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 bmr11097_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -6.52
_LACS_plot.Line_1_terminator_val_y_1 -2.43
_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 -0.86
_LACS_plot.Line_2_terminator_val_x_2 4.45
_LACS_plot.Line_2_terminator_val_y_2 2.06
_LACS_plot.Y_axis_chem_shift_offset -0.05
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
80 TYR -4.24 1.06 0
91 TYR -5.98 0.48 0
10 THR 0.05 0.02 1
11 SER -0.30 -0.25 1
12 VAL 0.14 0.14 1
14 ASP -0.13 -0.15 1
15 LEU 0.66 0.12 1
16 SER 0.43 0.53 1
17 THR 0.33 0.09 1
19 MET -0.94 -1.16 1
20 LEU 0.52 -0.17 1
23 VAL -5.54 -3.07 1
25 VAL 2.73 1.08 1
26 GLN -5.09 -1.27 1
27 ALA -4.99 -2.09 1
28 VAL -4.65 -2.07 1
29 ALA 0.67 0.87 1
30 LEU -1.93 0.30 1
31 THR -4.95 -1.99 1
32 HIS 0.45 2.21 1
33 ASP -4.43 -2.45 1
34 ALA -4.31 -1.16 1
35 VAL -6.52 -2.07 1
36 ARG -2.09 -1.00 1
37 VAL -3.20 -2.32 1
38 SER -2.89 -0.57 1
39 TRP -1.86 -0.74 1
40 ALA -5.03 -2.13 1
41 ASP -2.63 -1.40 1
42 ASN 0.75 0.36 1
43 SER 0.54 0.66 1
44 VAL 0.25 0.33 1
46 LYS 1.24 1.03 1
47 ASN 0.93 0.25 1
48 GLN -0.56 0.11 1
49 LYS 0.74 0.56 1
50 THR -0.41 -0.27 1
51 SER 0.54 0.17 1
52 GLU -1.85 -0.69 1
53 VAL 0.65 0.59 1
54 ARG -1.68 -0.65 1
55 LEU -4.81 -1.78 1
56 TYR -1.58 -0.66 1
57 THR -1.05 -0.07 1
58 VAL -3.01 -2.10 1
59 ARG -5.73 -2.95 1
60 TRP -6.14 -1.18 1
61 ARG -4.53 -2.25 1
62 THR 1.34 0.44 1
63 SER 3.12 2.60 1
64 PHE 3.28 0.47 1
65 SER -1.33 -1.43 1
66 ALA 1.97 1.48 1
67 SER -0.54 -0.65 1
68 ALA -0.66 -0.17 1
69 LYS -1.39 -1.05 1
70 TYR -0.05 0.99 1
71 LYS -2.40 -1.44 1
72 SER -4.35 -1.09 1
73 GLU -5.07 -0.71 1
74 ASP -3.85 -1.52 1
75 THR -1.39 -1.31 1
76 THR 0.37 0.14 1
77 SER -0.35 0.32 1
78 LEU 1.63 -0.96 1
79 SER -3.79 -1.82 1
81 THR 0.27 -0.62 1
82 ALA -0.82 -1.80 1
83 THR -3.31 -1.96 1
85 LEU 0.23 -1.51 1
86 LYS -0.76 -0.26 1
88 ASN -0.13 0.00 1
89 THR -1.08 1.11 1
90 MET -1.26 0.25 1
92 GLU -6.40 -3.28 1
93 PHE -4.96 -0.84 1
94 SER -1.89 -0.04 1
95 VAL -5.18 -1.57 1
96 MET -4.24 -1.40 1
97 VAL -6.45 -3.21 1
98 THR -1.70 -0.26 1
99 LYS -2.84 -0.62 1
100 ASN 3.30 1.67 1
101 ARG 4.46 1.61 1
102 ARG -2.39 -0.83 1
103 SER -3.46 -0.79 1
104 SER -4.09 -0.75 1
105 THR -0.43 -0.76 1
106 TRP -0.08 0.80 1
107 SER -2.70 0.23 1
108 MET 1.00 1.16 1
109 THR -1.68 -0.58 1
110 ALA -5.55 -1.81 1
111 HIS -4.93 0.41 1
112 ALA -4.72 -0.05 1
113 THR -1.34 -1.22 1
114 THR 0.46 -0.04 1
115 TYR -0.08 -0.11 1
116 GLU -0.55 0.39 1
117 ALA -0.29 -0.21 1
118 SER -0.36 -0.16 1
121 SER -0.18 -0.08 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11097_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -6.52
_LACS_plot.Line_1_terminator_val_y_1 4.09
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -1.19
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 1.14
_LACS_plot.Line_2_terminator_val_x_2 4.45
_LACS_plot.Line_2_terminator_val_y_2 -2.39
_LACS_plot.Y_axis_chem_shift_offset -0.05
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
80 TYR -4.24 5.30 0
91 TYR -5.98 6.46 0
10 THR 0.05 -0.03 1
11 SER -0.30 0.05 1
12 VAL 0.14 0.00 1
14 ASP -0.13 -0.02 1
15 LEU 0.66 -0.54 1
16 SER 0.43 0.10 1
17 THR 0.33 -0.24 1
19 MET -0.94 -0.22 1
20 LEU 0.52 -0.69 1
23 VAL -5.54 2.47 1
25 VAL 2.73 -1.65 1
26 GLN -5.09 3.82 1
27 ALA -4.99 2.90 1
28 VAL -4.65 2.58 1
29 ALA 0.67 0.20 1
30 LEU -1.93 2.23 1
31 THR -4.95 2.96 1
32 HIS 0.45 1.76 1
33 ASP -4.43 1.98 1
34 ALA -4.31 3.15 1
35 VAL -6.52 4.45 1
36 ARG -2.09 1.09 1
37 VAL -3.20 0.88 1
38 SER -2.89 2.32 1
39 TRP -1.86 1.12 1
40 ALA -5.03 2.90 1
41 ASP -2.63 1.23 1
42 ASN 0.75 -0.39 1
43 SER 0.54 0.12 1
44 VAL 0.25 0.08 1
46 LYS 1.24 -0.21 1
47 ASN 0.93 -0.68 1
48 GLN -0.56 0.67 1
49 LYS 0.74 -0.18 1
50 THR -0.41 0.14 1
51 SER 0.54 -0.37 1
52 GLU -1.85 1.16 1
53 VAL 0.65 -0.06 1
54 ARG -1.68 1.03 1
55 LEU -4.81 3.03 1
56 TYR -1.58 0.92 1
57 THR -1.05 0.98 1
58 VAL -3.01 0.91 1
59 ARG -5.73 2.78 1
60 TRP -6.14 4.96 1
61 ARG -4.53 2.28 1
62 THR 1.34 -0.90 1
63 SER 3.12 -0.52 1
64 PHE 3.28 -2.81 1
65 SER -1.33 -0.10 1
66 ALA 1.97 -0.49 1
67 SER -0.54 -0.11 1
68 ALA -0.66 0.49 1
69 LYS -1.39 0.34 1
70 TYR -0.05 1.04 1
71 LYS -2.40 0.96 1
72 SER -4.35 3.26 1
73 GLU -5.07 4.36 1
74 ASP -3.85 2.33 1
75 THR -1.39 0.08 1
76 THR 0.37 -0.23 1
77 SER -0.35 0.67 1
78 LEU 1.63 -2.59 1
79 SER -3.79 1.97 1
81 THR 0.27 -0.89 1
82 ALA -0.82 -0.98 1
83 THR -3.31 1.35 1
85 LEU 0.23 -1.74 1
86 LYS -0.76 0.50 1
88 ASN -0.13 0.13 1
89 THR -1.08 2.19 1
90 MET -1.26 1.51 1
92 GLU -6.40 3.12 1
93 PHE -4.96 4.12 1
94 SER -1.89 1.85 1
95 VAL -5.18 3.61 1
96 MET -4.24 2.84 1
97 VAL -6.45 3.24 1
98 THR -1.70 1.44 1
99 LYS -2.84 2.22 1
100 ASN 3.30 -1.63 1
101 ARG 4.46 -2.85 1
102 ARG -2.39 1.56 1
103 SER -3.46 2.67 1
104 SER -4.09 3.34 1
105 THR -0.43 -0.33 1
106 TRP -0.08 0.88 1
107 SER -2.70 2.93 1
108 MET 1.00 0.16 1
109 THR -1.68 1.10 1
110 ALA -5.55 3.74 1
111 HIS -4.93 5.34 1
112 ALA -4.72 4.67 1
113 THR -1.34 0.12 1
114 THR 0.46 -0.50 1
115 TYR -0.08 -0.03 1
116 GLU -0.55 0.94 1
117 ALA -0.29 0.08 1
118 SER -0.36 0.20 1
121 SER -0.18 0.10 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11097_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -6.52
_LACS_plot.Line_1_terminator_val_y_1 0.67
_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 0.17
_LACS_plot.Line_2_terminator_val_x_2 4.45
_LACS_plot.Line_2_terminator_val_y_2 -0.45
_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
74 ASP -3.85 1.40 0
59 ARG -5.73 1.53 0
35 VAL -6.52 0.08 0
25 VAL 2.73 0.51 0
95 VAL -5.18 1.56 0
10 THR 0.05 0.03 1
11 SER -0.30 0.02 1
12 VAL 0.14 0.00 1
14 ASP -0.13 -0.06 1
15 LEU 0.66 0.01 1
16 SER 0.43 -0.05 1
17 THR 0.33 -0.05 1
19 MET -0.94 -0.03 1
20 LEU 0.52 -0.12 1
23 VAL -5.54 0.65 1
26 GLN -5.09 0.29 1
27 ALA -4.99 0.75 1
28 VAL -4.65 0.19 1
29 ALA 0.67 -0.12 1
30 LEU -1.93 0.28 1
32 HIS 0.45 0.27 1
33 ASP -4.43 -0.10 1
34 ALA -4.31 1.14 1
36 ARG -2.09 0.32 1
37 VAL -3.20 0.87 1
38 SER -2.89 0.29 1
39 TRP -1.86 0.26 1
40 ALA -5.03 0.35 1
41 ASP -2.63 0.38 1
42 ASN 0.75 0.03 1
43 SER 0.54 -0.01 1
44 VAL 0.25 -0.14 1
46 LYS 1.24 -0.14 1
47 ASN 0.93 -0.12 1
48 GLN -0.56 0.03 1
49 LYS 0.74 0.05 1
50 THR -0.41 0.11 1
51 SER 0.54 0.04 1
52 GLU -1.85 0.06 1
53 VAL 0.65 -0.06 1
54 ARG -1.68 0.03 1
55 LEU -4.81 0.14 1
56 TYR -1.58 0.78 1
57 THR -1.05 0.81 1
58 VAL -3.01 0.70 1
60 TRP -6.14 1.27 1
61 ARG -4.53 0.55 1
62 THR 1.34 -0.42 1
63 SER 3.12 -0.53 1
64 PHE 3.28 -0.28 1
65 SER -1.33 0.05 1
66 ALA 1.97 -0.18 1
67 SER -0.54 -0.09 1
68 ALA -0.66 -0.18 1
69 LYS -1.39 -0.06 1
70 TYR -0.05 -0.12 1
71 LYS -2.40 -0.11 1
72 SER -4.35 1.03 1
73 GLU -5.07 0.20 1
75 THR -1.39 0.73 1
76 THR 0.37 0.82 1
77 SER -0.35 0.21 1
78 LEU 1.63 -0.88 1
79 SER -3.79 -0.17 1
80 TYR -4.24 -0.05 1
81 THR 0.27 0.27 1
82 ALA -0.82 -0.28 1
83 THR -3.31 0.74 1
85 LEU 0.23 -0.17 1
86 LYS -0.76 0.08 1
88 ASN -0.13 -0.26 1
89 THR -1.08 0.06 1
90 MET -1.26 0.47 1
91 TYR -5.98 0.21 1
92 GLU -6.40 0.39 1
93 PHE -4.96 1.21 1
94 SER -1.89 0.02 1
96 MET -4.24 -0.01 1
97 VAL -6.45 0.84 1
98 THR -1.70 0.63 1
99 LYS -2.84 0.25 1
100 ASN 3.30 -0.47 1
101 ARG 4.46 -0.61 1
102 ARG -2.39 0.28 1
103 SER -3.46 1.02 1
104 SER -4.09 0.12 1
105 THR -0.43 -0.05 1
106 TRP -0.08 -0.38 1
107 SER -2.70 -0.18 1
108 MET 1.00 0.06 1
109 THR -1.68 0.55 1
110 ALA -5.55 0.57 1
111 HIS -4.93 1.37 1
112 ALA -4.72 0.39 1
113 THR -1.34 0.97 1
114 THR 0.46 -0.52 1
115 TYR -0.08 -0.05 1
116 GLU -0.55 -0.04 1
117 ALA -0.29 -0.24 1
118 SER -0.36 -0.06 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11097_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -6.52
_LACS_plot.Line_1_terminator_val_y_1 -2.24
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.11
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.08
_LACS_plot.Line_2_terminator_val_x_2 4.45
_LACS_plot.Line_2_terminator_val_y_2 0.41
_LACS_plot.Y_axis_chem_shift_offset 0.62
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
111 HIS -4.93 1.93 0
77 SER -0.35 -4.94 0
10 THR 0.05 -0.20 1
11 SER -0.30 -0.64 1
12 VAL 0.14 -0.39 1
14 ASP -0.13 0.17 1
15 LEU 0.66 -0.03 1
16 SER 0.43 -0.20 1
17 THR 0.33 -0.50 1
19 MET -0.94 -1.14 1
20 LEU 0.52 -0.84 1
23 VAL -5.54 -0.89 1
25 VAL 2.73 0.18 1
26 GLN -5.09 -3.12 1
27 ALA -4.99 -3.18 1
28 VAL -4.65 -1.87 1
29 ALA 0.67 -1.46 1
30 LEU -1.93 -0.20 1
31 THR -4.95 -0.35 1
32 HIS 0.45 -0.92 1
33 ASP -4.43 -0.98 1
34 ALA -4.31 -1.27 1
35 VAL -6.52 -3.62 1
36 ARG -2.09 -2.01 1
37 VAL -3.20 -2.20 1
38 SER -2.89 -2.15 1
39 TRP -1.86 -4.25 1
40 ALA -5.03 -1.74 1
41 ASP -2.63 -0.07 1
42 ASN 0.75 0.54 1
43 SER 0.54 -0.57 1
44 VAL 0.25 -0.72 1
46 LYS 1.24 0.30 1
47 ASN 0.93 -0.49 1
48 GLN -0.56 -0.28 1
49 LYS 0.74 0.46 1
50 THR -0.41 -0.44 1
51 SER 0.54 -0.22 1
52 GLU -1.85 -0.96 1
53 VAL 0.65 -0.64 1
54 ARG -1.68 -3.23 1
55 LEU -4.81 -2.22 1
56 TYR -1.58 -0.87 1
57 THR -1.05 -2.29 1
58 VAL -3.01 -2.39 1
59 ARG -5.73 -1.28 1
60 TRP -6.14 -1.37 1
61 ARG -4.53 -1.69 1
62 THR 1.34 0.61 1
63 SER 3.12 0.32 1
64 PHE 3.28 -0.59 1
65 SER -1.33 0.36 1
67 SER -0.54 -0.33 1
68 ALA -0.66 -0.90 1
69 LYS -1.39 -0.10 1
70 TYR -0.05 1.40 1
71 LYS -2.40 -2.79 1
72 SER -4.35 -1.12 1
73 GLU -5.07 -3.27 1
74 ASP -3.85 0.50 1
75 THR -1.39 -2.33 1
76 THR 0.37 1.51 1
78 LEU 1.63 -3.12 1
79 SER -3.79 -1.74 1
80 TYR -4.24 -2.87 1
81 THR 0.27 -3.20 1
82 ALA -0.82 -2.12 1
83 THR -3.31 -0.03 1
85 LEU 0.23 -2.36 1
86 LYS -0.76 0.22 1
88 ASN -0.13 -0.84 1
89 THR -1.08 -3.50 1
90 MET -1.26 -1.15 1
91 TYR -5.98 -2.80 1
92 GLU -6.40 -1.64 1
93 PHE -4.96 -0.70 1
94 SER -1.89 -1.78 1
95 VAL -5.18 -2.23 1
96 MET -4.24 -3.45 1
97 VAL -6.45 -4.88 1
98 THR -1.70 -1.34 1
99 LYS -2.84 -1.07 1
100 ASN 3.30 -1.17 1
101 ARG 4.46 -1.34 1
102 ARG -2.39 -1.72 1
103 SER -3.46 0.05 1
104 SER -4.09 -0.42 1
105 THR -0.43 -0.09 1
106 TRP -0.08 1.52 1
107 SER -2.70 -1.57 1
108 MET 1.00 0.06 1
109 THR -1.68 0.09 1
110 ALA -5.55 -2.20 1
112 ALA -4.72 -2.60 1
113 THR -1.34 0.32 1
114 THR 0.46 0.64 1
115 TYR -0.08 0.05 1
116 GLU -0.55 -0.19 1
117 ALA -0.29 -0.53 1
118 SER -0.36 -0.09 1
121 SER -0.18 2.77 1
stop_
save_