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 bmr10076_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -6.51
_LACS_plot.Line_1_terminator_val_y_1 -2.25
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 0.65
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -0.95
_LACS_plot.Line_2_terminator_val_x_2 4.31
_LACS_plot.Line_2_terminator_val_y_2 2.13
_LACS_plot.Y_axis_chem_shift_offset 0.00
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
120 THR 1.03 -1.54 0
85 ARG -4.48 -3.54 0
98 TYR -4.19 0.54 0
107 ARG 4.32 2.47 0
41 THR 3.15 2.71 0
11 ASP -0.04 0.15 1
13 SER 0.47 0.39 1
15 SER 0.16 0.11 1
16 HIS -0.39 0.44 1
19 ILE 0.16 0.05 1
20 LEU -0.26 -0.13 1
21 GLU -0.54 0.00 1
22 ARG -0.11 0.03 1
23 THR -0.08 0.06 1
24 LEU -0.10 -0.05 1
25 ASP -0.69 -0.46 1
26 ASP -3.38 -1.14 1
27 VAL 1.97 -0.08 1
32 MET -4.95 -1.75 1
34 ILE 2.51 0.58 1
35 LEU -6.39 -1.39 1
36 PHE -1.87 -1.74 1
38 GLU -3.68 -0.66 1
39 VAL -0.63 0.96 1
40 ARG -4.22 -2.34 1
42 THR -3.80 -2.58 1
43 SER -3.84 -1.40 1
44 VAL -6.30 -2.25 1
45 ARG -4.17 -0.91 1
46 LEU -5.25 -1.86 1
47 ILE -4.85 -1.75 1
48 TRP -2.16 -0.58 1
49 GLN -2.68 -1.21 1
52 ALA 1.95 1.46 1
53 ALA -1.85 -1.68 1
55 ASN 2.33 0.44 1
57 ILE -0.70 -0.78 1
58 ILE 1.94 -0.93 1
59 LEU -1.83 -0.48 1
60 ALA -3.31 -0.19 1
61 TYR -4.44 0.01 1
62 GLN -5.24 -1.36 1
63 ILE -3.47 -2.16 1
64 THR -4.18 -2.80 1
65 HIS -3.20 -0.42 1
66 ARG -4.42 -1.90 1
67 LEU 0.26 0.50 1
68 ASN 1.15 1.36 1
69 THR -0.43 -0.76 1
70 THR -0.28 -0.14 1
71 THR -0.19 -0.24 1
72 ALA 1.38 1.25 1
73 ASN 1.07 0.72 1
74 THR -0.05 0.06 1
75 ALA -1.23 -0.45 1
76 THR 1.80 1.42 1
77 VAL -2.60 -1.12 1
78 GLU -5.01 -1.22 1
79 VAL 0.03 0.02 1
80 LEU -5.36 -1.61 1
81 ALA -0.03 0.31 1
83 SER -0.41 -0.76 1
84 ALA -0.65 1.23 1
86 GLN -5.69 -2.28 1
87 TYR -3.71 0.24 1
88 THR -0.55 -0.62 1
89 ALA -4.06 -2.45 1
90 THR -3.60 -1.97 1
92 LEU 0.00 -1.61 1
93 LYS -1.50 -0.46 1
95 GLU 1.85 -0.66 1
96 SER -3.17 -0.13 1
97 VAL 0.46 -0.36 1
99 LEU -3.01 -1.00 1
100 PHE -4.15 -0.69 1
101 ARG -4.62 -1.58 1
102 ILE -3.70 -1.24 1
103 THR -3.16 -1.25 1
104 ALA -5.53 -2.18 1
105 GLN -4.14 -1.97 1
106 THR -4.96 -1.64 1
108 LYS 0.45 -0.23 1
110 TRP -1.27 -0.41 1
112 GLU -2.23 -0.54 1
113 ALA -1.51 -0.70 1
114 ALA -3.62 -1.07 1
115 GLU -6.51 -2.19 1
116 ALA -5.10 -0.37 1
117 LEU -4.03 -1.46 1
118 VAL -4.00 -2.24 1
119 VAL -3.34 -2.85 1
121 THR -1.58 -1.14 1
122 GLU -1.59 -0.62 1
123 LYS 0.63 0.56 1
124 ARG -0.53 -0.22 1
125 SER -0.38 -0.04 1
128 SER 0.12 0.15 1
129 SER -0.15 0.11 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr10076_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -6.51
_LACS_plot.Line_1_terminator_val_y_1 4.26
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -1.35
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 1.05
_LACS_plot.Line_2_terminator_val_x_2 4.31
_LACS_plot.Line_2_terminator_val_y_2 -2.18
_LACS_plot.Y_axis_chem_shift_offset 0.00
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
120 THR 1.03 -2.57 0
85 ARG -4.48 0.94 0
98 TYR -4.19 4.73 0
107 ARG 4.32 -1.85 0
41 THR 3.15 -0.44 0
11 ASP -0.04 0.19 1
13 SER 0.47 -0.08 1
15 SER 0.16 -0.05 1
16 HIS -0.39 0.83 1
19 ILE 0.16 -0.11 1
20 LEU -0.26 0.13 1
21 GLU -0.54 0.54 1
22 ARG -0.11 0.14 1
23 THR -0.08 0.14 1
24 LEU -0.10 0.05 1
25 ASP -0.69 0.23 1
26 ASP -3.38 2.24 1
27 VAL 1.97 -2.05 1
32 MET -4.95 3.20 1
34 ILE 2.51 -1.93 1
35 LEU -6.39 5.00 1
36 PHE -1.87 0.13 1
38 GLU -3.68 3.02 1
39 VAL -0.63 1.59 1
40 ARG -4.22 1.88 1
42 THR -3.80 1.22 1
43 SER -3.84 2.44 1
44 VAL -6.30 4.05 1
45 ARG -4.17 3.26 1
46 LEU -5.25 3.39 1
47 ILE -4.85 3.10 1
48 TRP -2.16 1.58 1
49 GLN -2.68 1.47 1
52 ALA 1.95 -0.49 1
53 ALA -1.85 0.17 1
55 ASN 2.33 -1.89 1
57 ILE -0.70 -0.08 1
58 ILE 1.94 -2.87 1
59 LEU -1.83 1.35 1
60 ALA -3.31 3.12 1
61 TYR -4.44 4.45 1
62 GLN -5.24 3.88 1
63 ILE -3.47 1.31 1
64 THR -4.18 1.38 1
65 HIS -3.20 2.78 1
66 ARG -4.42 2.52 1
67 LEU 0.26 0.24 1
68 ASN 1.15 0.21 1
69 THR -0.43 -0.33 1
70 THR -0.28 0.14 1
71 THR -0.19 -0.05 1
72 ALA 1.38 -0.13 1
73 ASN 1.07 -0.35 1
74 THR -0.05 0.11 1
75 ALA -1.23 0.78 1
76 THR 1.80 -0.38 1
77 VAL -2.60 1.48 1
78 GLU -5.01 3.79 1
79 VAL 0.03 -0.01 1
80 LEU -5.36 3.75 1
81 ALA -0.03 0.34 1
83 SER -0.41 -0.35 1
84 ALA -0.65 1.88 1
86 GLN -5.69 3.41 1
87 TYR -3.71 3.95 1
88 THR -0.55 -0.07 1
89 ALA -4.06 1.61 1
90 THR -3.60 1.63 1
92 LEU 0.00 -1.61 1
93 LYS -1.50 1.04 1
95 GLU 1.85 -2.51 1
96 SER -3.17 3.04 1
97 VAL 0.46 -0.82 1
99 LEU -3.01 2.01 1
100 PHE -4.15 3.46 1
101 ARG -4.62 3.04 1
102 ILE -3.70 2.46 1
103 THR -3.16 1.91 1
104 ALA -5.53 3.35 1
105 GLN -4.14 2.17 1
106 THR -4.96 3.32 1
108 LYS 0.45 -0.68 1
110 TRP -1.27 0.86 1
112 GLU -2.23 1.69 1
113 ALA -1.51 0.81 1
114 ALA -3.62 2.55 1
115 GLU -6.51 4.32 1
116 ALA -5.10 4.73 1
117 LEU -4.03 2.57 1
118 VAL -4.00 1.76 1
119 VAL -3.34 0.49 1
121 THR -1.58 0.44 1
122 GLU -1.59 0.97 1
123 LYS 0.63 -0.07 1
124 ARG -0.53 0.31 1
125 SER -0.38 0.34 1
128 SER 0.12 0.03 1
129 SER -0.15 0.26 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr10076_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -6.51
_LACS_plot.Line_1_terminator_val_y_1 0.85
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.24
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.27
_LACS_plot.Line_2_terminator_val_x_2 4.31
_LACS_plot.Line_2_terminator_val_y_2 -0.56
_LACS_plot.Y_axis_chem_shift_offset -0.01
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
85 ARG -4.48 -1.66 0
11 ASP -0.04 -0.02 1
13 SER 0.47 -0.06 1
15 SER 0.16 -0.11 1
16 HIS -0.39 -0.07 1
19 ILE 0.16 -0.05 1
20 LEU -0.26 0.05 1
21 GLU -0.54 -0.08 1
22 ARG -0.11 0.07 1
23 THR -0.08 -0.02 1
24 LEU -0.10 0.00 1
25 ASP -0.69 0.05 1
26 ASP -3.38 0.10 1
27 VAL 1.97 -0.15 1
32 MET -4.95 0.39 1
34 ILE 2.51 0.39 1
35 LEU -6.39 0.17 1
36 PHE -1.87 0.92 1
38 GLU -3.68 0.30 1
39 VAL -0.63 0.14 1
40 ARG -4.22 0.52 1
41 THR 3.15 -0.18 1
42 THR -3.80 0.39 1
43 SER -3.84 0.73 1
44 VAL -6.30 0.58 1
45 ARG -4.17 0.90 1
46 LEU -5.25 0.82 1
47 ILE -4.85 0.92 1
48 TRP -2.16 0.22 1
49 GLN -2.68 0.01 1
52 ALA 1.95 -0.14 1
53 ALA -1.85 0.29 1
55 ASN 2.33 -0.58 1
57 ILE -0.70 -0.15 1
58 ILE 1.94 -0.03 1
59 LEU -1.83 -0.03 1
60 ALA -3.31 0.10 1
61 TYR -4.44 0.95 1
62 GLN -5.24 0.89 1
63 ILE -3.47 0.87 1
64 THR -4.18 1.33 1
65 HIS -3.20 0.82 1
66 ARG -4.42 0.52 1
67 LEU 0.26 -0.48 1
68 ASN 1.15 -0.20 1
69 THR -0.43 0.04 1
70 THR -0.28 0.18 1
71 THR -0.19 -0.04 1
72 ALA 1.38 -0.25 1
73 ASN 1.07 -0.10 1
74 THR -0.05 -0.02 1
75 ALA -1.23 0.07 1
76 THR 1.80 -0.16 1
77 VAL -2.60 0.55 1
78 GLU -5.01 0.44 1
79 VAL 0.03 0.77 1
80 LEU -5.36 0.66 1
81 ALA -0.03 0.03 1
83 SER -0.41 -0.04 1
84 ALA -0.65 -0.05 1
86 GLN -5.69 0.93 1
87 TYR -3.71 0.21 1
88 THR -0.55 0.65 1
89 ALA -4.06 0.22 1
90 THR -3.60 0.48 1
92 LEU 0.00 -0.13 1
93 LYS -1.50 0.06 1
95 GLU 1.85 -0.64 1
96 SER -3.17 0.48 1
97 VAL 0.46 0.45 1
98 TYR -4.19 0.21 1
99 LEU -3.01 0.72 1
100 PHE -4.15 0.83 1
101 ARG -4.62 1.19 1
102 ILE -3.70 1.15 1
103 THR -3.16 0.30 1
104 ALA -5.53 0.91 1
105 GLN -4.14 0.14 1
106 THR -4.96 0.53 1
107 ARG 4.32 -0.37 1
108 LYS 0.45 -0.14 1
110 TRP -1.27 0.21 1
112 GLU -2.23 -0.17 1
113 ALA -1.51 0.52 1
114 ALA -3.62 0.42 1
115 GLU -6.51 1.31 1
116 ALA -5.10 0.43 1
117 LEU -4.03 1.35 1
118 VAL -4.00 0.14 1
119 VAL -3.34 1.18 1
120 THR 1.03 -0.25 1
121 THR -1.58 0.13 1
122 GLU -1.59 0.05 1
123 LYS 0.63 -0.03 1
124 ARG -0.53 0.13 1
125 SER -0.38 0.06 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr10076_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -6.51
_LACS_plot.Line_1_terminator_val_y_1 -2.35
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 0.12
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.03
_LACS_plot.Line_2_terminator_val_x_2 4.31
_LACS_plot.Line_2_terminator_val_y_2 0.76
_LACS_plot.Y_axis_chem_shift_offset 0.46
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
118 VAL -4.00 -5.27 0
106 THR -4.96 2.05 0
11 ASP -0.04 0.70 1
13 SER 0.47 -0.26 1
15 SER 0.16 -0.79 1
16 HIS -0.39 -0.04 1
19 ILE 0.16 -0.20 1
20 LEU -0.26 -0.59 1
21 GLU -0.54 -0.44 1
22 ARG -0.11 -0.04 1
23 THR -0.08 -0.32 1
24 LEU -0.10 -1.17 1
25 ASP -0.69 -1.72 1
26 ASP -3.38 -0.47 1
27 VAL 1.97 -0.73 1
32 MET -4.95 -0.17 1
34 ILE 2.51 0.41 1
35 LEU -6.39 -3.43 1
36 PHE -1.87 -0.10 1
38 GLU -3.68 -2.94 1
39 VAL -0.63 -1.99 1
40 ARG -4.22 -1.55 1
41 THR 3.15 0.22 1
42 THR -3.80 -0.01 1
43 SER -3.84 -2.84 1
44 VAL -6.30 -3.50 1
45 ARG -4.17 -3.16 1
46 LEU -5.25 -2.35 1
47 ILE -4.85 -2.71 1
48 TRP -2.16 -2.73 1
49 GLN -2.68 -1.41 1
52 ALA 1.95 0.49 1
53 ALA -1.85 -2.81 1
55 ASN 2.33 -1.89 1
57 ILE -0.70 0.14 1
58 ILE 1.94 0.03 1
59 LEU -1.83 -0.71 1
60 ALA -3.31 -2.99 1
61 TYR -4.44 -1.75 1
62 GLN -5.24 -1.88 1
63 ILE -3.47 -1.02 1
64 THR -4.18 -0.89 1
65 HIS -3.20 -0.42 1
66 ARG -4.42 -1.76 1
67 LEU 0.26 1.16 1
68 ASN 1.15 -0.03 1
69 THR -0.43 -0.01 1
70 THR -0.28 0.16 1
71 THR -0.19 0.41 1
72 ALA 1.38 -0.05 1
73 ASN 1.07 0.12 1
74 THR -0.05 -0.56 1
75 ALA -1.23 -0.57 1
76 THR 1.80 -1.89 1
77 VAL -2.60 -1.14 1
78 GLU -5.01 -2.53 1
79 VAL 0.03 -0.78 1
80 LEU -5.36 -0.92 1
81 ALA -0.03 0.83 1
83 SER -0.41 0.17 1
84 ALA -0.65 -0.03 1
85 ARG -4.48 -3.01 1
86 GLN -5.69 -1.84 1
87 TYR -3.71 -3.07 1
88 THR -0.55 -2.54 1
89 ALA -4.06 -2.02 1
90 THR -3.60 -0.39 1
92 LEU 0.00 -2.04 1
93 LYS -1.50 0.14 1
95 GLU 1.85 -0.74 1
96 SER -3.17 -4.08 1
97 VAL 0.46 -0.79 1
98 TYR -4.19 -2.01 1
99 LEU -3.01 -1.21 1
100 PHE -4.15 -1.11 1
101 ARG -4.62 -0.90 1
102 ILE -3.70 -2.12 1
103 THR -3.16 -2.29 1
104 ALA -5.53 -3.51 1
105 GLN -4.14 0.55 1
107 ARG 4.32 0.37 1
108 LYS 0.45 -0.64 1
110 TRP -1.27 1.96 1
112 GLU -2.23 0.05 1
113 ALA -1.51 1.18 1
114 ALA -3.62 -1.72 1
115 GLU -6.51 -0.79 1
116 ALA -5.10 -3.16 1
117 LEU -4.03 -1.22 1
119 VAL -3.34 1.33 1
120 THR 1.03 0.34 1
121 THR -1.58 -1.70 1
122 GLU -1.59 -0.18 1
123 LYS 0.63 -0.19 1
124 ARG -0.53 -0.04 1
125 SER -0.38 -0.10 1
128 SER 0.12 0.05 1
129 SER -0.15 -0.69 1
stop_
save_