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 bmr7072_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.47 _LACS_plot.Line_1_terminator_val_y_1 -3.58 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.45 _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 6.47 _LACS_plot.Line_2_terminator_val_y_2 4.93 _LACS_plot.Y_axis_chem_shift_offset -0.49 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 65 HIS 6.47 8.13 0 29 ILE 2.41 -1.88 0 10 GLU -1.67 -0.68 1 11 ASP 4.53 3.81 1 12 HIS -0.01 1.37 1 13 GLU -4.40 -1.48 1 15 LEU 0.66 2.14 1 17 ILE -5.60 -2.12 1 18 SER -1.60 -0.81 1 19 ILE -6.41 -2.26 1 20 THR -3.50 -2.38 1 23 LYS 3.01 3.30 1 24 GLU 4.31 2.56 1 25 HIS -3.09 0.53 1 27 VAL -2.66 -0.84 1 30 LEU -5.63 -2.16 1 31 ILE 3.82 2.25 1 32 SER -0.92 0.21 1 33 GLU -4.99 0.05 1 34 ILE -1.65 -1.85 1 35 HIS -0.98 0.67 1 38 GLN 3.52 1.98 1 40 ALA 2.65 2.76 1 41 ASP 0.64 2.66 1 42 ARG 3.64 3.54 1 46 LEU -5.20 -2.26 1 47 HIS -4.67 -1.03 1 48 VAL 4.77 3.19 1 50 ASP 0.50 1.37 1 51 ALA -3.97 -2.71 1 52 ILE 0.77 0.17 1 53 LEU 1.40 0.77 1 54 ALA -4.22 -0.53 1 55 VAL -5.18 -3.62 1 56 ASN 2.09 0.56 1 58 VAL 2.34 0.64 1 59 ASN 1.02 1.26 1 60 LEU -1.96 -0.99 1 61 ARG 3.67 3.19 1 62 ASP -0.69 -0.27 1 63 THR -0.82 0.35 1 64 LYS 0.00 0.73 1 66 LYS 4.42 3.46 1 67 GLU 2.37 2.33 1 68 ALA 3.56 3.12 1 69 VAL 6.28 5.19 1 70 THR 6.28 5.23 1 71 ILE 4.59 4.65 1 72 LEU 5.14 4.12 1 73 SER 3.14 2.85 1 74 GLN 0.31 0.19 1 75 GLN -0.04 -1.14 1 76 ARG -3.68 -0.65 1 78 GLU -0.59 -0.33 1 79 ILE -2.27 -0.19 1 80 GLU -4.03 -1.56 1 81 PHE -3.38 -0.58 1 82 GLU -2.67 -0.70 1 83 VAL -8.47 -3.84 1 84 VAL -5.05 -2.28 1 85 TYR 2.14 1.57 1 86 VAL -1.01 -0.59 1 87 ALA 0.21 0.13 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr7072_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.47 _LACS_plot.Line_1_terminator_val_y_1 4.89 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.55 _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 6.47 _LACS_plot.Line_2_terminator_val_y_2 -1.54 _LACS_plot.Y_axis_chem_shift_offset -0.49 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 65 HIS 6.47 1.66 0 29 ILE 2.41 -4.29 0 10 GLU -1.67 0.99 1 11 ASP 4.53 -0.72 1 12 HIS -0.01 1.38 1 13 GLU -4.40 2.92 1 15 LEU 0.66 1.48 1 17 ILE -5.60 3.48 1 18 SER -1.60 0.79 1 19 ILE -6.41 4.15 1 20 THR -3.50 1.12 1 23 LYS 3.01 0.29 1 24 GLU 4.31 -1.75 1 25 HIS -3.09 3.62 1 27 VAL -2.66 1.82 1 30 LEU -5.63 3.47 1 31 ILE 3.82 -1.57 1 32 SER -0.92 1.13 1 33 GLU -4.99 5.04 1 34 ILE -1.65 -0.20 1 35 HIS -0.98 1.65 1 38 GLN 3.52 -1.54 1 40 ALA 2.65 0.11 1 41 ASP 0.64 2.02 1 42 ARG 3.64 -0.10 1 46 LEU -5.20 2.94 1 47 HIS -4.67 3.64 1 48 VAL 4.77 -1.58 1 50 ASP 0.50 0.87 1 51 ALA -3.97 1.26 1 52 ILE 0.77 -0.60 1 53 LEU 1.40 -0.63 1 54 ALA -4.22 3.69 1 55 VAL -5.18 1.56 1 56 ASN 2.09 -1.53 1 58 VAL 2.34 -1.70 1 59 ASN 1.02 0.24 1 60 LEU -1.96 0.97 1 61 ARG 3.67 -0.48 1 62 ASP -0.69 0.42 1 63 THR -0.82 1.17 1 64 LYS 0.00 0.73 1 66 LYS 4.42 -0.96 1 67 GLU 2.37 -0.04 1 68 ALA 3.56 -0.44 1 69 VAL 6.28 -1.09 1 70 THR 6.28 -1.05 1 71 ILE 4.59 0.06 1 72 LEU 5.14 -1.02 1 73 SER 3.14 -0.29 1 74 GLN 0.31 -0.12 1 75 GLN -0.04 -1.10 1 76 ARG -3.68 3.03 1 78 GLU -0.59 0.26 1 79 ILE -2.27 2.08 1 80 GLU -4.03 2.47 1 81 PHE -3.38 2.80 1 82 GLU -2.67 1.97 1 83 VAL -8.47 4.63 1 84 VAL -5.05 2.77 1 85 TYR 2.14 -0.57 1 86 VAL -1.01 0.42 1 87 ALA 0.21 -0.08 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr7072_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.47 _LACS_plot.Line_1_terminator_val_y_1 1.05 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.02 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.36 _LACS_plot.Line_2_terminator_val_x_2 6.47 _LACS_plot.Line_2_terminator_val_y_2 -0.47 _LACS_plot.Y_axis_chem_shift_offset -0.17 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 19 ILE -6.41 1.64 0 83 VAL -8.47 1.82 0 10 GLU -1.67 0.30 1 11 ASP 4.53 -0.23 1 12 HIS -0.01 0.00 1 13 GLU -4.40 0.24 1 15 LEU 0.66 -0.29 1 17 ILE -5.60 0.99 1 18 SER -1.60 0.63 1 20 THR -3.50 0.42 1 23 LYS 3.01 -0.17 1 24 GLU 4.31 -0.08 1 25 HIS -3.09 0.21 1 27 VAL -2.66 0.55 1 29 ILE 2.41 0.25 1 30 LEU -5.63 0.95 1 31 ILE 3.82 0.14 1 32 SER -0.92 0.22 1 33 GLU -4.99 0.12 1 34 ILE -1.65 0.21 1 35 HIS -0.98 -0.04 1 38 GLN 3.52 0.08 1 40 ALA 2.65 -0.20 1 41 ASP 0.64 -0.29 1 42 ARG 3.64 -0.27 1 46 LEU -5.20 0.23 1 47 HIS -4.67 0.11 1 48 VAL 4.77 -0.55 1 50 ASP 0.50 0.62 1 51 ALA -3.97 1.17 1 52 ILE 0.77 0.24 1 53 LEU 1.40 -0.01 1 54 ALA -4.22 0.84 1 55 VAL -5.18 0.84 1 56 ASN 2.09 -0.07 1 58 VAL 2.34 -0.13 1 59 ASN 1.02 -0.14 1 60 LEU -1.96 0.63 1 61 ARG 3.67 -0.06 1 62 ASP -0.69 0.22 1 63 THR -0.82 0.16 1 64 LYS 0.00 0.50 1 65 HIS 6.47 -0.71 1 66 LYS 4.42 -0.28 1 67 GLU 2.37 -0.16 1 68 ALA 3.56 -0.29 1 69 VAL 6.28 -0.59 1 70 THR 6.28 -0.41 1 71 ILE 4.59 -0.38 1 72 LEU 5.14 -0.38 1 73 SER 3.14 -0.01 1 74 GLN 0.31 0.15 1 75 GLN -0.04 0.10 1 76 ARG -3.68 0.29 1 78 GLU -0.59 0.46 1 79 ILE -2.27 0.28 1 80 GLU -4.03 0.82 1 81 PHE -3.38 0.53 1 82 GLU -2.67 1.08 1 84 VAL -5.05 0.54 1 85 TYR 2.14 0.52 1 86 VAL -1.01 0.22 1 87 ALA 0.21 -0.18 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr7072_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.47 _LACS_plot.Line_1_terminator_val_y_1 -2.02 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.60 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.43 _LACS_plot.Line_2_terminator_val_x_2 6.47 _LACS_plot.Line_2_terminator_val_y_2 2.01 _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 84 VAL -5.05 -3.46 0 71 ILE 4.59 3.86 0 83 VAL -8.47 -2.35 0 10 GLU -1.67 2.80 0 11 ASP 4.53 0.45 1 12 HIS -0.01 0.93 1 13 GLU -4.40 0.01 1 15 LEU 0.66 0.39 1 17 ILE -5.60 -0.94 1 18 SER -1.60 -1.14 1 19 ILE -6.41 -0.41 1 20 THR -3.50 -1.89 1 23 LYS 3.01 2.44 1 24 GLU 4.31 0.18 1 25 HIS -3.09 1.88 1 27 VAL -2.66 0.93 1 29 ILE 2.41 -1.13 1 30 LEU -5.63 -0.28 1 31 ILE 3.82 -0.20 1 32 SER -0.92 0.30 1 33 GLU -4.99 -2.61 1 34 ILE -1.65 -1.12 1 35 HIS -0.98 1.89 1 38 GLN 3.52 -0.33 1 40 ALA 2.65 1.38 1 41 ASP 0.64 2.10 1 42 ARG 3.64 2.46 1 46 LEU -5.20 -3.01 1 47 HIS -4.67 0.57 1 48 VAL 4.77 1.30 1 50 ASP 0.50 -0.71 1 51 ALA -3.97 -0.19 1 52 ILE 0.77 -1.56 1 53 LEU 1.40 -0.14 1 54 ALA -4.22 -2.20 1 55 VAL -5.18 -2.30 1 56 ASN 2.09 -1.20 1 58 VAL 2.34 -0.75 1 59 ASN 1.02 0.94 1 60 LEU -1.96 2.07 1 61 ARG 3.67 0.58 1 62 ASP -0.69 -1.04 1 63 THR -0.82 1.55 1 64 LYS 0.00 0.87 1 65 HIS 6.47 3.12 1 66 LYS 4.42 2.98 1 67 GLU 2.37 1.94 1 68 ALA 3.56 1.33 1 69 VAL 6.28 3.04 1 70 THR 6.28 2.12 1 72 LEU 5.14 1.71 1 73 SER 3.14 -0.07 1 74 GLN 0.31 0.37 1 75 GLN -0.04 -0.47 1 76 ARG -3.68 -1.35 1 78 GLU -0.59 -0.52 1 79 ILE -2.27 -2.64 1 80 GLU -4.03 -0.74 1 81 PHE -3.38 -0.80 1 82 GLU -2.67 -0.53 1 85 TYR 2.14 -0.19 1 87 ALA 0.21 -1.14 1 stop_ save_