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 bmr11148_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -6.90
_LACS_plot.Line_1_terminator_val_y_1 -4.77
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -1.89
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -3.41
_LACS_plot.Line_2_terminator_val_x_2 3.87
_LACS_plot.Line_2_terminator_val_y_2 -0.12
_LACS_plot.Y_axis_chem_shift_offset 2.41
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
34 PHE -1.26 -5.92 0
38 SER 3.21 1.99 0
10 GLN -4.15 -4.12 1
11 VAL -0.43 -2.14 1
12 GLU -0.58 -1.99 1
13 ALA -3.84 -3.01 1
14 TYR -3.39 -3.70 1
15 SER -2.64 -2.92 1
17 SER -0.75 -2.89 1
18 ALA -5.61 -4.08 1
20 SER 0.46 -1.10 1
21 VAL 2.03 -0.32 1
22 ARG 2.83 -0.33 1
25 GLU -3.29 -4.12 1
26 GLU -0.91 -2.76 1
27 LEU -4.69 -3.50 1
28 VAL -2.30 -3.35 1
29 LEU -3.41 -4.30 1
30 THR -2.34 -3.45 1
32 SER -2.57 -3.58 1
33 ASN 3.53 -1.76 1
35 LEU -2.15 -2.63 1
37 ASP -1.46 -4.88 1
39 LYS -5.44 -4.42 1
40 VAL -1.45 -3.13 1
41 VAL -1.79 -3.10 1
42 PHE -3.99 -3.68 1
43 ILE -6.90 -4.16 1
44 GLU -5.83 -3.51 1
45 ARG -2.55 -2.96 1
48 ASP -0.19 -3.52 1
50 LYS 0.14 -2.40 1
51 LEU 1.53 -1.18 1
52 GLN -1.66 -2.25 1
53 TRP -1.35 -2.02 1
54 GLU -3.45 -3.90 1
55 GLU -5.22 -4.25 1
56 GLU -0.66 -2.99 1
57 ALA -4.79 -4.09 1
58 THR 1.82 -1.07 1
59 VAL -0.54 -2.30 1
60 ASN 0.81 -3.85 1
61 ARG 3.69 -0.56 1
62 LEU 2.71 -0.55 1
63 GLN -1.19 -3.94 1
64 SER -2.87 -2.47 1
65 ASN 1.55 -2.28 1
66 GLU 3.30 0.48 1
67 VAL -2.82 -4.44 1
68 THR -2.76 -2.88 1
69 LEU -4.60 -3.48 1
70 THR 0.22 -2.30 1
71 LEU -3.43 -3.50 1
72 THR -0.96 -3.02 1
73 VAL 0.95 -0.26 1
75 GLU -1.51 -3.26 1
76 TYR 0.02 -3.33 1
77 SER 1.77 -1.40 1
78 ASN -1.22 -3.88 1
79 LYS 1.86 -2.00 1
80 ARG 0.89 -2.83 1
81 VAL 0.03 -2.44 1
82 SER -0.83 -2.47 1
83 ARG -2.15 -3.28 1
85 VAL -3.68 -3.59 1
86 GLN -0.10 -2.30 1
87 VAL -4.35 -4.87 1
88 TYR -6.53 -4.04 1
89 PHE -4.05 -4.94 1
90 TYR -4.42 -4.70 1
91 VAL -2.83 -4.23 1
92 SER -3.75 -4.54 1
93 ASN -1.11 -3.74 1
95 ARG 3.88 0.12 1
96 ARG 2.43 -1.74 1
97 LYS -1.27 -3.64 1
98 ARG -4.60 -4.00 1
99 SER 0.27 -1.35 1
101 THR -0.03 -2.49 1
102 GLN -3.36 -5.75 1
103 SER 0.33 -1.90 1
104 PHE -3.66 -2.12 1
105 ARG -4.62 -4.09 1
106 PHE -3.78 -3.91 1
107 LEU -1.95 -4.28 1
109 VAL 0.25 -2.23 1
110 ILE 0.00 -2.54 1
112 LYS -0.07 -2.22 1
113 GLU -0.16 -2.56 1
114 GLU 0.17 -1.44 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11148_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -6.90
_LACS_plot.Line_1_terminator_val_y_1 2.13
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -3.89
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.41
_LACS_plot.Line_2_terminator_val_x_2 3.87
_LACS_plot.Line_2_terminator_val_y_2 -3.99
_LACS_plot.Y_axis_chem_shift_offset 2.41
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
34 PHE -1.26 -4.66 0
38 SER 3.21 -1.22 0
10 GLN -4.15 0.03 1
11 VAL -0.43 -1.71 1
12 GLU -0.58 -1.41 1
13 ALA -3.84 0.83 1
14 TYR -3.39 -0.31 1
15 SER -2.64 -0.28 1
17 SER -0.75 -2.14 1
18 ALA -5.61 1.53 1
20 SER 0.46 -1.56 1
21 VAL 2.03 -2.35 1
22 ARG 2.83 -3.16 1
25 GLU -3.29 -0.83 1
26 GLU -0.91 -1.85 1
27 LEU -4.69 1.19 1
28 VAL -2.30 -1.05 1
29 LEU -3.41 -0.89 1
30 THR -2.34 -1.11 1
32 SER -2.57 -1.01 1
33 ASN 3.53 -5.29 1
35 LEU -2.15 -0.48 1
37 ASP -1.46 -3.42 1
39 LYS -5.44 1.02 1
40 VAL -1.45 -1.68 1
41 VAL -1.79 -1.31 1
42 PHE -3.99 0.31 1
43 ILE -6.90 2.74 1
44 GLU -5.83 2.32 1
45 ARG -2.55 -0.41 1
48 ASP -0.19 -3.33 1
50 LYS 0.14 -2.54 1
51 LEU 1.53 -2.71 1
52 GLN -1.66 -0.59 1
53 TRP -1.35 -0.67 1
54 GLU -3.45 -0.45 1
55 GLU -5.22 0.97 1
56 GLU -0.66 -2.33 1
57 ALA -4.79 0.70 1
58 THR 1.82 -2.89 1
59 VAL -0.54 -1.76 1
60 ASN 0.81 -4.66 1
61 ARG 3.69 -4.25 1
62 LEU 2.71 -3.26 1
63 GLN -1.19 -2.75 1
64 SER -2.87 0.40 1
65 ASN 1.55 -3.83 1
66 GLU 3.30 -2.82 1
67 VAL -2.82 -1.62 1
68 THR -2.76 -0.12 1
69 LEU -4.60 1.12 1
70 THR 0.22 -2.52 1
71 LEU -3.43 -0.07 1
72 THR -0.96 -2.06 1
73 VAL 0.95 -1.21 1
75 GLU -1.51 -1.75 1
76 TYR 0.02 -3.35 1
77 SER 1.77 -3.17 1
78 ASN -1.22 -2.66 1
79 LYS 1.86 -3.86 1
80 ARG 0.89 -3.72 1
81 VAL 0.03 -2.47 1
82 SER -0.83 -1.64 1
83 ARG -2.15 -1.13 1
85 VAL -3.68 0.09 1
86 GLN -0.10 -2.20 1
87 VAL -4.35 -0.52 1
88 TYR -6.53 2.49 1
89 PHE -4.05 -0.89 1
90 TYR -4.42 -0.28 1
91 VAL -2.83 -1.40 1
92 SER -3.75 -0.79 1
93 ASN -1.11 -2.63 1
95 ARG 3.88 -3.76 1
96 ARG 2.43 -4.17 1
97 LYS -1.27 -2.37 1
98 ARG -4.60 0.60 1
99 SER 0.27 -1.62 1
101 THR -0.03 -2.46 1
102 GLN -3.36 -2.39 1
103 SER 0.33 -2.23 1
104 PHE -3.66 1.54 1
105 ARG -4.62 0.53 1
106 PHE -3.78 -0.13 1
107 LEU -1.95 -2.33 1
109 VAL 0.25 -2.48 1
110 ILE 0.00 -2.54 1
112 LYS -0.07 -2.15 1
113 GLU -0.16 -2.40 1
114 GLU 0.17 -1.61 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11148_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -6.90
_LACS_plot.Line_1_terminator_val_y_1 0.82
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.22
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.23
_LACS_plot.Line_2_terminator_val_x_2 3.87
_LACS_plot.Line_2_terminator_val_y_2 -0.40
_LACS_plot.Y_axis_chem_shift_offset -0.02
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
73 VAL 0.95 -1.26 0
10 GLN -4.15 0.22 1
11 VAL -0.43 0.20 1
12 GLU -0.58 0.06 1
13 ALA -3.84 0.29 1
14 TYR -3.39 1.01 1
15 SER -2.64 -0.21 1
17 SER -0.75 0.25 1
18 ALA -5.61 -0.18 1
20 SER 0.46 0.41 1
21 VAL 2.03 -0.36 1
22 ARG 2.83 -0.43 1
25 GLU -3.29 0.08 1
26 GLU -0.91 0.39 1
27 LEU -4.69 0.66 1
28 VAL -2.30 0.80 1
29 LEU -3.41 0.78 1
30 THR -2.34 1.10 1
32 SER -2.57 0.01 1
33 ASN 3.53 -0.56 1
34 PHE -1.26 0.35 1
35 LEU -2.15 0.25 1
37 ASP -1.46 -0.05 1
38 SER 3.21 0.08 1
39 LYS -5.44 0.42 1
40 VAL -1.45 0.49 1
41 VAL -1.79 -0.03 1
42 PHE -3.99 0.46 1
43 ILE -6.90 1.21 1
44 GLU -5.83 0.71 1
45 ARG -2.55 0.65 1
48 ASP -0.19 -0.15 1
50 LYS 0.14 -0.09 1
51 LEU 1.53 0.11 1
52 GLN -1.66 0.17 1
53 TRP -1.35 0.00 1
54 GLU -3.45 0.47 1
55 GLU -5.22 -0.06 1
56 GLU -0.66 0.20 1
57 ALA -4.79 0.13 1
58 THR 1.82 -0.17 1
59 VAL -0.54 -0.31 1
60 ASN 0.81 -0.13 1
61 ARG 3.69 -0.51 1
62 LEU 2.71 -0.10 1
63 GLN -1.19 0.17 1
64 SER -2.87 0.45 1
65 ASN 1.55 -0.06 1
66 GLU 3.30 0.07 1
67 VAL -2.82 0.34 1
68 THR -2.76 1.20 1
69 LEU -4.60 0.25 1
70 THR 0.22 0.47 1
71 LEU -3.43 0.66 1
72 THR -0.96 0.24 1
75 GLU -1.51 -0.69 1
76 TYR 0.02 -0.89 1
77 SER 1.77 -0.71 1
78 ASN -1.22 -0.10 1
79 LYS 1.86 -0.27 1
80 ARG 0.89 0.01 1
81 VAL 0.03 0.01 1
82 SER -0.83 0.08 1
83 ARG -2.15 0.11 1
85 VAL -3.68 -0.04 1
86 GLN -0.10 0.06 1
87 VAL -4.35 0.90 1
88 TYR -6.53 1.07 1
89 PHE -4.05 1.14 1
90 TYR -4.42 -0.12 1
91 VAL -2.83 0.65 1
92 SER -3.75 0.83 1
93 ASN -1.11 0.48 1
95 ARG 3.88 -0.41 1
96 ARG 2.43 -0.27 1
97 LYS -1.27 0.15 1
98 ARG -4.60 1.14 1
99 SER 0.27 0.09 1
101 THR -0.03 -0.08 1
102 GLN -3.36 0.05 1
103 SER 0.33 -0.25 1
104 PHE -3.66 0.09 1
105 ARG -4.62 0.84 1
106 PHE -3.78 0.93 1
107 LEU -1.95 -0.07 1
109 VAL 0.25 -0.04 1
110 ILE 0.00 -0.05 1
112 LYS -0.07 -0.07 1
113 GLU -0.16 -0.11 1
114 GLU 0.17 -0.28 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11148_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -6.90
_LACS_plot.Line_1_terminator_val_y_1 -4.75
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -2.48
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -3.54
_LACS_plot.Line_2_terminator_val_x_2 3.87
_LACS_plot.Line_2_terminator_val_y_2 -1.92
_LACS_plot.Y_axis_chem_shift_offset 2.99
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
114 GLU 0.17 1.61 0
10 GLN -4.15 -4.05 1
11 VAL -0.43 -3.46 1
12 GLU -0.58 -2.87 1
13 ALA -3.84 -5.44 1
14 TYR -3.39 -4.58 1
15 SER -2.64 -2.60 1
17 SER -0.75 -3.97 1
18 ALA -5.61 -3.58 1
20 SER 0.46 -0.20 1
21 VAL 2.03 -3.44 1
22 ARG 2.83 -1.58 1
25 GLU -3.29 -4.58 1
26 GLU -0.91 -4.52 1
27 LEU -4.69 -6.10 1
28 VAL -2.30 -2.59 1
29 LEU -3.41 -3.94 1
30 THR -2.34 -1.84 1
32 SER -2.57 -5.18 1
33 ASN 3.53 -3.45 1
34 PHE -1.26 -2.10 1
35 LEU -2.15 -0.31 1
37 ASP -1.46 -1.22 1
38 SER 3.21 -3.69 1
39 LYS -5.44 -3.36 1
40 VAL -1.45 -5.25 1
41 VAL -1.79 -4.70 1
42 PHE -3.99 -3.34 1
43 ILE -6.90 -4.15 1
44 GLU -5.83 -3.38 1
45 ARG -2.55 -2.10 1
48 ASP -0.19 -1.71 1
50 LYS 0.14 -1.99 1
51 LEU 1.53 -2.63 1
52 GLN -1.66 -3.10 1
53 TRP -1.35 -5.23 1
54 GLU -3.45 -4.82 1
55 GLU -5.22 -4.59 1
56 GLU -0.66 -3.04 1
57 ALA -4.79 -3.34 1
58 THR 1.82 -2.85 1
59 VAL -0.54 -3.32 1
60 ASN 0.81 -0.82 1
61 ARG 3.69 -0.15 1
62 LEU 2.71 -1.63 1
63 GLN -1.19 -3.25 1
64 SER -2.87 -5.52 1
65 ASN 1.55 -2.15 1
66 GLU 3.30 -2.58 1
67 VAL -2.82 -2.85 1
68 THR -2.76 -4.13 1
69 LEU -4.60 -5.36 1
70 THR 0.22 -4.26 1
71 LEU -3.43 -5.72 1
72 THR -0.96 -2.49 1
73 VAL 0.95 -3.40 1
75 GLU -1.51 -3.05 1
76 TYR 0.02 -3.21 1
77 SER 1.77 -2.98 1
78 ASN -1.22 -3.03 1
79 LYS 1.86 -1.65 1
80 ARG 0.89 -2.67 1
81 VAL 0.03 -2.93 1
82 SER -0.83 -3.40 1
83 ARG -2.15 -5.02 1
85 VAL -3.68 -3.43 1
86 GLN -0.10 -3.41 1
87 VAL -4.35 -5.69 1
88 TYR -6.53 -3.88 1
89 PHE -4.05 -4.58 1
90 TYR -4.42 -6.16 1
91 VAL -2.83 -3.20 1
92 SER -3.75 -2.82 1
93 ASN -1.11 -2.88 1
95 ARG 3.88 -1.49 1
96 ARG 2.43 -2.44 1
97 LYS -1.27 -4.97 1
98 ARG -4.60 -2.27 1
99 SER 0.27 -3.97 1
101 THR -0.03 -2.66 1
102 GLN -3.36 -2.98 1
103 SER 0.33 -2.72 1
104 PHE -3.66 -6.35 1
105 ARG -4.62 -4.56 1
106 PHE -3.78 -1.75 1
107 LEU -1.95 -3.89 1
109 VAL 0.25 -2.43 1
110 ILE 0.00 -2.96 1
112 LYS -0.07 -2.92 1
113 GLU -0.16 -3.66 1
stop_
save_