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 bmr10272_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.56 _LACS_plot.Line_1_terminator_val_y_1 -3.63 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.23 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.13 _LACS_plot.Line_2_terminator_val_x_2 5.72 _LACS_plot.Line_2_terminator_val_y_2 4.02 _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 27 PHE -0.12 -1.84 0 57 SER 5.72 2.57 0 22 ASP 3.79 3.55 0 11 TYR -5.76 -0.80 0 10 SER -0.20 0.10 1 12 MET -3.48 -3.18 1 13 THR -1.60 -1.80 1 15 SER -3.76 -1.44 1 16 ALA -1.03 -0.41 1 17 TYR -3.47 -0.10 1 18 GLN -3.47 -2.93 1 19 LYS 0.02 0.29 1 20 VAL 0.37 0.32 1 21 GLN -3.03 -1.41 1 23 SER 1.11 0.30 1 24 GLU -3.92 -0.97 1 25 ILE -6.13 -2.26 1 26 SER -3.11 -1.78 1 29 ALA -0.45 0.17 1 31 VAL -5.21 -3.39 1 32 GLU -2.60 -0.89 1 33 VAL -5.13 -3.43 1 34 GLN -2.73 -1.37 1 35 VAL 1.67 0.83 1 36 LEU 0.16 0.68 1 37 GLU -3.70 -0.36 1 38 LYS -2.49 -0.62 1 39 GLN -2.65 -0.38 1 40 GLU 2.48 1.94 1 41 SER 0.34 0.41 1 43 TRP -0.76 -0.26 1 44 TRP -7.56 -4.20 1 45 TYR 0.15 0.14 1 46 VAL -5.79 -3.19 1 47 ARG -5.09 -1.84 1 48 PHE -4.02 -3.25 1 50 GLU -0.64 -0.52 1 51 LEU -2.80 -1.03 1 52 GLU -6.38 -2.79 1 54 TRP -1.48 0.10 1 55 ALA -5.16 -1.16 1 58 HIS 2.34 1.94 1 59 TYR 3.17 0.96 1 60 LEU -1.87 -1.39 1 61 VAL -1.53 -0.82 1 62 LEU -0.82 -0.29 1 63 ASP -0.82 -0.30 1 64 GLU 0.13 0.44 1 65 ASN 0.38 0.57 1 66 GLU -0.75 -0.17 1 67 GLN -0.26 -0.11 1 69 ASP -0.65 -0.25 1 71 SER 0.99 0.96 1 73 LYS 0.24 0.22 1 74 GLU -0.46 -0.15 1 75 SER 0.06 0.24 1 78 SER -0.11 0.07 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10272_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.56 _LACS_plot.Line_1_terminator_val_y_1 3.93 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.77 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.87 _LACS_plot.Line_2_terminator_val_x_2 5.72 _LACS_plot.Line_2_terminator_val_y_2 -1.70 _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 27 PHE -0.12 -1.72 0 57 SER 5.72 -3.15 0 22 ASP 3.79 -0.24 0 11 TYR -5.76 4.96 0 10 SER -0.20 0.30 1 12 MET -3.48 0.30 1 13 THR -1.60 -0.20 1 15 SER -3.76 2.32 1 16 ALA -1.03 0.62 1 17 TYR -3.47 3.37 1 18 GLN -3.47 0.54 1 19 LYS 0.02 0.27 1 20 VAL 0.37 -0.05 1 21 GLN -3.03 1.62 1 23 SER 1.11 -0.81 1 24 GLU -3.92 2.95 1 25 ILE -6.13 3.87 1 26 SER -3.11 1.33 1 29 ALA -0.45 0.62 1 31 VAL -5.21 1.82 1 32 GLU -2.60 1.71 1 33 VAL -5.13 1.70 1 34 GLN -2.73 1.36 1 35 VAL 1.67 -0.84 1 36 LEU 0.16 0.52 1 37 GLU -3.70 3.34 1 38 LYS -2.49 1.87 1 39 GLN -2.65 2.27 1 40 GLU 2.48 -0.54 1 41 SER 0.34 0.07 1 43 TRP -0.76 0.50 1 44 TRP -7.56 3.36 1 45 TYR 0.15 -0.01 1 46 VAL -5.79 2.60 1 47 ARG -5.09 3.25 1 48 PHE -4.02 0.77 1 50 GLU -0.64 0.12 1 51 LEU -2.80 1.77 1 52 GLU -6.38 3.59 1 54 TRP -1.48 1.58 1 55 ALA -5.16 4.00 1 58 HIS 2.34 -0.40 1 59 TYR 3.17 -2.21 1 60 LEU -1.87 0.48 1 61 VAL -1.53 0.71 1 62 LEU -0.82 0.53 1 63 ASP -0.82 0.52 1 64 GLU 0.13 0.31 1 65 ASN 0.38 0.19 1 66 GLU -0.75 0.58 1 67 GLN -0.26 0.15 1 69 ASP -0.65 0.40 1 71 SER 0.99 -0.03 1 73 LYS 0.24 -0.02 1 74 GLU -0.46 0.31 1 75 SER 0.06 0.18 1 78 SER -0.11 0.18 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10272_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.56 _LACS_plot.Line_1_terminator_val_y_1 0.96 _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 0.26 _LACS_plot.Line_2_terminator_val_x_2 5.72 _LACS_plot.Line_2_terminator_val_y_2 -0.61 _LACS_plot.Y_axis_chem_shift_offset -0.03 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 57 SER 5.72 -1.75 0 10 SER -0.20 0.76 1 11 TYR -5.76 0.24 1 12 MET -3.48 0.98 1 13 THR -1.60 0.52 1 15 SER -3.76 0.11 1 16 ALA -1.03 0.26 1 17 TYR -3.47 -0.17 1 18 GLN -3.47 -0.02 1 19 LYS 0.02 -0.19 1 20 VAL 0.37 0.03 1 21 GLN -3.03 0.24 1 22 ASP 3.79 -0.32 1 23 SER 1.11 0.18 1 24 GLU -3.92 1.22 1 25 ILE -6.13 0.49 1 26 SER -3.11 0.41 1 27 PHE -0.12 0.04 1 29 ALA -0.45 -0.50 1 31 VAL -5.21 0.63 1 32 GLU -2.60 0.74 1 33 VAL -5.13 0.88 1 34 GLN -2.73 0.71 1 35 VAL 1.67 0.02 1 36 LEU 0.16 0.09 1 37 GLU -3.70 0.06 1 38 LYS -2.49 -0.14 1 39 GLN -2.65 0.56 1 40 GLU 2.48 -0.04 1 41 SER 0.34 -0.06 1 43 TRP -0.76 0.28 1 44 TRP -7.56 1.22 1 45 TYR 0.15 -0.38 1 46 VAL -5.79 1.02 1 47 ARG -5.09 0.82 1 48 PHE -4.02 0.68 1 50 GLU -0.64 -0.02 1 51 LEU -2.80 0.29 1 52 GLU -6.38 1.13 1 54 TRP -1.48 0.69 1 55 ALA -5.16 0.36 1 58 HIS 2.34 -0.30 1 59 TYR 3.17 -0.18 1 60 LEU -1.87 0.62 1 61 VAL -1.53 0.19 1 62 LEU -0.82 -0.05 1 63 ASP -0.82 -0.05 1 64 GLU 0.13 -0.13 1 65 ASN 0.38 -0.08 1 66 GLU -0.75 -0.06 1 67 GLN -0.26 -0.07 1 69 ASP -0.65 -0.09 1 71 SER 0.99 -0.11 1 73 LYS 0.24 -0.02 1 74 GLU -0.46 -0.05 1 75 SER 0.06 -0.02 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10272_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.56 _LACS_plot.Line_1_terminator_val_y_1 -2.56 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.27 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.93 _LACS_plot.Line_2_terminator_val_x_2 5.72 _LACS_plot.Line_2_terminator_val_y_2 1.41 _LACS_plot.Y_axis_chem_shift_offset 0.32 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 39 GLN -2.65 1.96 0 13 THR -1.60 2.33 0 57 SER 5.72 0.49 0 59 TYR 3.17 -2.03 0 25 ILE -6.13 -4.88 0 10 SER -0.20 -1.28 1 11 TYR -5.76 -1.79 1 12 MET -3.48 0.74 1 15 SER -3.76 -3.56 1 16 ALA -1.03 -0.90 1 17 TYR -3.47 -2.06 1 18 GLN -3.47 -3.01 1 19 LYS 0.02 -0.60 1 20 VAL 0.37 0.19 1 21 GLN -3.03 1.02 1 22 ASP 3.79 0.45 1 23 SER 1.11 0.93 1 24 GLU -3.92 -2.21 1 26 SER -3.11 -0.55 1 27 PHE -0.12 -1.12 1 29 ALA -0.45 0.27 1 31 VAL -5.21 -2.66 1 32 GLU -2.60 0.12 1 33 VAL -5.13 -1.90 1 34 GLN -2.73 -0.25 1 35 VAL 1.67 -0.70 1 36 LEU 0.16 -0.30 1 37 GLU -3.70 -2.47 1 38 LYS -2.49 -0.72 1 40 GLU 2.48 0.18 1 41 SER 0.34 0.83 1 43 TRP -0.76 -1.45 1 44 TRP -7.56 -2.40 1 45 TYR 0.15 -0.81 1 46 VAL -5.79 -3.92 1 47 ARG -5.09 -1.24 1 48 PHE -4.02 -0.67 1 50 GLU -0.64 -0.60 1 51 LEU -2.80 -2.55 1 52 GLU -6.38 -0.54 1 54 TRP -1.48 -0.23 1 55 ALA -5.16 -2.26 1 58 HIS 2.34 1.66 1 60 LEU -1.87 -1.94 1 61 VAL -1.53 -1.50 1 62 LEU -0.82 -0.62 1 63 ASP -0.82 -0.03 1 64 GLU 0.13 -0.10 1 65 ASN 0.38 0.02 1 66 GLU -0.75 -0.55 1 67 GLN -0.26 -0.56 1 71 SER 0.99 0.84 1 73 LYS 0.24 0.19 1 74 GLU -0.46 0.05 1 75 SER 0.06 -0.06 1 78 SER -0.11 0.14 1 stop_ save_