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 bmr6919_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -7.17
_LACS_plot.Line_1_terminator_val_y_1 -2.67
_LACS_plot.Line_1_terminator_val_x_2 2.00
_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 -1.69
_LACS_plot.Line_2_terminator_val_x_2 6.58
_LACS_plot.Line_2_terminator_val_y_2 5.31
_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
55 ILE 1.66 -0.59 0
32 ASN 2.87 4.75 0
95 VAL -7.17 -2.49 0
10 GLU 3.42 2.74 1
11 GLU 2.94 2.55 1
13 GLU 2.90 3.19 1
14 THR 6.34 4.46 1
20 MET 3.48 1.73 1
21 VAL 6.58 5.45 1
23 LYS 4.59 3.46 1
24 ILE 5.11 5.01 1
25 ILE 5.96 4.51 1
26 ASP 3.99 3.61 1
27 VAL 5.56 4.33 1
28 LEU 2.58 2.85 1
30 SER 5.45 3.67 1
31 HIS 3.84 4.74 1
33 GLU 3.54 2.80 1
34 ALA 3.63 2.56 1
36 GLN 3.08 1.87 1
37 GLU -1.37 -0.26 1
38 ASN -0.69 -1.07 1
39 LYS 2.46 0.95 1
40 ASP 0.80 0.73 1
41 LEU -1.84 -0.70 1
42 GLN -0.22 -0.59 1
44 TYR -4.33 -2.74 1
45 MET -4.51 -0.69 1
47 ILE 1.24 2.73 1
49 HIS 5.42 4.40 1
50 VAL 3.30 1.89 1
52 ASP 2.73 2.04 1
53 SER -1.34 0.64 1
54 LEU -1.50 -0.88 1
56 GLN 2.67 2.72 1
58 HIS -1.60 0.06 1
59 ASP 6.00 4.69 1
60 ARG 4.69 3.50 1
61 LYS 3.26 2.56 1
62 LYS -0.41 -1.43 1
63 MET 4.89 4.82 1
64 LYS 5.23 4.40 1
66 VAL 3.77 3.19 1
67 TRP 4.93 3.51 1
68 ASP 3.58 2.80 1
70 ALA 6.10 5.10 1
71 VAL 3.43 3.00 1
72 ASP 4.29 4.22 1
73 PHE 2.64 2.76 1
74 LEU 2.68 2.09 1
75 ALA 0.09 0.97 1
76 ALA -2.82 -1.67 1
81 VAL -4.83 -2.07 1
82 ARG 0.60 0.16 1
83 THR -6.46 -2.48 1
84 GLU 0.30 -0.11 1
85 THR -5.88 -2.31 1
86 ARG -0.20 -0.88 1
87 ARG -1.75 -0.30 1
88 ILE -5.01 -2.03 1
91 ALA -0.78 0.05 1
92 ASP -3.96 -0.74 1
93 PHE -1.47 -0.62 1
94 LEU -6.65 -4.57 1
96 TRP -5.05 -0.97 1
97 ARG -2.60 -1.04 1
98 TRP -1.30 -1.87 1
99 ILE -1.11 -0.52 1
100 GLN 0.35 0.07 1
102 SER -0.62 0.05 1
103 ALA 0.35 0.07 1
104 SER -0.37 -0.12 1
109 LEU -0.11 -0.21 1
110 VAL -2.67 -2.77 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr6919_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -7.17
_LACS_plot.Line_1_terminator_val_y_1 4.50
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -1.36
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.31
_LACS_plot.Line_2_terminator_val_x_2 6.58
_LACS_plot.Line_2_terminator_val_y_2 -1.27
_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
55 ILE 1.66 -2.25 0
32 ASN 2.87 1.88 0
95 VAL -7.17 4.68 0
10 GLU 3.42 -0.68 1
11 GLU 2.94 -0.39 1
13 GLU 2.90 0.29 1
14 THR 6.34 -1.88 1
20 MET 3.48 -1.75 1
21 VAL 6.58 -1.13 1
23 LYS 4.59 -1.13 1
24 ILE 5.11 -0.10 1
25 ILE 5.96 -1.45 1
26 ASP 3.99 -0.38 1
27 VAL 5.56 -1.23 1
28 LEU 2.58 0.27 1
30 SER 5.45 -1.78 1
31 HIS 3.84 0.90 1
33 GLU 3.54 -0.74 1
34 ALA 3.63 -1.07 1
36 GLN 3.08 -1.21 1
37 GLU -1.37 1.11 1
38 ASN -0.69 -0.38 1
39 LYS 2.46 -1.51 1
40 ASP 0.80 -0.07 1
41 LEU -1.84 1.14 1
42 GLN -0.22 -0.37 1
44 TYR -4.33 1.59 1
45 MET -4.51 3.82 1
47 ILE 1.24 1.49 1
49 HIS 5.42 -1.02 1
50 VAL 3.30 -1.41 1
52 ASP 2.73 -0.69 1
53 SER -1.34 1.98 1
54 LEU -1.50 0.62 1
56 GLN 2.67 0.05 1
58 HIS -1.60 1.66 1
59 ASP 6.00 -1.31 1
60 ARG 4.69 -1.19 1
61 LYS 3.26 -0.70 1
62 LYS -0.41 -1.02 1
63 MET 4.89 -0.07 1
64 LYS 5.23 -0.83 1
66 VAL 3.77 -0.58 1
67 TRP 4.93 -1.42 1
68 ASP 3.58 -0.78 1
70 ALA 6.10 -1.00 1
71 VAL 3.43 -0.43 1
72 ASP 4.29 -0.07 1
73 PHE 2.64 0.12 1
74 LEU 2.68 -0.59 1
75 ALA 0.09 0.88 1
76 ALA -2.82 1.15 1
81 VAL -4.83 2.76 1
82 ARG 0.60 -0.44 1
83 THR -6.46 3.98 1
84 GLU 0.30 -0.41 1
85 THR -5.88 3.57 1
86 ARG -0.20 -0.68 1
87 ARG -1.75 1.45 1
88 ILE -5.01 2.98 1
91 ALA -0.78 0.83 1
92 ASP -3.96 3.22 1
93 PHE -1.47 0.85 1
94 LEU -6.65 2.08 1
96 TRP -5.05 4.08 1
97 ARG -2.60 1.56 1
98 TRP -1.30 -0.57 1
99 ILE -1.11 0.59 1
100 GLN 0.35 -0.28 1
102 SER -0.62 0.67 1
103 ALA 0.35 -0.28 1
104 SER -0.37 0.25 1
109 LEU -0.11 -0.10 1
110 VAL -2.67 -0.10 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr6919_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -7.17
_LACS_plot.Line_1_terminator_val_y_1 0.70
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.18
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.19
_LACS_plot.Line_2_terminator_val_x_2 6.58
_LACS_plot.Line_2_terminator_val_y_2 -0.62
_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
82 ARG 0.60 1.29 0
10 GLU 3.42 -0.26 1
11 GLU 2.94 -0.29 1
13 GLU 2.90 -0.35 1
14 THR 6.34 -0.59 1
20 MET 3.48 -0.03 1
21 VAL 6.58 -0.81 1
23 LYS 4.59 -0.21 1
24 ILE 5.11 -0.82 1
25 ILE 5.96 -0.87 1
26 ASP 3.99 -0.35 1
27 VAL 5.56 -0.44 1
28 LEU 2.58 -0.22 1
30 SER 5.45 -0.30 1
31 HIS 3.84 -0.34 1
32 ASN 2.87 -0.45 1
33 GLU 3.54 -0.40 1
34 ALA 3.63 -0.19 1
36 GLN 3.08 -0.34 1
37 GLU -1.37 0.02 1
38 ASN -0.69 0.10 1
39 LYS 2.46 -0.01 1
40 ASP 0.80 -0.01 1
41 LEU -1.84 -0.04 1
42 GLN -0.22 -0.09 1
44 TYR -4.33 0.73 1
45 MET -4.51 0.25 1
47 ILE 1.24 -0.28 1
49 HIS 5.42 -0.49 1
50 VAL 3.30 -0.38 1
52 ASP 2.73 -0.18 1
53 SER -1.34 0.08 1
54 LEU -1.50 0.07 1
55 ILE 1.66 0.05 1
56 GLN 2.67 -0.25 1
58 HIS -1.60 0.32 1
59 ASP 6.00 -0.73 1
60 ARG 4.69 -0.21 1
61 LYS 3.26 -0.16 1
62 LYS -0.41 0.40 1
63 MET 4.89 -0.30 1
64 LYS 5.23 -0.70 1
66 VAL 3.77 -0.41 1
67 TRP 4.93 -0.45 1
68 ASP 3.58 -0.50 1
70 ALA 6.10 -0.64 1
71 VAL 3.43 -0.20 1
72 ASP 4.29 -0.60 1
73 PHE 2.64 -0.48 1
74 LEU 2.68 -0.15 1
75 ALA 0.09 -0.06 1
76 ALA -2.82 0.58 1
81 VAL -4.83 0.50 1
83 THR -6.46 0.38 1
84 GLU 0.30 0.85 1
85 THR -5.88 0.17 1
86 ARG -0.20 0.75 1
87 ARG -1.75 0.15 1
88 ILE -5.01 0.27 1
91 ALA -0.78 0.43 1
92 ASP -3.96 0.03 1
93 PHE -1.47 0.58 1
94 LEU -6.65 0.86 1
95 VAL -7.17 1.35 1
96 TRP -5.05 0.53 1
97 ARG -2.60 0.52 1
98 TRP -1.30 -0.03 1
99 ILE -1.11 -0.20 1
100 GLN 0.35 -0.06 1
102 SER -0.62 0.06 1
103 ALA 0.35 -0.06 1
104 SER -0.37 0.04 1
109 LEU -0.11 -0.05 1
110 VAL -2.67 0.26 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr6919_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -7.17
_LACS_plot.Line_1_terminator_val_y_1 -3.16
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 0.88
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -0.92
_LACS_plot.Line_2_terminator_val_x_2 6.58
_LACS_plot.Line_2_terminator_val_y_2 2.96
_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
49 HIS 1.24 4.48 0
96 TRP -7.17 0.70 0
10 GLU 3.42 2.54 1
13 GLU 2.90 2.28 1
20 MET 3.48 1.12 1
21 VAL 6.58 2.93 1
23 LYS 4.59 2.90 1
24 ILE 5.11 1.03 1
25 ILE 5.96 0.78 1
26 ASP 3.99 3.35 1
27 VAL 5.56 2.70 1
28 LEU 2.58 2.14 1
30 SER 5.45 2.75 1
31 HIS 3.84 2.55 1
32 ASN 2.87 2.47 1
33 GLU 3.54 2.76 1
34 ALA 3.63 2.94 1
36 GLN 3.08 1.04 1
37 GLU -1.37 -0.95 1
38 ASN -0.69 -0.40 1
39 LYS 2.46 -0.11 1
40 ASP 0.80 0.34 1
41 LEU -1.84 -0.73 1
44 TYR -4.33 -1.65 1
45 MET -4.51 -1.27 1
50 VAL 5.42 1.58 1
52 ASP 3.30 0.83 1
53 SER 2.73 0.35 1
54 LEU -1.34 -1.61 1
55 ILE -1.50 -1.09 1
58 HIS 2.67 1.42 1
59 ASP -1.60 -0.17 1
60 ARG 6.00 1.94 1
61 LYS 4.69 2.70 1
62 LYS 3.26 1.90 1
63 MET -0.41 -0.05 1
64 LYS 4.89 -0.04 1
66 VAL 5.23 0.70 1
67 TRP 3.77 0.36 1
68 ASP 4.93 3.39 1
70 ALA 3.58 0.79 1
71 VAL 6.10 3.10 1
72 ASP 3.43 2.22 1
73 PHE 4.29 3.12 1
74 LEU 2.64 1.70 1
75 ALA 2.68 1.40 1
81 VAL -2.82 -1.55 1
82 ARG -4.83 -0.97 1
83 THR 0.60 -0.07 1
84 GLU -6.46 -2.48 1
85 THR 0.30 0.28 1
86 ARG -5.88 -2.80 1
87 ARG -0.20 -0.19 1
88 ILE -1.75 0.47 1
91 ALA -5.01 -3.37 1
92 ASP -0.78 -0.42 1
93 PHE -3.96 -1.35 1
94 LEU -1.47 -0.60 1
95 VAL -6.65 -3.06 1
97 ARG -5.05 -2.51 1
98 TRP -2.60 -0.72 1
99 ILE -1.30 -1.96 1
100 GLN -1.11 -0.44 1
102 SER 0.35 -0.40 1
103 ALA -0.62 -0.30 1
104 SER 0.35 -0.12 1
109 LEU -0.37 -1.21 1
110 VAL -0.11 -0.96 1
111 ILE -2.67 -2.09 1
stop_
save_