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 bmr18429_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -1.36 _LACS_plot.Line_1_terminator_val_y_1 -0.30 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.57 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.50 _LACS_plot.Line_2_terminator_val_x_2 5.96 _LACS_plot.Line_2_terminator_val_y_2 4.53 _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 55 ARG 2.74 3.96 0 97 HIS 0.70 2.45 0 67 ASN 1.56 3.24 0 10 GLU 3.29 2.68 1 11 LYS 3.67 2.57 1 12 LEU 3.45 2.63 1 13 GLU 4.02 3.52 1 14 LYS 3.64 2.67 1 15 ILE 4.39 3.79 1 16 LEU 4.50 2.74 1 17 ASP 3.92 3.09 1 18 GLU 3.36 2.66 1 19 VAL 3.79 2.70 1 20 THR 5.11 3.90 1 21 ASP 2.40 2.17 1 23 ALA 0.45 -0.15 1 25 ASP 4.44 3.86 1 26 GLU 3.97 2.62 1 27 ALA -0.42 0.38 1 28 ARG 5.96 4.60 1 29 GLU 3.67 3.01 1 30 ARG 3.87 2.83 1 31 ILE 4.43 2.72 1 32 GLU 3.46 2.96 1 33 LYS 4.26 3.21 1 34 LEU 3.01 2.41 1 35 ALA 3.43 2.52 1 36 LYS 4.05 3.00 1 37 ASP 4.10 2.98 1 38 VAL 5.13 3.47 1 39 LYS 4.52 3.51 1 40 ASP 2.91 2.22 1 41 GLU 0.95 0.78 1 42 LEU 1.86 1.61 1 43 GLU 2.53 2.20 1 44 GLU -1.36 -0.15 1 46 ASP -0.69 -0.58 1 47 ALA 1.56 1.44 1 48 LYS 4.85 3.91 1 49 ASN 3.41 2.88 1 50 MET 2.41 1.80 1 51 ILE 5.78 4.26 1 52 GLU 4.18 3.53 1 53 LYS 3.84 2.89 1 54 PHE 4.03 3.84 1 56 ASP 4.64 3.36 1 57 GLU 2.81 2.29 1 58 MET 4.22 3.17 1 59 GLU 3.86 3.14 1 60 GLN 3.83 2.55 1 61 MET 4.16 3.57 1 62 TYR 2.76 2.35 1 63 LYS 3.68 2.60 1 64 ASP 1.34 1.44 1 65 ALA -0.45 -0.28 1 68 ALA 2.72 2.46 1 69 VAL 5.29 3.71 1 70 MET 2.11 1.14 1 71 GLU 3.41 3.20 1 72 GLN 4.11 2.82 1 73 LEU 3.97 2.95 1 74 LEU 4.00 2.67 1 75 GLU 3.69 2.66 1 76 GLU 3.05 2.51 1 77 ILE 5.10 3.45 1 78 GLU 3.80 2.89 1 79 LYS 4.21 3.54 1 80 LEU 3.57 2.85 1 81 LEU 3.46 2.68 1 82 LYS 3.56 2.67 1 83 LYS 2.04 1.13 1 84 ALA 2.34 1.42 1 86 SER 0.39 0.34 1 87 LEU 0.37 -0.11 1 88 VAL 0.18 -0.04 1 90 ARG 0.68 0.33 1 92 SER 0.19 0.01 1 93 TYR 0.71 0.20 1 94 LEU 0.08 -0.15 1 95 GLU -0.04 0.11 1 96 HIS -0.56 0.84 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18429_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -1.36 _LACS_plot.Line_1_terminator_val_y_1 1.06 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.43 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.50 _LACS_plot.Line_2_terminator_val_x_2 5.96 _LACS_plot.Line_2_terminator_val_y_2 -1.43 _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 55 ARG 2.74 1.22 0 97 HIS 0.70 1.75 0 67 ASN 1.56 1.68 0 10 GLU 3.29 -0.61 1 11 LYS 3.67 -1.10 1 12 LEU 3.45 -0.82 1 13 GLU 4.02 -0.50 1 14 LYS 3.64 -0.97 1 15 ILE 4.39 -0.60 1 16 LEU 4.50 -1.76 1 17 ASP 3.92 -0.83 1 18 GLU 3.36 -0.70 1 19 VAL 3.79 -1.09 1 20 THR 5.11 -1.21 1 21 ASP 2.40 -0.23 1 23 ALA 0.45 -0.60 1 25 ASP 4.44 -0.58 1 26 GLU 3.97 -1.35 1 27 ALA -0.42 0.80 1 28 ARG 5.96 -1.36 1 29 GLU 3.67 -0.66 1 30 ARG 3.87 -1.04 1 31 ILE 4.43 -1.71 1 32 GLU 3.46 -0.50 1 33 LYS 4.26 -1.05 1 34 LEU 3.01 -0.60 1 35 ALA 3.43 -0.91 1 36 LYS 4.05 -1.05 1 37 ASP 4.10 -1.12 1 38 VAL 5.13 -1.66 1 39 LYS 4.52 -1.01 1 40 ASP 2.91 -0.69 1 41 GLU 0.95 -0.17 1 42 LEU 1.86 -0.25 1 43 GLU 2.53 -0.33 1 44 GLU -1.36 1.21 1 46 ASP -0.69 0.11 1 47 ALA 1.56 -0.12 1 48 LYS 4.85 -0.94 1 49 ASN 3.41 -0.53 1 50 MET 2.41 -0.61 1 51 ILE 5.78 -1.52 1 52 GLU 4.18 -0.65 1 53 LYS 3.84 -0.95 1 54 PHE 4.03 -0.19 1 56 ASP 4.64 -1.28 1 57 GLU 2.81 -0.52 1 58 MET 4.22 -1.05 1 59 GLU 3.86 -0.72 1 60 GLN 3.83 -1.28 1 61 MET 4.16 -0.59 1 62 TYR 2.76 -0.41 1 63 LYS 3.68 -1.08 1 64 ASP 1.34 0.10 1 65 ALA -0.45 0.17 1 68 ALA 2.72 -0.26 1 69 VAL 5.29 -1.58 1 70 MET 2.11 -0.97 1 71 GLU 3.41 -0.21 1 72 GLN 4.11 -1.29 1 73 LEU 3.97 -1.02 1 74 LEU 4.00 -1.33 1 75 GLU 3.69 -1.03 1 76 GLU 3.05 -0.54 1 77 ILE 5.10 -1.65 1 78 GLU 3.80 -0.91 1 79 LYS 4.21 -0.67 1 80 LEU 3.57 -0.72 1 81 LEU 3.46 -0.78 1 82 LYS 3.56 -0.89 1 83 LYS 2.04 -0.91 1 84 ALA 2.34 -0.92 1 86 SER 0.39 -0.05 1 87 LEU 0.37 -0.48 1 88 VAL 0.18 -0.22 1 90 ARG 0.68 -0.35 1 92 SER 0.19 -0.18 1 93 TYR 0.71 -0.51 1 94 LEU 0.08 -0.23 1 95 GLU -0.04 0.15 1 96 HIS -0.56 1.40 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18429_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -1.36 _LACS_plot.Line_1_terminator_val_y_1 0.07 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.19 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.12 _LACS_plot.Line_2_terminator_val_x_2 5.96 _LACS_plot.Line_2_terminator_val_y_2 -0.50 _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 71 GLU 3.41 -0.83 0 10 GLU 3.29 -0.30 1 11 LYS 3.67 -0.24 1 12 LEU 3.45 -0.46 1 13 GLU 4.02 -0.65 1 14 LYS 3.64 -0.19 1 15 ILE 4.39 -0.39 1 16 LEU 4.50 -0.49 1 17 ASP 3.92 -0.30 1 18 GLU 3.36 -0.20 1 19 VAL 3.79 -0.29 1 20 THR 5.11 -0.49 1 21 ASP 2.40 -0.20 1 23 ALA 0.45 -0.11 1 25 ASP 4.44 -0.39 1 26 GLU 3.97 -0.22 1 27 ALA -0.42 0.09 1 28 ARG 5.96 -0.67 1 29 GLU 3.67 -0.31 1 30 ARG 3.87 -0.21 1 31 ILE 4.43 -0.43 1 32 GLU 3.46 -0.41 1 33 LYS 4.26 -0.26 1 34 LEU 3.01 -0.11 1 35 ALA 3.43 -0.55 1 36 LYS 4.05 -0.39 1 37 ASP 4.10 -0.24 1 38 VAL 5.13 -0.50 1 39 LYS 4.52 -0.51 1 40 ASP 2.91 -0.19 1 41 GLU 0.95 -0.12 1 42 LEU 1.86 -0.22 1 43 GLU 2.53 -0.22 1 44 GLU -1.36 0.07 1 46 ASP -0.69 0.05 1 47 ALA 1.56 -0.20 1 48 LYS 4.85 -0.52 1 49 ASN 3.41 -0.23 1 50 MET 2.41 -0.15 1 51 ILE 5.78 -0.48 1 52 GLU 4.18 -0.51 1 53 LYS 3.84 -0.19 1 54 PHE 4.03 -0.52 1 55 ARG 2.74 -0.51 1 56 ASP 4.64 -0.31 1 57 GLU 2.81 -0.30 1 58 MET 4.22 -0.39 1 59 GLU 3.86 -0.40 1 60 GLN 3.83 -0.37 1 61 MET 4.16 -0.40 1 62 TYR 2.76 -0.39 1 63 LYS 3.68 -0.52 1 64 ASP 1.34 -0.15 1 65 ALA -0.45 -0.03 1 67 ASN 1.56 -0.29 1 68 ALA 2.72 -0.03 1 69 VAL 5.29 -0.31 1 70 MET 2.11 -0.07 1 72 GLN 4.11 -0.22 1 73 LEU 3.97 -0.30 1 74 LEU 4.00 -0.39 1 75 GLU 3.69 -0.31 1 76 GLU 3.05 -0.26 1 77 ILE 5.10 -0.35 1 78 GLU 3.80 -0.31 1 79 LYS 4.21 -0.36 1 80 LEU 3.57 -0.29 1 81 LEU 3.46 -0.38 1 82 LYS 3.56 -0.19 1 83 LYS 2.04 -0.08 1 84 ALA 2.34 -0.25 1 86 SER 0.39 0.04 1 87 LEU 0.37 -0.01 1 88 VAL 0.18 -0.05 1 90 ARG 0.68 -0.05 1 92 SER 0.19 -0.06 1 93 TYR 0.71 -0.04 1 94 LEU 0.08 -0.14 1 95 GLU -0.04 -0.23 1 96 HIS -0.56 -0.16 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18429_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -1.36 _LACS_plot.Line_1_terminator_val_y_1 -0.27 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.08 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.53 _LACS_plot.Line_2_terminator_val_x_2 5.96 _LACS_plot.Line_2_terminator_val_y_2 2.67 _LACS_plot.Y_axis_chem_shift_offset -0.28 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 65 ALA -0.45 4.56 0 97 HIS 0.70 5.38 0 10 GLU 3.29 3.00 1 11 LYS 3.67 2.37 1 12 LEU 3.45 0.38 1 13 GLU 4.02 1.33 1 14 LYS 3.64 2.63 1 15 ILE 4.39 1.61 1 16 LEU 4.50 2.13 1 17 ASP 3.92 1.85 1 18 GLU 3.36 3.05 1 19 VAL 3.79 1.20 1 20 THR 5.11 1.19 1 21 ASP 2.40 1.06 1 23 ALA 0.45 -0.98 1 25 ASP 4.44 2.00 1 26 GLU 3.97 0.85 1 27 ALA -0.42 0.26 1 28 ARG 5.96 1.25 1 29 GLU 3.67 2.52 1 30 ARG 3.87 2.95 1 31 ILE 4.43 0.69 1 32 GLU 3.46 2.83 1 33 LYS 4.26 1.56 1 34 LEU 3.01 1.03 1 35 ALA 3.43 1.50 1 36 LYS 4.05 1.62 1 37 ASP 4.10 3.03 1 38 VAL 5.13 0.72 1 39 LYS 4.52 1.97 1 40 ASP 2.91 1.84 1 41 GLU 0.95 1.25 1 42 LEU 1.86 0.68 1 43 GLU 2.53 0.98 1 44 GLU -1.36 0.53 1 46 ASP -0.69 0.08 1 47 ALA 1.56 0.28 1 48 LYS 4.85 0.98 1 49 ASN 3.41 2.55 1 50 MET 2.41 2.38 1 51 ILE 5.78 1.27 1 52 GLU 4.18 1.60 1 53 LYS 3.84 2.56 1 54 PHE 4.03 1.12 1 55 ARG 2.74 2.08 1 56 ASP 4.64 3.10 1 57 GLU 2.81 3.11 1 58 MET 4.22 1.84 1 59 GLU 3.86 2.34 1 60 GLN 3.83 2.05 1 61 MET 4.16 2.24 1 62 TYR 2.76 0.22 1 63 LYS 3.68 1.87 1 64 ASP 1.34 0.16 1 68 ALA 2.72 2.24 1 69 VAL 5.29 2.28 1 70 MET 2.11 1.56 1 71 GLU 3.41 2.35 1 72 GLN 4.11 2.60 1 73 LEU 3.97 1.39 1 74 LEU 4.00 1.49 1 75 GLU 3.69 3.17 1 76 GLU 3.05 3.50 1 77 ILE 5.10 0.82 1 78 GLU 3.80 3.04 1 79 LYS 4.21 3.13 1 80 LEU 3.57 1.34 1 81 LEU 3.46 1.77 1 82 LYS 3.56 2.64 1 83 LYS 2.04 1.63 1 84 ALA 2.34 1.20 1 86 SER 0.39 -0.15 1 87 LEU 0.37 -0.76 1 88 VAL 0.18 -0.53 1 90 ARG 0.68 0.78 1 92 SER 0.19 -0.14 1 93 TYR 0.71 -0.24 1 94 LEU 0.08 -0.56 1 95 GLU -0.04 -0.33 1 96 HIS -0.56 0.00 1 stop_ save_