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 bmr19098_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -7.90
_LACS_plot.Line_1_terminator_val_y_1 -2.92
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 0.83
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.40
_LACS_plot.Line_2_terminator_val_x_2 5.28
_LACS_plot.Line_2_terminator_val_y_2 3.91
_LACS_plot.Y_axis_chem_shift_offset -0.07
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
65 HIS 2.56 5.17 0
23 HIS 1.58 4.96 0
10 SER 0.99 0.19 1
11 LEU 0.20 -0.30 1
13 ARG 2.59 1.52 1
14 ASP -0.32 -1.76 1
15 ILE -3.68 -2.65 1
16 THR -5.18 -2.42 1
17 ALA 4.78 3.38 1
18 VAL 4.63 3.48 1
19 GLU 2.17 2.63 1
20 LEU 3.21 2.99 1
21 GLN 5.29 3.90 1
22 ASN 3.62 3.06 1
24 PHE 1.92 0.61 1
25 LYS 4.82 3.90 1
26 ASN 3.60 2.28 1
27 SER -0.38 1.51 1
28 SER 1.55 1.05 1
30 ASP 2.59 3.54 1
31 GLN -3.78 -0.40 1
32 ILE -1.85 -0.14 1
33 ARG -2.24 -1.27 1
34 LEU -2.94 -0.44 1
35 ARG -0.67 -2.77 1
36 ALA 4.24 3.58 1
37 ASP 3.62 1.58 1
38 LYS -2.71 -1.32 1
40 ILE -6.88 -2.65 1
41 ALA -7.90 -2.42 1
42 PHE -3.74 -1.68 1
43 LEU -3.09 -2.23 1
44 GLU -4.73 -1.94 1
45 PHE -3.24 -0.89 1
46 ASP -0.79 -0.26 1
47 ALA 1.15 1.66 1
48 ASP 2.26 1.89 1
49 LYS 0.03 0.61 1
50 ASP -1.03 -1.40 1
51 ARG 3.18 2.79 1
52 THR 2.13 1.81 1
54 ILE 3.62 2.23 1
55 GLN 4.99 3.41 1
56 ARG 4.07 2.93 1
57 ARG 4.33 4.34 1
58 MET 4.85 4.12 1
59 ASP 4.59 3.48 1
60 ILE 4.47 3.61 1
61 ALA 5.21 3.52 1
62 LEU 4.15 2.78 1
63 LEU 1.81 1.40 1
64 GLN -0.49 -1.68 1
67 THR -2.87 -0.55 1
68 LEU -2.41 -1.23 1
69 LEU -3.00 -1.16 1
70 LYS 4.69 1.42 1
71 GLU 3.46 1.44 1
72 LYS -3.37 -2.21 1
73 LYS 0.23 -0.11 1
74 ILE -1.26 0.07 1
75 ASN -4.65 -1.77 1
76 VAL -3.05 -0.45 1
77 GLU -6.76 -2.01 1
78 LEU 0.09 0.44 1
79 THR -0.34 0.03 1
80 VAL -0.60 -0.01 1
85 ASN 0.06 -0.13 1
86 SER 1.42 1.28 1
87 GLN 2.41 1.72 1
88 GLU 1.47 1.34 1
89 ARG 2.37 1.63 1
90 LEU 1.97 1.36 1
91 GLU 1.54 1.29 1
92 LYS 1.85 1.36 1
93 LEU 1.09 0.87 1
94 LYS 1.42 1.06 1
95 ASN 0.31 0.59 1
96 LYS 1.29 0.93 1
97 ASN 0.93 0.61 1
98 ILE 1.14 0.96 1
99 LYS 1.17 0.61 1
100 LEU 1.25 0.97 1
101 ASP 1.50 1.26 1
102 GLU 1.87 1.36 1
103 GLU 1.38 1.13 1
104 ARG 2.22 1.58 1
105 LYS 2.00 1.51 1
106 GLU 1.37 1.24 1
107 ARG 2.06 1.39 1
108 LEU 1.37 1.02 1
109 THR 1.67 1.53 1
110 LYS 1.02 0.72 1
111 MET 0.83 0.69 1
112 ILE 0.80 0.62 1
113 ASN 0.51 0.36 1
114 ASP 0.41 0.40 1
116 ASN 0.68 0.46 1
117 GLN 0.91 0.62 1
118 LYS 0.57 0.22 1
119 LYS 0.35 0.05 1
120 ILE -0.12 -0.24 1
121 ALA -0.31 -0.21 1
122 LYS 0.15 0.18 1
123 THR -0.28 -0.16 1
124 THR -0.05 0.00 1
125 ALA -0.02 0.15 1
126 THR -0.05 0.00 1
127 ALA -0.02 -0.05 1
128 ALA 0.00 -0.03 1
129 GLN 0.02 0.13 1
130 THR -0.36 -0.24 1
131 SER -0.29 0.04 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr19098_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -7.90
_LACS_plot.Line_1_terminator_val_y_1 4.98
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -1.17
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.60
_LACS_plot.Line_2_terminator_val_x_2 5.28
_LACS_plot.Line_2_terminator_val_y_2 -1.37
_LACS_plot.Y_axis_chem_shift_offset -0.07
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
65 HIS 2.56 2.61 0
23 HIS 1.58 3.38 0
10 SER 0.99 -0.80 1
11 LEU 0.20 -0.50 1
13 ARG 2.59 -1.07 1
14 ASP -0.32 -1.44 1
15 ILE -3.68 1.03 1
16 THR -5.18 2.76 1
17 ALA 4.78 -1.40 1
18 VAL 4.63 -1.15 1
19 GLU 2.17 0.46 1
20 LEU 3.21 -0.22 1
21 GLN 5.29 -1.39 1
22 ASN 3.62 -0.56 1
24 PHE 1.92 -1.31 1
25 LYS 4.82 -0.92 1
26 ASN 3.60 -1.32 1
27 SER -0.38 1.89 1
28 SER 1.55 -0.50 1
30 ASP 2.59 0.95 1
31 GLN -3.78 3.38 1
32 ILE -1.85 1.71 1
33 ARG -2.24 0.97 1
34 LEU -2.94 2.50 1
35 ARG -0.67 -2.10 1
36 ALA 4.24 -0.66 1
37 ASP 3.62 -2.04 1
38 LYS -2.71 1.39 1
40 ILE -6.88 4.23 1
41 ALA -7.90 5.48 1
42 PHE -3.74 2.06 1
43 LEU -3.09 0.86 1
44 GLU -4.73 2.79 1
45 PHE -3.24 2.35 1
46 ASP -0.79 0.53 1
47 ALA 1.15 0.51 1
48 ASP 2.26 -0.37 1
49 LYS 0.03 0.58 1
50 ASP -1.03 -0.37 1
51 ARG 3.18 -0.39 1
52 THR 2.13 -0.32 1
54 ILE 3.62 -1.39 1
55 GLN 4.99 -1.58 1
56 ARG 4.07 -1.14 1
57 ARG 4.33 0.01 1
58 MET 4.85 -0.73 1
59 ASP 4.59 -1.11 1
60 ILE 4.47 -0.86 1
61 ALA 5.21 -1.69 1
62 LEU 4.15 -1.37 1
63 LEU 1.81 -0.41 1
64 GLN -0.49 -1.19 1
67 THR -2.87 2.32 1
68 LEU -2.41 1.18 1
69 LEU -3.00 1.84 1
70 LYS 4.69 -3.27 1
71 GLU 3.46 -2.02 1
72 LYS -3.37 1.16 1
73 LYS 0.23 -0.34 1
74 ILE -1.26 1.33 1
75 ASN -4.65 2.88 1
76 VAL -3.05 2.60 1
77 GLU -6.76 4.75 1
78 LEU 0.09 0.35 1
79 THR -0.34 0.37 1
80 VAL -0.60 0.59 1
85 ASN 0.06 -0.19 1
86 SER 1.42 -0.14 1
87 GLN 2.41 -0.69 1
88 GLU 1.47 -0.13 1
89 ARG 2.37 -0.74 1
90 LEU 1.97 -0.61 1
91 GLU 1.54 -0.25 1
92 LYS 1.85 -0.49 1
93 LEU 1.09 -0.22 1
94 LYS 1.42 -0.36 1
95 ASN 0.31 0.28 1
96 LYS 1.29 -0.36 1
97 ASN 0.93 -0.32 1
98 ILE 1.14 -0.18 1
99 LYS 1.17 -0.56 1
100 LEU 1.25 -0.28 1
101 ASP 1.50 -0.24 1
102 GLU 1.87 -0.51 1
103 GLU 1.38 -0.25 1
104 ARG 2.22 -0.64 1
105 LYS 2.00 -0.49 1
106 GLU 1.37 -0.13 1
107 ARG 2.06 -0.67 1
108 LEU 1.37 -0.35 1
109 THR 1.67 -0.14 1
110 LYS 1.02 -0.30 1
111 MET 0.83 -0.14 1
112 ILE 0.80 -0.18 1
113 ASN 0.51 -0.15 1
114 ASP 0.41 -0.01 1
116 ASN 0.68 -0.22 1
117 GLN 0.91 -0.29 1
118 LYS 0.57 -0.35 1
119 LYS 0.35 -0.30 1
120 ILE -0.12 -0.12 1
121 ALA -0.31 0.10 1
122 LYS 0.15 0.03 1
123 THR -0.28 0.12 1
124 THR -0.05 0.05 1
125 ALA -0.02 0.17 1
126 THR -0.05 0.05 1
127 ALA -0.02 -0.03 1
128 ALA 0.00 -0.03 1
129 GLN 0.02 0.11 1
130 THR -0.36 0.12 1
131 SER -0.29 0.33 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr19098_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -7.90
_LACS_plot.Line_1_terminator_val_y_1 0.64
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.15
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.21
_LACS_plot.Line_2_terminator_val_x_2 5.28
_LACS_plot.Line_2_terminator_val_y_2 -0.46
_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
76 VAL -3.05 1.23 0
10 SER 0.99 -0.49 1
11 LEU 0.20 -0.54 1
13 ARG 2.59 -0.13 1
14 ASP -0.32 -0.05 1
15 ILE -3.68 0.15 1
16 THR -5.18 0.43 1
17 ALA 4.78 -0.43 1
18 VAL 4.63 -0.30 1
19 GLU 2.17 -0.27 1
20 LEU 3.21 -0.15 1
21 GLN 5.29 -0.63 1
22 ASN 3.62 -0.23 1
23 HIS 1.58 -0.51 1
24 PHE 1.92 0.04 1
25 LYS 4.82 -0.10 1
26 ASN 3.60 -0.07 1
27 SER -0.38 -0.01 1
28 SER 1.55 -0.64 1
30 ASP 2.59 -0.27 1
31 GLN -3.78 0.11 1
32 ILE -1.85 0.49 1
33 ARG -2.24 0.40 1
34 LEU -2.94 0.20 1
35 ARG -0.67 0.50 1
36 ALA 4.24 -0.49 1
37 ASP 3.62 -0.30 1
38 LYS -2.71 0.23 1
40 ILE -6.88 1.11 1
41 ALA -7.90 0.53 1
42 PHE -3.74 0.67 1
43 LEU -3.09 0.45 1
44 GLU -4.73 0.92 1
45 PHE -3.24 0.29 1
46 ASP -0.79 0.14 1
47 ALA 1.15 -0.18 1
48 ASP 2.26 -0.07 1
49 LYS 0.03 -0.04 1
50 ASP -1.03 0.20 1
51 ARG 3.18 -0.07 1
52 THR 2.13 0.03 1
54 ILE 3.62 -0.26 1
55 GLN 4.99 -0.64 1
56 ARG 4.07 -0.25 1
57 ARG 4.33 -0.58 1
58 MET 4.85 -1.19 1
59 ASP 4.59 -0.33 1
60 ILE 4.47 -0.46 1
61 ALA 5.21 0.06 1
62 LEU 4.15 -0.31 1
63 LEU 1.81 -0.02 1
64 GLN -0.49 0.35 1
65 HIS 2.56 -0.43 1
67 THR -2.87 0.01 1
68 LEU -2.41 0.49 1
69 LEU -3.00 -0.06 1
70 LYS 4.69 -0.59 1
71 GLU 3.46 -0.62 1
72 LYS -3.37 0.22 1
73 LYS 0.23 0.25 1
74 ILE -1.26 0.48 1
75 ASN -4.65 1.06 1
77 GLU -6.76 0.39 1
78 LEU 0.09 0.28 1
79 THR -0.34 0.24 1
80 VAL -0.60 0.13 1
85 ASN 0.06 0.01 1
86 SER 1.42 -0.17 1
87 GLN 2.41 -0.20 1
88 GLU 1.47 -0.20 1
89 ARG 2.37 -0.17 1
90 LEU 1.97 -0.16 1
91 GLU 1.54 -0.22 1
92 LYS 1.85 -0.12 1
93 LEU 1.09 -0.12 1
94 LYS 1.42 -0.12 1
95 ASN 0.31 -0.08 1
96 LYS 1.29 -0.06 1
97 ASN 0.93 -0.04 1
98 ILE 1.14 -0.07 1
99 LYS 1.17 -0.02 1
100 LEU 1.25 -0.08 1
101 ASP 1.50 -0.12 1
102 GLU 1.87 -0.20 1
103 GLU 1.38 -0.18 1
104 ARG 2.22 -0.16 1
105 LYS 2.00 -0.16 1
106 GLU 1.37 -0.17 1
107 ARG 2.06 -0.13 1
108 LEU 1.37 0.00 1
109 THR 1.67 -0.16 1
110 LYS 1.02 -0.03 1
111 MET 0.83 -0.05 1
112 ILE 0.80 -0.09 1
113 ASN 0.51 0.00 1
114 ASP 0.41 -0.09 1
116 ASN 0.68 -0.02 1
117 GLN 0.91 -0.06 1
118 LYS 0.57 -0.05 1
119 LYS 0.35 0.00 1
120 ILE -0.12 -0.02 1
121 ALA -0.31 0.02 1
122 LYS 0.15 0.04 1
123 THR -0.28 0.06 1
124 THR -0.05 -0.01 1
125 ALA -0.02 0.08 1
126 THR -0.05 -0.05 1
127 ALA -0.02 -0.01 1
128 ALA 0.00 -0.01 1
129 GLN 0.02 0.07 1
130 THR -0.36 0.03 1
131 SER -0.29 0.05 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr19098_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -7.90
_LACS_plot.Line_1_terminator_val_y_1 -3.81
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 0.81
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.10
_LACS_plot.Line_2_terminator_val_x_2 5.28
_LACS_plot.Line_2_terminator_val_y_2 2.40
_LACS_plot.Y_axis_chem_shift_offset 0.13
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
19 GLU 2.17 4.14 0
16 THR -5.18 0.84 0
10 SER 0.99 -0.49 1
11 LEU 0.20 -0.30 1
13 ARG 2.59 -0.15 1
14 ASP -0.32 -0.21 1
15 ILE -3.68 -4.05 1
17 ALA 4.78 2.12 1
18 VAL 4.63 1.79 1
20 LEU 3.21 0.28 1
21 GLN 5.29 2.67 1
22 ASN 3.62 3.01 1
23 HIS 1.58 2.92 1
24 PHE 1.92 0.89 1
25 LYS 4.82 1.73 1
26 ASN 3.60 0.38 1
27 SER -0.38 -1.09 1
30 ASP 2.59 0.01 1
31 GLN -3.78 -2.35 1
32 ILE -1.85 -1.25 1
33 ARG -2.24 -1.98 1
34 LEU -2.94 -1.84 1
35 ARG -0.67 0.00 1
36 ALA 4.24 1.07 1
37 ASP 3.62 0.79 1
38 LYS -2.71 0.03 1
40 ILE -6.88 -2.96 1
41 ALA -7.90 -4.41 1
42 PHE -3.74 -1.14 1
43 LEU -3.09 -2.65 1
44 GLU -4.73 -1.59 1
45 PHE -3.24 -1.30 1
46 ASP -0.79 0.38 1
47 ALA 1.15 0.26 1
48 ASP 2.26 1.54 1
49 LYS 0.03 -0.51 1
50 ASP -1.03 -1.42 1
51 ARG 3.18 2.87 1
52 THR 2.13 1.68 1
54 ILE 3.62 -0.71 1
55 GLN 4.99 1.38 1
56 ARG 4.07 2.44 1
57 ARG 4.33 2.27 1
58 MET 4.85 1.38 1
59 ASP 4.59 3.23 1
60 ILE 4.47 2.58 1
61 ALA 5.21 2.35 1
62 LEU 4.15 3.06 1
63 LEU 1.81 0.02 1
64 GLN -0.49 1.76 1
65 HIS 2.56 2.60 1
67 THR -2.87 -2.46 1
68 LEU -2.41 -1.06 1
69 LEU -3.00 -2.95 1
70 LYS 4.69 -0.98 1
71 GLU 3.46 -1.53 1
72 LYS -3.37 -2.20 1
73 LYS 0.23 0.33 1
74 ILE -1.26 -0.98 1
75 ASN -4.65 -0.93 1
76 VAL -3.05 -1.53 1
77 GLU -6.76 -2.07 1
78 LEU 0.09 -0.57 1
79 THR -0.34 -0.50 1
80 VAL -0.60 0.04 1
85 ASN 0.06 0.45 1
86 SER 1.42 0.59 1
87 GLN 2.41 1.00 1
88 GLU 1.47 1.06 1
89 ARG 2.37 1.20 1
90 LEU 1.97 0.89 1
91 GLU 1.54 1.03 1
92 LYS 1.85 1.11 1
93 LEU 1.09 0.27 1
94 LYS 1.42 0.34 1
95 ASN 0.31 0.44 1
96 LYS 1.29 -0.06 1
97 ASN 0.93 0.31 1
98 ILE 1.14 0.03 1
99 LYS 1.17 0.52 1
100 LEU 1.25 0.35 1
101 ASP 1.50 0.97 1
102 GLU 1.87 1.00 1
103 GLU 1.38 0.99 1
104 ARG 2.22 1.01 1
105 LYS 2.00 1.15 1
106 GLU 1.37 0.71 1
107 ARG 2.06 0.94 1
108 LEU 1.37 0.52 1
109 THR 1.67 0.15 1
110 LYS 1.02 0.06 1
111 MET 0.83 0.43 1
112 ILE 0.80 -0.07 1
113 ASN 0.51 0.04 1
114 ASP 0.41 0.90 1
116 ASN 0.68 0.45 1
117 GLN 0.91 0.17 1
118 LYS 0.57 -0.08 1
119 LYS 0.35 -0.15 1
120 ILE -0.12 -0.46 1
121 ALA -0.31 -0.29 1
122 LYS 0.15 0.24 1
123 THR -0.28 -0.06 1
124 THR -0.05 -0.40 1
125 ALA -0.02 0.14 1
126 THR -0.05 -0.26 1
127 ALA -0.02 -0.35 1
128 ALA 0.00 -0.03 1
129 GLN 0.02 0.28 1
130 THR -0.36 -0.25 1
131 SER -0.29 -0.74 1
stop_
save_