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 bmr17757_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -0.83
_LACS_plot.Line_1_terminator_val_y_1 -0.40
_LACS_plot.Line_1_terminator_val_x_2 1.99
_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 -1.12
_LACS_plot.Line_2_terminator_val_x_2 0.85
_LACS_plot.Line_2_terminator_val_y_2 0.65
_LACS_plot.Y_axis_chem_shift_offset -0.12
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
22 ILE -0.40 -0.54 0
11 TYR 0.14 0.24 1
13 LEU 0.32 0.45 1
15 SER -0.46 -0.04 1
16 ALA 0.35 0.35 1
18 SER -0.17 0.15 1
19 ARG 0.18 0.28 1
21 ILE 0.16 -0.06 1
23 HIS -0.50 -0.31 1
24 PHE -0.12 0.26 1
26 SER 0.03 0.27 1
28 TYR 0.85 0.69 1
31 ARG 0.80 0.62 1
32 TYR -0.03 -0.03 1
33 TYR -0.16 0.03 1
34 ARG 0.08 0.10 1
36 ASN 0.27 0.24 1
38 HIS 0.38 0.52 1
39 ARG -0.13 0.13 1
40 TYR 0.31 0.23 1
42 ASN 0.48 0.38 1
43 GLN -0.06 0.27 1
44 VAL 0.18 0.16 1
45 TYR -0.75 -0.32 1
46 TYR -0.74 -0.31 1
47 ARG -0.83 -0.37 1
52 TYR -0.23 -0.13 1
53 SER -0.42 -0.13 1
54 ASN 0.32 0.23 1
55 GLN 0.58 0.53 1
56 ASN 0.25 0.26 1
57 ASN 0.26 0.20 1
58 PHE 0.13 -0.02 1
59 VAL 0.45 0.30 1
60 HIS 0.15 0.11 1
63 VAL 0.16 0.14 1
64 ASN -0.07 0.02 1
65 ILE -0.13 0.07 1
66 THR 0.17 0.32 1
67 ILE -0.07 -0.16 1
68 LYS 0.06 0.04 1
69 GLN -0.06 0.25 1
70 HIS 0.24 0.33 1
71 THR -0.13 0.22 1
72 VAL -0.17 0.00 1
73 THR -0.30 -0.07 1
74 THR -0.37 -0.13 1
75 THR -0.42 -0.16 1
76 THR -0.17 0.02 1
77 LYS 0.46 0.52 1
80 ASN -0.06 -0.03 1
81 PHE 0.17 0.22 1
82 THR 0.02 0.25 1
84 THR 0.17 0.26 1
86 VAL 0.55 0.35 1
87 LYS 0.49 0.33 1
91 ARG 0.27 0.31 1
92 VAL 0.06 0.10 1
93 VAL 0.15 0.12 1
95 GLN 0.29 0.07 1
98 ILE 0.28 0.28 1
99 THR 0.05 0.21 1
100 GLN 0.30 0.41 1
101 TYR 0.24 0.23 1
103 ARG 0.59 0.49 1
105 SER 0.13 0.30 1
106 GLN 0.35 0.39 1
107 ALA 0.16 0.22 1
108 TYR 0.11 0.28 1
109 TYR -0.33 -0.16 1
110 GLN -0.12 0.07 1
111 ARG 0.43 0.47 1
113 SER -0.73 -0.44 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr17757_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -0.83
_LACS_plot.Line_1_terminator_val_y_1 0.43
_LACS_plot.Line_1_terminator_val_x_2 1.99
_LACS_plot.Line_1_terminator_val_y_2 -0.64
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.88
_LACS_plot.Line_2_terminator_val_x_2 0.85
_LACS_plot.Line_2_terminator_val_y_2 -0.20
_LACS_plot.Y_axis_chem_shift_offset -0.12
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
22 ILE -0.40 -0.14 0
11 TYR 0.14 0.10 1
13 LEU 0.32 0.13 1
15 SER -0.46 0.42 1
16 ALA 0.35 0.00 1
18 SER -0.17 0.32 1
19 ARG 0.18 0.10 1
21 ILE 0.16 -0.22 1
23 HIS -0.50 0.19 1
24 PHE -0.12 0.38 1
26 SER 0.03 0.24 1
28 TYR 0.85 -0.16 1
31 ARG 0.80 -0.18 1
32 TYR -0.03 0.00 1
33 TYR -0.16 0.19 1
34 ARG 0.08 0.02 1
36 ASN 0.27 -0.03 1
38 HIS 0.38 0.14 1
39 ARG -0.13 0.26 1
40 TYR 0.31 -0.08 1
42 ASN 0.48 -0.10 1
43 GLN -0.06 0.33 1
44 VAL 0.18 -0.02 1
45 TYR -0.75 0.43 1
46 TYR -0.74 0.43 1
47 ARG -0.83 0.46 1
52 TYR -0.23 0.10 1
53 SER -0.42 0.29 1
54 ASN 0.32 -0.09 1
55 GLN 0.58 -0.05 1
56 ASN 0.25 0.01 1
57 ASN 0.26 -0.06 1
58 PHE 0.13 -0.15 1
59 VAL 0.45 -0.15 1
60 HIS 0.15 -0.04 1
63 VAL 0.16 -0.02 1
64 ASN -0.07 0.09 1
65 ILE -0.13 0.20 1
66 THR 0.17 0.15 1
67 ILE -0.07 -0.09 1
68 LYS 0.06 -0.02 1
69 GLN -0.06 0.31 1
70 HIS 0.24 0.09 1
71 THR -0.13 0.35 1
72 VAL -0.17 0.17 1
73 THR -0.30 0.23 1
74 THR -0.37 0.24 1
75 THR -0.42 0.26 1
76 THR -0.17 0.19 1
77 LYS 0.46 0.06 1
80 ASN -0.06 0.03 1
81 PHE 0.17 0.05 1
82 THR 0.02 0.23 1
84 THR 0.17 0.09 1
86 VAL 0.55 -0.20 1
87 LYS 0.49 -0.16 1
91 ARG 0.27 0.04 1
92 VAL 0.06 0.04 1
93 VAL 0.15 -0.03 1
95 GLN 0.29 -0.22 1
98 ILE 0.28 0.00 1
99 THR 0.05 0.16 1
100 GLN 0.30 0.11 1
101 TYR 0.24 -0.01 1
103 ARG 0.59 -0.10 1
105 SER 0.13 0.17 1
106 GLN 0.35 0.04 1
107 ALA 0.16 0.06 1
108 TYR 0.11 0.17 1
109 TYR -0.33 0.17 1
110 GLN -0.12 0.19 1
111 ARG 0.43 0.04 1
113 SER -0.73 0.29 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr17757_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -0.83
_LACS_plot.Line_1_terminator_val_y_1 0.05
_LACS_plot.Line_1_terminator_val_x_2 1.99
_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 0.13
_LACS_plot.Line_2_terminator_val_x_2 0.85
_LACS_plot.Line_2_terminator_val_y_2 -0.07
_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
47 ARG -0.83 -0.12 0
11 TYR 0.14 -0.02 1
15 SER -0.46 0.03 1
16 ALA 0.35 0.00 1
18 SER -0.17 0.01 1
19 ARG 0.18 -0.02 1
21 ILE 0.16 -0.09 1
22 ILE -0.40 -0.08 1
23 HIS -0.50 0.01 1
24 PHE -0.12 0.01 1
26 SER 0.03 -0.03 1
28 TYR 0.85 -0.09 1
31 ARG 0.80 -0.13 1
32 TYR -0.03 -0.03 1
33 TYR -0.16 -0.03 1
34 ARG 0.08 -0.06 1
36 ASN 0.27 -0.08 1
38 HIS 0.38 -0.11 1
39 ARG -0.13 -0.04 1
40 TYR 0.31 0.00 1
42 ASN 0.48 -0.07 1
43 GLN -0.06 -0.02 1
44 VAL 0.18 -0.11 1
45 TYR -0.75 0.01 1
46 TYR -0.74 -0.02 1
52 TYR -0.23 0.08 1
53 SER -0.42 0.01 1
55 GLN 0.58 -0.04 1
56 ASN 0.25 -0.09 1
57 ASN 0.26 -0.08 1
58 PHE 0.13 0.02 1
59 VAL 0.45 -0.08 1
60 HIS 0.15 0.02 1
64 ASN -0.07 0.04 1
65 ILE -0.13 0.11 1
66 THR 0.17 0.04 1
67 ILE -0.07 0.03 1
68 LYS 0.06 0.00 1
69 GLN -0.06 -0.02 1
70 HIS 0.24 0.08 1
72 VAL -0.17 0.18 1
73 THR -0.30 0.17 1
74 THR -0.37 0.17 1
75 THR -0.42 0.17 1
76 THR -0.17 0.18 1
77 LYS 0.46 0.00 1
81 PHE 0.17 0.09 1
82 THR 0.02 -0.03 1
84 THR 0.17 -0.02 1
86 VAL 0.55 -0.02 1
87 LYS 0.49 -0.01 1
91 ARG 0.27 0.05 1
93 VAL 0.15 0.00 1
95 GLN 0.29 -0.02 1
99 THR 0.05 -0.03 1
101 TYR 0.24 -0.01 1
103 ARG 0.59 -0.05 1
105 SER 0.13 -0.05 1
106 GLN 0.35 -0.02 1
108 TYR 0.11 -0.12 1
109 TYR -0.33 -0.03 1
110 GLN -0.12 -0.04 1
111 ARG 0.43 -0.14 1
113 SER -0.73 0.04 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr17757_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -0.83
_LACS_plot.Line_1_terminator_val_y_1 -0.57
_LACS_plot.Line_1_terminator_val_x_2 1.99
_LACS_plot.Line_1_terminator_val_y_2 0.49
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.01
_LACS_plot.Line_2_terminator_val_x_2 0.85
_LACS_plot.Line_2_terminator_val_y_2 0.06
_LACS_plot.Y_axis_chem_shift_offset 0.26
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
47 ARG -0.83 -0.86 0
31 ARG 0.80 -0.54 0
46 TYR -0.74 -1.03 0
11 TYR 0.14 0.07 1
13 LEU 0.32 0.18 1
15 SER -0.46 -0.02 1
16 ALA 0.35 0.13 1
18 SER -0.17 -0.59 1
19 ARG 0.18 -0.38 1
21 ILE 0.16 -0.43 1
22 ILE -0.40 -0.82 1
23 HIS -0.50 -0.22 1
24 PHE -0.12 0.33 1
26 SER 0.03 -0.04 1
28 TYR 0.85 -0.08 1
32 TYR -0.03 -0.40 1
33 TYR -0.16 -0.41 1
34 ARG 0.08 -0.39 1
36 ASN 0.27 0.23 1
38 HIS 0.38 -0.07 1
39 ARG -0.13 -0.70 1
40 TYR 0.31 -0.60 1
42 ASN 0.48 -0.01 1
43 GLN -0.06 -0.51 1
44 VAL 0.18 -0.86 1
45 TYR -0.75 -0.79 1
52 TYR -0.23 -0.08 1
53 SER -0.42 -0.34 1
54 ASN 0.32 0.14 1
55 GLN 0.58 -0.26 1
56 ASN 0.25 -0.32 1
57 ASN 0.26 -0.38 1
58 PHE 0.13 -0.21 1
59 VAL 0.45 -0.48 1
60 HIS 0.15 -0.01 1
63 VAL 0.16 -0.73 1
64 ASN -0.07 -0.25 1
65 ILE -0.13 -0.24 1
66 THR 0.17 -0.31 1
67 ILE -0.07 -0.36 1
68 LYS 0.06 -0.23 1
69 GLN -0.06 -0.12 1
70 HIS 0.24 0.34 1
71 THR -0.13 -0.37 1
72 VAL -0.17 -0.09 1
73 THR -0.30 -0.02 1
74 THR -0.37 -0.05 1
75 THR -0.42 0.02 1
76 THR -0.17 -0.07 1
77 LYS 0.46 0.32 1
80 ASN -0.06 -0.31 1
81 PHE 0.17 0.04 1
82 THR 0.02 -0.29 1
84 THR 0.17 -0.44 1
86 VAL 0.55 -0.15 1
87 LYS 0.49 0.31 1
91 ARG 0.27 -0.26 1
92 VAL 0.06 -0.33 1
93 VAL 0.15 -0.33 1
95 GLN 0.29 0.13 1
98 ILE 0.28 -0.03 1
99 THR 0.05 -0.30 1
100 GLN 0.30 -0.41 1
101 TYR 0.24 0.00 1
103 ARG 0.59 0.14 1
105 SER 0.13 0.03 1
106 GLN 0.35 -0.28 1
107 ALA 0.16 -0.49 1
108 TYR 0.11 -0.40 1
109 TYR -0.33 -0.55 1
110 GLN -0.12 -0.37 1
111 ARG 0.43 0.40 1
stop_
save_