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 bmr17085_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -6.10
_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 1.87
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -0.13
_LACS_plot.Line_2_terminator_val_x_2 7.84
_LACS_plot.Line_2_terminator_val_y_2 6.54
_LACS_plot.Y_axis_chem_shift_offset -1.14
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
23 TYR 6.71 -1.13 0
10 LEU 0.22 0.36 1
11 PHE -1.05 -2.00 1
13 SER -4.75 -0.47 1
14 LEU -6.10 0.04 1
15 ARG -0.94 -0.29 1
17 HIS -3.50 2.87 1
18 VAL -0.02 0.19 1
19 VAL -5.03 -2.13 1
21 LEU 0.02 0.90 1
22 ARG 1.96 4.66 1
25 THR -0.97 0.06 1
27 VAL -2.69 -0.28 1
28 VAL -4.35 -0.86 1
29 ASN -3.97 -0.84 1
30 ASN 2.62 2.76 1
31 ASN 3.26 2.76 1
32 GLU -3.37 0.32 1
33 MET -0.41 1.15 1
34 VAL -4.38 -2.45 1
35 ALA -4.79 -1.14 1
36 LEU -1.30 -0.66 1
37 GLN -5.09 -0.70 1
38 ARG 1.94 4.28 1
41 ASN -0.71 0.13 1
42 ASN 0.75 2.31 1
45 ASP -1.47 0.64 1
46 LYS 3.58 2.88 1
47 ASN 0.69 0.99 1
48 ALA 0.32 2.17 1
49 ILE -2.55 1.55 1
50 LYS -0.89 1.32 1
51 VAL -0.77 -0.32 1
52 ASN -4.92 -1.66 1
53 ASN -2.33 -1.19 1
54 VAL 3.79 3.52 1
55 ASN -0.10 1.13 1
57 ASN -1.75 -0.17 1
59 VAL -1.26 0.85 1
62 LEU 0.10 1.86 1
63 LYS 0.39 2.35 1
64 LYS 6.10 6.06 1
65 GLU 5.62 5.23 1
66 LEU 1.91 2.36 1
67 ALA 5.14 4.42 1
69 ALA -1.01 1.28 1
70 LEU 1.87 2.85 1
71 ALA 7.84 6.06 1
72 TYR 2.13 4.55 1
73 ILE 4.11 4.62 1
74 MET 3.46 5.07 1
75 ASP 4.85 3.93 1
76 ASN 0.49 1.15 1
77 LYS 4.84 1.85 1
78 LEU -0.67 1.92 1
79 ALA -4.82 -0.56 1
80 GLN -1.20 0.45 1
81 ILE -1.73 0.00 1
82 GLU -4.90 -1.59 1
84 VAL -6.07 -1.41 1
87 PHE -1.07 -0.57 1
89 ALA 1.40 1.94 1
90 ASN 0.18 0.52 1
91 ASN -0.27 1.24 1
92 ALA 0.25 1.59 1
94 THR -2.14 1.01 1
97 LEU -5.69 -0.86 1
98 HIS -2.32 1.53 1
100 THR -1.56 0.14 1
101 PHE -4.15 -0.44 1
102 TRP -5.82 -1.69 1
104 LYS -1.65 -0.26 1
105 GLU 3.77 4.46 1
106 GLU 3.06 3.02 1
107 ASN -1.39 0.89 1
108 ARG 4.00 5.32 1
109 LYS 4.62 4.08 1
110 ALA 2.86 3.27 1
111 VAL 6.60 5.96 1
113 ASP 4.15 3.93 1
114 GLN 5.50 3.28 1
115 LEU 5.22 4.32 1
116 LYS 4.29 4.43 1
117 LYS 3.54 3.50 1
118 HIS -2.59 1.79 1
120 PHE -3.29 0.13 1
121 LYS -2.15 0.41 1
122 LEU -0.42 0.81 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr17085_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -6.10
_LACS_plot.Line_1_terminator_val_y_1 4.67
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.13
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 1.87
_LACS_plot.Line_2_terminator_val_x_2 7.84
_LACS_plot.Line_2_terminator_val_y_2 -1.30
_LACS_plot.Y_axis_chem_shift_offset -1.14
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
23 TYR 6.71 -7.84 0
10 LEU 0.22 0.14 1
11 PHE -1.05 -0.95 1
13 SER -4.75 4.28 1
14 LEU -6.10 6.14 1
15 ARG -0.94 0.65 1
17 HIS -3.50 6.37 1
18 VAL -0.02 0.21 1
19 VAL -5.03 2.90 1
21 LEU 0.02 0.88 1
22 ARG 1.96 2.70 1
25 THR -0.97 1.03 1
27 VAL -2.69 2.41 1
28 VAL -4.35 3.49 1
29 ASN -3.97 3.13 1
30 ASN 2.62 0.14 1
31 ASN 3.26 -0.50 1
32 GLU -3.37 3.69 1
33 MET -0.41 1.56 1
34 VAL -4.38 1.93 1
35 ALA -4.79 3.65 1
36 LEU -1.30 0.64 1
37 GLN -5.09 4.39 1
38 ARG 1.94 2.34 1
41 ASN -0.71 0.84 1
42 ASN 0.75 1.56 1
45 ASP -1.47 2.11 1
46 LYS 3.58 -0.70 1
47 ASN 0.69 0.30 1
48 ALA 0.32 1.85 1
49 ILE -2.55 4.10 1
50 LYS -0.89 2.21 1
51 VAL -0.77 0.45 1
52 ASN -4.92 3.26 1
53 ASN -2.33 1.14 1
54 VAL 3.79 -0.27 1
55 ASN -0.10 1.23 1
57 ASN -1.75 1.58 1
59 VAL -1.26 2.11 1
62 LEU 0.10 1.76 1
63 LYS 0.39 1.96 1
64 LYS 6.10 -0.04 1
65 GLU 5.62 -0.39 1
66 LEU 1.91 0.45 1
67 ALA 5.14 -0.72 1
69 ALA -1.01 2.29 1
70 LEU 1.87 0.98 1
71 ALA 7.84 -1.78 1
72 TYR 2.13 2.42 1
73 ILE 4.11 0.51 1
74 MET 3.46 1.61 1
75 ASP 4.85 -0.92 1
76 ASN 0.49 0.66 1
77 LYS 4.84 -2.99 1
78 LEU -0.67 2.59 1
79 ALA -4.82 4.26 1
80 GLN -1.20 1.65 1
81 ILE -1.73 1.73 1
82 GLU -4.90 3.31 1
84 VAL -6.07 4.66 1
87 PHE -1.07 0.50 1
89 ALA 1.40 0.54 1
90 ASN 0.18 0.34 1
91 ASN -0.27 1.51 1
92 ALA 0.25 1.34 1
94 THR -2.14 3.15 1
97 LEU -5.69 4.83 1
98 HIS -2.32 3.85 1
100 THR -1.56 1.70 1
101 PHE -4.15 3.71 1
102 TRP -5.82 4.13 1
104 LYS -1.65 1.39 1
105 GLU 3.77 0.69 1
106 GLU 3.06 -0.04 1
107 ASN -1.39 2.28 1
108 ARG 4.00 1.32 1
109 LYS 4.62 -0.54 1
110 ALA 2.86 0.41 1
111 VAL 6.60 -0.64 1
113 ASP 4.15 -0.22 1
114 GLN 5.50 -2.22 1
115 LEU 5.22 -0.90 1
116 LYS 4.29 0.14 1
117 LYS 3.54 -0.04 1
118 HIS -2.59 4.38 1
120 PHE -3.29 3.42 1
121 LYS -2.15 2.56 1
122 LEU -0.42 1.23 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr17085_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -6.10
_LACS_plot.Line_1_terminator_val_y_1 0.22
_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 -0.13
_LACS_plot.Line_2_terminator_val_x_2 7.84
_LACS_plot.Line_2_terminator_val_y_2 -0.95
_LACS_plot.Y_axis_chem_shift_offset 0.30
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
108 ARG 4.00 -2.41 0
10 LEU 0.22 -1.12 1
11 PHE -1.05 0.01 1
13 SER -4.75 0.95 1
14 LEU -6.10 -0.01 1
15 ARG -0.94 0.39 1
17 HIS -3.50 0.25 1
18 VAL -0.02 -0.05 1
19 VAL -5.03 0.84 1
21 LEU 0.02 -0.31 1
22 ARG 1.96 -0.26 1
23 TYR 6.71 -0.28 1
25 THR -0.97 0.00 1
27 VAL -2.69 -0.01 1
28 VAL -4.35 -0.08 1
29 ASN -3.97 -0.23 1
30 ASN 2.62 -0.96 1
31 ASN 3.26 -0.91 1
32 GLU -3.37 -0.30 1
33 MET -0.41 0.14 1
34 VAL -4.38 0.14 1
35 ALA -4.79 0.08 1
36 LEU -1.30 0.35 1
37 GLN -5.09 0.01 1
38 ARG 1.94 -0.82 1
41 ASN -0.71 -0.30 1
42 ASN 0.75 -0.76 1
45 ASP -1.47 -0.48 1
46 LYS 3.58 -0.38 1
47 ASN 0.69 -0.69 1
48 ALA 0.32 -0.94 1
49 ILE -2.55 -0.17 1
50 LYS -0.89 -0.47 1
51 VAL -0.77 0.05 1
52 ASN -4.92 0.34 1
53 ASN -2.33 -0.18 1
54 VAL 3.79 -0.60 1
55 ASN -0.10 -0.24 1
57 ASN -1.75 -0.29 1
59 VAL -1.26 -0.50 1
62 LEU 0.10 -0.42 1
63 LYS 0.39 -0.38 1
64 LYS 6.10 -0.65 1
65 GLU 5.62 -0.44 1
66 LEU 1.91 -0.50 1
67 ALA 5.14 -0.74 1
69 ALA -1.01 -0.97 1
70 LEU 1.87 -0.64 1
71 ALA 7.84 -0.92 1
72 TYR 2.13 -0.74 1
73 ILE 4.11 -0.95 1
74 MET 3.46 -0.55 1
75 ASP 4.85 -0.60 1
76 ASN 0.49 -0.37 1
77 LYS 4.84 -0.68 1
78 LEU -0.67 -0.45 1
79 ALA -4.82 0.25 1
80 GLN -1.20 -0.14 1
81 ILE -1.73 0.23 1
82 GLU -4.90 0.12 1
84 VAL -6.07 0.33 1
87 PHE -1.07 -0.40 1
89 ALA 1.40 -0.46 1
90 ASN 0.18 -0.34 1
91 ASN -0.27 -0.58 1
92 ALA 0.25 -0.65 1
94 THR -2.14 0.36 1
97 LEU -5.69 0.03 1
98 HIS -2.32 -0.03 1
100 THR -1.56 0.08 1
101 PHE -4.15 0.15 1
102 TRP -5.82 0.08 1
104 LYS -1.65 0.09 1
105 GLU 3.77 -0.62 1
106 GLU 3.06 -0.41 1
107 ASN -1.39 0.12 1
109 LYS 4.62 -0.77 1
110 ALA 2.86 -0.49 1
111 VAL 6.60 -1.09 1
113 ASP 4.15 -0.61 1
114 GLN 5.50 -0.41 1
115 LEU 5.22 -0.61 1
116 LYS 4.29 -0.41 1
117 LYS 3.54 -0.64 1
118 HIS -2.59 -0.55 1
120 PHE -3.29 -0.08 1
121 LYS -2.15 -0.25 1
122 LEU -0.42 -0.01 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr17085_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -6.10
_LACS_plot.Line_1_terminator_val_y_1 3.76
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 0.07
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 2.00
_LACS_plot.Line_2_terminator_val_x_2 7.84
_LACS_plot.Line_2_terminator_val_y_2 -2.60
_LACS_plot.Y_axis_chem_shift_offset -1.02
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
47 ASN 0.69 6.30 0
110 ALA 2.86 -6.06 0
94 THR -2.14 8.03 0
10 LEU 0.22 -2.05 1
11 PHE -1.05 1.31 1
13 SER -4.75 6.92 1
14 LEU -6.10 1.21 1
15 ARG -0.94 1.29 1
17 HIS -3.50 5.65 1
21 LEU 0.02 -1.30 1
25 THR -0.97 2.50 1
27 VAL -2.69 1.11 1
28 VAL -4.35 3.72 1
29 ASN -3.97 4.51 1
30 ASN 2.62 1.88 1
31 ASN 3.26 4.60 1
32 GLU -3.37 1.61 1
33 MET -0.41 1.82 1
34 VAL -4.38 3.14 1
35 ALA -4.79 -0.24 1
36 LEU -1.30 -0.98 1
37 GLN -5.09 2.23 1
41 ASN -0.71 3.76 1
45 ASP -1.47 1.81 1
46 LYS 3.58 -0.65 1
50 LYS -0.89 1.71 1
51 VAL -0.77 3.20 1
52 ASN -4.92 3.35 1
53 ASN -2.33 0.25 1
54 VAL 3.79 1.04 1
55 ASN -0.10 2.93 1
57 ASN -1.75 3.36 1
59 VAL -1.26 2.38 1
64 LYS 6.10 -2.01 1
65 GLU 5.62 -2.57 1
66 LEU 1.91 -3.14 1
67 ALA 5.14 -2.95 1
69 ALA -1.01 -2.84 1
70 LEU 1.87 -3.33 1
71 ALA 7.84 -2.74 1
72 TYR 2.13 -1.19 1
73 ILE 4.11 0.02 1
74 MET 3.46 -3.22 1
75 ASP 4.85 -0.27 1
76 ASN 0.49 5.99 1
77 LYS 4.84 0.45 1
78 LEU -0.67 -1.07 1
79 ALA -4.82 0.07 1
80 GLN -1.20 2.65 1
81 ILE -1.73 1.45 1
82 GLU -4.90 0.99 1
84 VAL -6.07 2.89 1
89 ALA 1.40 -1.71 1
90 ASN 0.18 3.24 1
91 ASN -0.27 3.73 1
97 LEU -5.69 1.24 1
98 HIS -2.32 4.20 1
100 THR -1.56 6.30 1
101 PHE -4.15 3.87 1
102 TRP -5.82 1.99 1
104 LYS -1.65 -1.88 1
105 GLU 3.77 -1.63 1
106 GLU 3.06 -0.10 1
107 ASN -1.39 3.99 1
108 ARG 4.00 -1.28 1
109 LYS 4.62 -0.76 1
111 VAL 6.60 0.25 1
113 ASP 4.15 -1.67 1
114 GLN 5.50 -0.20 1
115 LEU 5.22 -4.07 1
116 LYS 4.29 -3.75 1
117 LYS 3.54 0.00 1
118 HIS -2.59 5.65 1
120 PHE -3.29 3.58 1
121 LYS -2.15 2.90 1
122 LEU -0.42 -1.16 1
stop_
save_