -0.28 1
106 LEU 2.40 -0.08 1
107 VAL 5.10 -0.36 1
108 LEU 2.80 -0.22 1
109 GLU 1.70 -0.22 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr15089_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -4.30
_LACS_plot.Line_1_terminator_val_y_1 -1.43
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 0.88
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -0.46
_LACS_plot.Line_2_terminator_val_x_2 7.80
_LACS_plot.Line_2_terminator_val_y_2 2.86
_LACS_plot.Y_axis_chem_shift_offset -0.18
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
50 VAL -0.80 4.50 0
11 THR 1.80 1.90 1
12 ALA 3.00 0.70 1
13 ILE 4.80 0.70 1
14 GLU 3.60 1.80 1
15 LYS 3.00 1.10 1
16 ALA 3.40 1.80 1
17 LEU 4.10 2.10 1
18 ASP 4.50 4.20 1
19 PHE 2.20 4.80 1
20 ILE 4.50 0.80 1
23 MET 2.20 -2.00 1
24 ASN 2.30 0.70 1
25 THR 0.80 -0.80 1
26 SER 0.27 0.00 1
27 ALA -1.20 -1.80 1
28 SER 1.90 -0.50 1
29 VAL -1.10 -1.30 1
34 ASP 3.00 0.80 1
35 GLU 3.80 1.40 1
36 SER 5.50 1.90 1
37 THR 7.80 0.60 1
38 ALA 4.40 1.30 1
39 LYS 4.00 1.20 1
41 ILE 4.50 0.40 1
42 LEU 2.90 2.80 1
43 LYS 3.60 0.20 1
44 TYR 2.50 2.10 1
45 LEU 5.90 1.70 1
46 HIS 6.20 4.70 1
47 ASP 4.60 1.50 1
48 LEU -0.20 -0.70 1
52 VAL -1.00 -1.20 1
53 SER -0.20 0.50 1
55 GLU 5.10 3.20 1
56 VAL 4.50 2.00 1
57 VAL 6.00 0.60 1
58 VAL 5.00 1.60 1
59 ALA 3.30 2.50 1
60 ARG 3.40 1.00 1
62 GLU 2.70 2.70 1
63 GLN 3.20 2.10 1
64 GLU -1.70 0.50 1
66 TRP -3.30 0.60 1
67 ASN 1.00 2.10 1
69 GLU 2.50 2.50 1
70 PHE 5.90 1.30 1
71 THR 7.00 1.10 1
72 LYS 3.80 3.10 1
73 LYS 3.90 1.30 1
74 VAL 5.60 1.90 1
75 ALA 4.20 1.90 1
77 TRP 3.00 2.10 1
78 ALA 5.00 2.60 1
79 GLU 3.10 2.10 1
80 LYS 3.70 2.90 1
81 VAL 4.40 2.70 1
82 ALA 3.30 1.40 1
83 SER 0.60 0.20 1
85 ASN -1.10 -0.80 1
86 ARG 1.10 -0.40 1
87 ILE -4.30 -2.50 1
88 LEU -0.30 -1.80 1
89 ILE -0.50 -0.80 1
90 LYS 2.60 0.10 1
93 GLU 3.70 0.50 1
94 TYR 2.00 0.20 1
95 PHE -0.80 0.40 1
96 SER -2.20 0.10 1
97 THR 5.60 1.20 1
98 TYR 3.50 1.80 1
99 MET 3.30 1.40 1
100 GLN 4.80 1.90 1
101 GLU 3.40 2.80 1
102 GLN 3.20 3.00 1
103 LEU 3.60 0.50 1
104 LYS 5.00 2.10 1
105 GLU 3.10 2.10 1
106 LEU 2.40 2.30 1
107 VAL 5.10 1.30 1
108 LEU 2.80 1.10 1
109 GLU 1.70 0.90 1
stop_
save_