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 bmr17036_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.53 _LACS_plot.Line_1_terminator_val_y_1 -4.30 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.00 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.56 _LACS_plot.Line_2_terminator_val_x_2 5.94 _LACS_plot.Line_2_terminator_val_y_2 4.34 _LACS_plot.Y_axis_chem_shift_offset 0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 65 PHE -8.53 -1.36 0 66 HIS 1.17 5.00 0 11 MET 0.19 -0.05 1 12 VAL -0.05 -0.49 1 13 ALA -0.73 -0.70 1 14 ASN -0.19 0.16 1 17 ALA -2.87 -1.58 1 18 SER -2.04 -1.59 1 19 LYS 4.38 3.24 1 20 GLU 4.88 3.40 1 21 SER 4.52 3.30 1 22 ILE 3.81 3.51 1 23 ASP 3.78 2.56 1 24 ALA -0.07 -0.42 1 25 LEU 2.63 0.78 1 27 GLU -0.99 -0.89 1 28 ILE -1.69 -0.99 1 29 LEU 0.56 -0.59 1 30 VAL 3.55 1.24 1 31 THR -0.40 -0.50 1 32 GLU -2.03 -0.80 1 33 ASP 0.40 0.30 1 34 HIS 1.73 1.03 1 36 ALA -1.40 -0.62 1 37 VAL -0.09 -1.28 1 39 GLN 1.66 0.64 1 40 GLU -1.78 -1.05 1 41 MET 0.00 0.34 1 45 ILE 2.62 2.87 1 48 SER -1.75 -0.63 1 49 GLU -0.68 -0.37 1 50 TYR 0.96 0.69 1 51 VAL -5.43 -3.24 1 52 LYS 3.19 2.10 1 54 ASP -0.31 0.97 1 55 VAL 0.51 -0.36 1 56 ALA -4.99 -2.62 1 57 THR -0.59 -1.22 1 58 GLU -7.07 -3.35 1 59 LEU 0.26 0.61 1 62 HIS 5.59 1.05 1 63 HIS 0.96 3.59 1 64 TYR -3.64 -1.14 1 67 LYS 2.57 1.05 1 70 VAL 5.18 3.98 1 71 SER 3.75 2.74 1 72 ILE 4.22 3.21 1 73 TRP 0.88 1.07 1 74 LEU 1.70 1.51 1 75 GLN 0.94 0.72 1 76 LYS -2.12 -1.59 1 77 SER -6.27 -3.04 1 79 THR 2.42 2.39 1 82 VAL 5.94 1.67 1 84 ARG 0.87 1.56 1 86 MET -4.04 -0.65 1 87 PHE 0.46 1.36 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17036_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.53 _LACS_plot.Line_1_terminator_val_y_1 4.23 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.00 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.44 _LACS_plot.Line_2_terminator_val_x_2 5.94 _LACS_plot.Line_2_terminator_val_y_2 -1.60 _LACS_plot.Y_axis_chem_shift_offset 0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 65 PHE -8.53 7.17 0 66 HIS 1.17 3.83 0 11 MET 0.19 -0.24 1 12 VAL -0.05 -0.44 1 13 ALA -0.73 0.03 1 14 ASN -0.19 0.35 1 17 ALA -2.87 1.29 1 18 SER -2.04 0.45 1 19 LYS 4.38 -1.14 1 20 GLU 4.88 -1.48 1 21 SER 4.52 -1.22 1 22 ILE 3.81 -0.30 1 23 ASP 3.78 -1.22 1 24 ALA -0.07 -0.35 1 25 LEU 2.63 -1.85 1 27 GLU -0.99 0.10 1 28 ILE -1.69 0.70 1 29 LEU 0.56 -1.15 1 30 VAL 3.55 -2.31 1 31 THR -0.40 -0.10 1 32 GLU -2.03 1.23 1 33 ASP 0.40 -0.10 1 34 HIS 1.73 -0.70 1 36 ALA -1.40 0.78 1 37 VAL -0.09 -1.19 1 39 GLN 1.66 -1.02 1 40 GLU -1.78 0.73 1 41 MET 0.00 0.34 1 45 ILE 2.62 0.25 1 48 SER -1.75 1.12 1 49 GLU -0.68 0.31 1 50 TYR 0.96 -0.27 1 51 VAL -5.43 2.19 1 52 LYS 3.19 -1.09 1 54 ASP -0.31 1.28 1 55 VAL 0.51 -0.87 1 56 ALA -4.99 2.37 1 57 THR -0.59 -0.63 1 58 GLU -7.07 3.72 1 59 LEU 0.26 0.35 1 62 HIS 5.59 -4.54 1 63 HIS 0.96 2.63 1 64 TYR -3.64 2.50 1 67 LYS 2.57 -1.52 1 70 VAL 5.18 -1.20 1 71 SER 3.75 -1.01 1 72 ILE 4.22 -1.01 1 73 TRP 0.88 0.19 1 74 LEU 1.70 -0.19 1 75 GLN 0.94 -0.22 1 76 LYS -2.12 0.53 1 77 SER -6.27 3.23 1 79 THR 2.42 -0.03 1 82 VAL 5.94 -4.27 1 84 ARG 0.87 0.69 1 86 MET -4.04 3.39 1 87 PHE 0.46 0.90 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17036_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.53 _LACS_plot.Line_1_terminator_val_y_1 0.62 _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 0.13 _LACS_plot.Line_2_terminator_val_x_2 5.94 _LACS_plot.Line_2_terminator_val_y_2 -0.53 _LACS_plot.Y_axis_chem_shift_offset 0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 56 ALA -4.99 1.09 0 86 MET -4.04 -0.54 0 11 MET 0.19 -0.09 1 12 VAL -0.05 -0.08 1 13 ALA -0.73 -0.04 1 14 ASN -0.19 -0.10 1 17 ALA -2.87 0.15 1 18 SER -2.04 -0.21 1 19 LYS 4.38 -0.46 1 20 GLU 4.88 -0.33 1 21 SER 4.52 -0.34 1 22 ILE 3.81 -0.53 1 23 ASP 3.78 -0.32 1 24 ALA -0.07 -0.05 1 25 LEU 2.63 -0.34 1 27 GLU -0.99 0.26 1 28 ILE -1.69 -0.05 1 29 LEU 0.56 0.28 1 30 VAL 3.55 -0.30 1 31 THR -0.40 0.12 1 32 GLU -2.03 0.03 1 33 ASP 0.40 -0.15 1 34 HIS 1.73 -0.27 1 36 ALA -1.40 0.06 1 37 VAL -0.09 -0.49 1 39 GLN 1.66 -0.37 1 40 GLU -1.78 0.08 1 41 MET 0.00 0.16 1 45 ILE 2.62 -0.24 1 48 SER -1.75 0.25 1 49 GLU -0.68 0.07 1 50 TYR 0.96 0.21 1 51 VAL -5.43 0.45 1 52 LYS 3.19 -0.76 1 54 ASP -0.31 0.03 1 55 VAL 0.51 0.42 1 57 THR -0.59 0.18 1 58 GLU -7.07 0.35 1 59 LEU 0.26 -0.13 1 62 HIS 5.59 -0.31 1 63 HIS 0.96 0.07 1 64 TYR -3.64 0.83 1 65 PHE -8.53 0.50 1 66 HIS 1.17 0.33 1 67 LYS 2.57 -0.25 1 70 VAL 5.18 -0.68 1 71 SER 3.75 -0.48 1 72 ILE 4.22 -0.50 1 73 TRP 0.88 0.32 1 74 LEU 1.70 -0.24 1 75 GLN 0.94 -0.06 1 76 LYS -2.12 -0.33 1 77 SER -6.27 0.56 1 79 THR 2.42 -0.41 1 82 VAL 5.94 -0.19 1 84 ARG 0.87 -0.15 1 87 PHE 0.46 -0.26 1 stop_ save_