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 bmr11323_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CA
_LACS_plot.Line_1_terminator_val_x_1 -6.39
_LACS_plot.Line_1_terminator_val_y_1 -2.05
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 0.84
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 -1.42
_LACS_plot.Line_2_terminator_val_x_2 5.83
_LACS_plot.Line_2_terminator_val_y_2 4.47
_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
46 HIS -3.01 2.05 0
10 ALA -0.19 -0.10 1
11 VAL -0.28 -0.20 1
12 ALA -0.32 -0.13 1
14 GLU -0.64 -0.15 1
15 ARG 0.29 -0.26 1
17 ARG -4.64 -2.98 1
19 ALA 2.42 1.97 1
20 TYR 1.81 3.16 1
22 SER 4.63 3.78 1
23 ALA -1.76 0.26 1
24 GLU 2.63 2.41 1
25 ALA -4.66 -1.12 1
26 SER -1.72 0.04 1
27 LYS -3.17 -1.37 1
28 ARG -5.02 -2.50 1
30 SER 3.28 2.47 1
31 ARG 1.27 2.80 1
33 GLN 4.94 1.35 1
34 ASN -1.80 -0.08 1
35 GLU -5.18 -1.91 1
36 TRP -3.38 -0.59 1
37 TYR -6.39 -0.88 1
40 ARG 3.76 2.54 1
41 GLU 5.83 4.74 1
43 GLN 4.37 3.23 1
44 VAL 5.29 4.16 1
45 LYS 4.84 3.25 1
47 TRP 2.85 3.09 1
48 GLU 3.88 2.96 1
49 LYS 0.89 1.17 1
50 HIS 2.29 3.46 1
52 LYS 2.62 1.79 1
53 THR -0.45 -0.68 1
55 VAL -0.87 -0.43 1
56 LEU 0.94 0.76 1
57 ALA 0.09 0.01 1
58 ALA 0.05 0.10 1
59 GLN 0.27 0.42 1
61 ASP 0.31 0.42 1
62 ARG 0.82 0.38 1
63 ALA 0.41 0.33 1
64 LYS 0.33 0.20 1
65 SER -0.38 0.04 1
68 SER -0.16 0.16 1
stop_
save_
save_LACS_CACB_CB_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11323_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CB
_LACS_plot.Line_1_terminator_val_x_1 -6.39
_LACS_plot.Line_1_terminator_val_y_1 4.34
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -1.16
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.58
_LACS_plot.Line_2_terminator_val_x_2 5.83
_LACS_plot.Line_2_terminator_val_y_2 -1.36
_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
46 HIS -3.01 5.06 0
10 ALA -0.19 0.09 1
11 VAL -0.28 0.08 1
12 ALA -0.32 0.19 1
14 GLU -0.64 0.49 1
15 ARG 0.29 -0.55 1
17 ARG -4.64 1.66 1
19 ALA 2.42 -0.45 1
20 TYR 1.81 1.35 1
22 SER 4.63 -0.85 1
23 ALA -1.76 2.02 1
24 GLU 2.63 -0.22 1
25 ALA -4.66 3.54 1
26 SER -1.72 1.76 1
27 LYS -3.17 1.80 1
28 ARG -5.02 2.52 1
30 SER 3.28 -0.81 1
31 ARG 1.27 1.53 1
33 GLN 4.94 -3.59 1
34 ASN -1.80 1.72 1
35 GLU -5.18 3.27 1
36 TRP -3.38 2.79 1
37 TYR -6.39 5.51 1
40 ARG 3.76 -1.22 1
41 GLU 5.83 -1.09 1
43 GLN 4.37 -1.14 1
44 VAL 5.29 -1.13 1
45 LYS 4.84 -1.59 1
47 TRP 2.85 0.24 1
48 GLU 3.88 -0.92 1
49 LYS 0.89 0.28 1
50 HIS 2.29 1.17 1
52 LYS 2.62 -0.83 1
53 THR -0.45 -0.23 1
55 VAL -0.87 0.44 1
56 LEU 0.94 -0.18 1
57 ALA 0.09 -0.08 1
58 ALA 0.05 0.05 1
59 GLN 0.27 0.15 1
61 ASP 0.31 0.11 1
62 ARG 0.82 -0.44 1
63 ALA 0.41 -0.08 1
64 LYS 0.33 -0.13 1
65 SER -0.38 0.42 1
68 SER -0.16 0.32 1
stop_
save_
save_LACS_CACB_HA_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11323_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name HA
_LACS_plot.Line_1_terminator_val_x_1 -6.39
_LACS_plot.Line_1_terminator_val_y_1 0.45
_LACS_plot.Line_1_terminator_val_x_2 2.00
_LACS_plot.Line_1_terminator_val_y_2 -0.20
_LACS_plot.Line_2_terminator_val_x_1 -2.00
_LACS_plot.Line_2_terminator_val_y_1 0.11
_LACS_plot.Line_2_terminator_val_x_2 5.83
_LACS_plot.Line_2_terminator_val_y_2 -0.50
_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
43 GLN 4.37 -2.18 0
10 ALA -0.19 0.01 1
11 VAL -0.28 -0.04 1
12 ALA -0.32 -0.03 1
14 GLU -0.64 -0.19 1
15 ARG 0.29 -0.28 1
17 ARG -4.64 0.16 1
19 ALA 2.42 -0.38 1
20 TYR 1.81 -0.06 1
22 SER 4.63 -0.26 1
23 ALA -1.76 0.10 1
24 GLU 2.63 -0.41 1
25 ALA -4.66 0.02 1
26 SER -1.72 0.31 1
27 LYS -3.17 0.58 1
28 ARG -5.02 0.59 1
30 SER 3.28 -0.30 1
31 ARG 1.27 -0.05 1
33 GLN 4.94 -0.44 1
34 ASN -1.80 0.31 1
35 GLU -5.18 0.17 1
36 TRP -3.38 0.30 1
37 TYR -6.39 1.52 1
40 ARG 3.76 -0.33 1
41 GLU 5.83 -0.46 1
44 VAL 5.29 -0.48 1
45 LYS 4.84 -0.37 1
46 HIS -3.01 0.08 1
47 TRP 2.85 0.01 1
48 GLU 3.88 -0.57 1
49 LYS 0.89 -0.10 1
50 HIS 2.29 -0.62 1
52 LYS 2.62 -0.37 1
53 THR -0.45 -0.01 1
55 VAL -0.87 0.06 1
56 LEU 0.94 -0.30 1
57 ALA 0.09 0.00 1
58 ALA 0.05 -0.03 1
59 GLN 0.27 -0.02 1
61 ASP 0.31 -0.07 1
62 ARG 0.82 -0.06 1
63 ALA 0.41 -0.05 1
64 LYS 0.33 0.02 1
65 SER -0.38 0.04 1
stop_
save_
save_LACS_CACB_CO_output
_LACS_plot.Sf_category LACS_output
_LACS.plot.Input_file_name bmr11323_21.str
_LACS_plot.X_coord_name CA-CB
_LACS_plot.Y_coord_name CO
_LACS_plot.Line_1_terminator_val_x_1 -6.39
_LACS_plot.Line_1_terminator_val_y_1 -2.89
_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 -1.08
_LACS_plot.Line_2_terminator_val_x_2 5.83
_LACS_plot.Line_2_terminator_val_y_2 2.29
_LACS_plot.Y_axis_chem_shift_offset 0.21
loop_
_LACS.Comp_index_ID
_LACS.Comp_ID
_LACS.X_coord_val
_LACS.Y_coord_val
_LACS.Designator
37 TYR -6.39 0.22 0
22 SER 4.63 -2.06 0
10 ALA -0.19 -0.33 1
11 VAL -0.28 -0.64 1
12 ALA -0.32 -0.40 1
14 GLU -0.64 -0.27 1
15 ARG 0.29 -0.80 1
17 ARG -4.64 -1.54 1
19 ALA 2.42 -0.70 1
20 TYR 1.81 0.79 1
23 ALA -1.76 -0.85 1
24 GLU 2.63 -0.57 1
25 ALA -4.66 -1.55 1
26 SER -1.72 -0.82 1
27 LYS -3.17 -2.40 1
28 ARG -5.02 1.11 1
30 SER 3.28 -0.14 1
31 ARG 1.27 0.45 1
33 GLN 4.94 0.10 1
34 ASN -1.80 -1.05 1
35 GLU -5.18 -3.32 1
36 TRP -3.38 -2.08 1
40 ARG 3.76 0.87 1
41 GLU 5.83 2.55 1
43 GLN 4.37 3.05 1
44 VAL 5.29 3.66 1
45 LYS 4.84 1.84 1
46 HIS -3.01 2.27 1
47 TRP 2.85 1.26 1
48 GLU 3.88 0.80 1
49 LYS 0.89 1.82 1
50 HIS 2.29 2.29 1
52 LYS 2.62 1.14 1
53 THR -0.45 -0.98 1
55 VAL -0.87 -0.83 1
56 LEU 0.94 -0.44 1
57 ALA 0.09 -0.16 1
58 ALA 0.05 0.02 1
59 GLN 0.27 0.76 1
61 ASP 0.31 0.46 1
62 ARG 0.82 0.17 1
63 ALA 0.41 0.19 1
64 LYS 0.33 0.10 1
65 SER -0.38 -0.07 1
68 SER -0.16 2.89 1
stop_
save_