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 bmr6950_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -3.07 _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 0.68 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.25 _LACS_plot.Line_2_terminator_val_x_2 9.91 _LACS_plot.Line_2_terminator_val_y_2 7.13 _LACS_plot.Y_axis_chem_shift_offset -0.07 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 79 SER -0.07 3.57 0 10 GLU 0.19 -0.31 1 11 ALA -1.01 -0.66 1 12 GLU -0.69 -0.28 1 13 PHE -1.81 -0.43 1 14 GLU -3.07 -0.04 1 15 GLU 2.64 0.94 1 17 ARG 2.67 2.69 1 18 VAL 5.24 3.82 1 19 ILE 5.10 4.43 1 20 ASP 3.91 3.30 1 21 LEU 2.40 2.88 1 22 TRP 0.18 0.87 1 23 ASP 4.09 3.45 1 24 LEU 2.89 2.41 1 25 ALA 3.93 2.33 1 26 GLN 2.17 2.06 1 27 SER -0.17 -0.32 1 28 ALA -0.80 -0.89 1 29 ASN 2.43 0.23 1 30 LEU -1.81 -1.12 1 31 THR -1.79 -0.78 1 32 ASP 5.50 3.72 1 33 LYS 3.78 2.47 1 34 GLU 1.75 1.96 1 35 LEU 3.46 2.73 1 36 GLU 3.50 2.13 1 37 ALA 3.82 2.39 1 38 PHE 4.44 4.06 1 39 ARG 5.88 4.05 1 40 GLU 3.58 2.32 1 41 GLU 4.02 2.81 1 42 LEU 3.20 2.23 1 43 LYS 4.02 2.75 1 44 HIS 2.82 3.70 1 45 PHE 2.06 1.46 1 46 GLU 3.67 3.73 1 47 ALA 3.63 2.33 1 48 LYS 3.67 2.87 1 49 ILE 5.44 4.94 1 50 GLU 3.25 2.64 1 51 LYS 4.70 2.80 1 52 HIS 3.14 5.34 1 53 ASN 4.46 2.75 1 54 HIS 3.61 4.63 1 55 TYR 6.64 4.32 1 56 GLN 5.09 3.89 1 57 LYS 4.81 2.37 1 58 GLN 3.79 2.32 1 59 LEU 3.90 3.10 1 60 GLU 3.72 2.57 1 61 ILE 4.12 3.49 1 62 ALA 3.72 2.62 1 63 HIS 3.49 4.40 1 64 GLU 4.11 2.57 1 65 LYS 4.69 2.96 1 66 LEU 3.82 2.87 1 67 ARG 4.60 2.45 1 68 HIS 3.28 4.39 1 69 ALA 4.25 2.64 1 70 GLU 2.50 2.24 1 71 SER 3.44 2.38 1 72 VAL 1.16 0.26 1 74 ASP 1.30 -0.97 1 76 GLU 2.64 2.21 1 77 ARG 2.96 2.53 1 78 VAL 5.95 4.83 1 80 ARG 2.94 2.67 1 81 SER 4.63 3.78 1 82 ARG 4.70 3.87 1 83 GLU 3.43 2.39 1 84 LYS 4.62 2.94 1 85 HIS 4.52 6.29 1 86 ALA 3.49 2.43 1 87 LEU 3.12 2.64 1 88 LEU 2.17 2.39 1 89 GLU 4.25 3.50 1 91 ARG 3.85 2.08 1 92 THR 8.23 6.35 1 93 LYS 4.88 2.98 1 94 GLU 3.69 2.48 1 95 LEU 3.13 2.18 1 97 TYR 4.06 2.44 1 98 THR 9.91 6.58 1 99 VAL 6.42 5.23 1 100 LYS 4.37 3.47 1 101 LYS 3.75 2.41 1 102 HIS 1.57 3.45 1 103 LEU 4.07 3.12 1 104 GLN 3.31 3.04 1 105 ASP 2.71 3.07 1 106 LEU 3.14 3.12 1 107 SER 5.13 3.89 1 109 ARG 5.12 4.11 1 110 ILE 2.72 1.36 1 111 SER 3.26 2.26 1 112 ARG 3.04 1.53 1 113 ALA 0.94 0.52 1 114 ARG 1.30 0.39 1 115 HIS -0.02 1.10 1 116 ASN 0.18 0.11 1 117 GLU -0.22 -0.50 1 118 LEU 1.63 1.63 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6950_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -3.07 _LACS_plot.Line_1_terminator_val_y_1 2.01 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.32 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.75 _LACS_plot.Line_2_terminator_val_x_2 9.91 _LACS_plot.Line_2_terminator_val_y_2 -2.78 _LACS_plot.Y_axis_chem_shift_offset -0.07 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 79 SER -0.07 3.64 0 10 GLU 0.19 -0.50 1 11 ALA -1.01 0.35 1 12 GLU -0.69 0.41 1 13 PHE -1.81 1.38 1 14 GLU -3.07 3.03 1 15 GLU 2.64 -1.70 1 17 ARG 2.67 0.02 1 18 VAL 5.24 -1.42 1 19 ILE 5.10 -0.67 1 20 ASP 3.91 -0.61 1 21 LEU 2.40 0.48 1 22 TRP 0.18 0.69 1 23 ASP 4.09 -0.64 1 24 LEU 2.89 -0.48 1 25 ALA 3.93 -1.60 1 26 GLN 2.17 -0.11 1 27 SER -0.17 -0.15 1 28 ALA -0.80 -0.09 1 29 ASN 2.43 -2.20 1 30 LEU -1.81 0.69 1 31 THR -1.79 1.01 1 32 ASP 5.50 -1.78 1 33 LYS 3.78 -1.31 1 34 GLU 1.75 0.21 1 35 LEU 3.46 -0.73 1 36 GLU 3.50 -1.37 1 37 ALA 3.82 -1.43 1 38 PHE 4.44 -0.38 1 39 ARG 5.88 -1.83 1 40 GLU 3.58 -1.26 1 41 GLU 4.02 -1.21 1 42 LEU 3.20 -0.97 1 43 LYS 4.02 -1.27 1 44 HIS 2.82 0.88 1 45 PHE 2.06 -0.60 1 46 GLU 3.67 0.06 1 47 ALA 3.63 -1.30 1 48 LYS 3.67 -0.80 1 49 ILE 5.44 -0.50 1 50 GLU 3.25 -0.61 1 51 LYS 4.70 -1.90 1 52 HIS 3.14 2.20 1 53 ASN 4.46 -1.71 1 54 HIS 3.61 1.02 1 55 TYR 6.64 -2.32 1 56 GLN 5.09 -1.20 1 57 LYS 4.81 -2.44 1 58 GLN 3.79 -1.47 1 59 LEU 3.90 -0.80 1 60 GLU 3.72 -1.15 1 61 ILE 4.12 -0.63 1 62 ALA 3.72 -1.10 1 63 HIS 3.49 0.91 1 64 GLU 4.11 -1.54 1 65 LYS 4.69 -1.73 1 66 LEU 3.82 -0.95 1 67 ARG 4.60 -2.15 1 68 HIS 3.28 1.11 1 69 ALA 4.25 -1.61 1 70 GLU 2.50 -0.26 1 71 SER 3.44 -1.06 1 72 VAL 1.16 -0.90 1 74 ASP 1.30 -2.27 1 76 GLU 2.64 -0.43 1 77 ARG 2.96 -0.43 1 78 VAL 5.95 -1.12 1 80 ARG 2.94 -0.27 1 81 SER 4.63 -0.85 1 82 ARG 4.70 -0.83 1 83 GLU 3.43 -1.04 1 84 LYS 4.62 -1.68 1 85 HIS 4.52 1.77 1 86 ALA 3.49 -1.06 1 87 LEU 3.12 -0.48 1 88 LEU 2.17 0.22 1 89 GLU 4.25 -0.75 1 91 ARG 3.85 -1.77 1 92 THR 8.23 -1.88 1 93 LYS 4.88 -1.90 1 94 GLU 3.69 -1.21 1 95 LEU 3.13 -0.95 1 97 TYR 4.06 -1.62 1 98 THR 9.91 -3.33 1 99 VAL 6.42 -1.19 1 100 LYS 4.37 -0.90 1 101 LYS 3.75 -1.34 1 102 HIS 1.57 1.88 1 103 LEU 4.07 -0.95 1 104 GLN 3.31 -0.27 1 105 ASP 2.71 0.36 1 106 LEU 3.14 -0.02 1 107 SER 5.13 -1.24 1 109 ARG 5.12 -1.01 1 110 ILE 2.72 -1.36 1 111 SER 3.26 -1.00 1 112 ARG 3.04 -1.51 1 113 ALA 0.94 -0.42 1 114 ARG 1.30 -0.91 1 115 HIS -0.02 1.12 1 116 ASN 0.18 -0.07 1 117 GLU -0.22 -0.28 1 118 LEU 1.63 0.00 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6950_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -3.07 _LACS_plot.Line_1_terminator_val_y_1 0.14 _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 0.06 _LACS_plot.Line_2_terminator_val_x_2 9.91 _LACS_plot.Line_2_terminator_val_y_2 -0.72 _LACS_plot.Y_axis_chem_shift_offset 0.07 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 98 THR 9.91 0.09 0 10 GLU 0.19 -0.13 1 11 ALA -1.01 -0.16 1 12 GLU -0.69 -0.41 1 13 PHE -1.81 0.21 1 14 GLU -3.07 0.15 1 15 GLU 2.64 -0.11 1 17 ARG 2.67 -0.11 1 18 VAL 5.24 -0.60 1 19 ILE 5.10 -0.65 1 20 ASP 3.91 -0.19 1 21 LEU 2.40 -0.24 1 22 TRP 0.18 0.13 1 23 ASP 4.09 -0.43 1 24 LEU 2.89 -0.40 1 25 ALA 3.93 -0.75 1 26 GLN 2.17 -0.71 1 27 SER -0.17 0.11 1 28 ALA -0.80 0.00 1 29 ASN 2.43 -0.26 1 30 LEU -1.81 0.22 1 31 THR -1.79 0.07 1 32 ASP 5.50 -0.26 1 33 LYS 3.78 -0.21 1 34 GLU 1.75 -0.31 1 35 LEU 3.46 -0.10 1 36 GLU 3.50 -0.09 1 37 ALA 3.82 -0.04 1 38 PHE 4.44 -0.28 1 39 ARG 5.88 -0.78 1 40 GLU 3.58 -0.39 1 41 GLU 4.02 -0.23 1 42 LEU 3.20 -0.40 1 43 LYS 4.02 -0.14 1 44 HIS 2.82 -0.22 1 45 PHE 2.06 -0.14 1 46 GLU 3.67 -0.89 1 47 ALA 3.63 -0.06 1 48 LYS 3.67 -0.23 1 49 ILE 5.44 -0.05 1 50 GLU 3.25 -0.27 1 51 LYS 4.70 -0.16 1 52 HIS 3.14 -0.46 1 53 ASN 4.46 -0.46 1 54 HIS 3.61 -0.36 1 55 TYR 6.64 -0.59 1 56 GLN 5.09 -0.41 1 57 LYS 4.81 -0.19 1 58 GLN 3.79 -0.41 1 59 LEU 3.90 -0.45 1 60 GLU 3.72 -0.22 1 61 ILE 4.12 -0.34 1 62 ALA 3.72 -0.23 1 63 HIS 3.49 -0.66 1 64 GLU 4.11 -0.38 1 65 LYS 4.69 -0.27 1 66 LEU 3.82 -0.17 1 67 ARG 4.60 -0.36 1 68 HIS 3.28 -0.64 1 69 ALA 4.25 -0.36 1 70 GLU 2.50 -0.51 1 71 SER 3.44 -0.23 1 72 VAL 1.16 0.04 1 74 ASP 1.30 0.01 1 76 GLU 2.64 -0.17 1 77 ARG 2.96 -0.26 1 78 VAL 5.95 -0.70 1 79 SER -0.07 -0.72 1 80 ARG 2.94 -0.07 1 81 SER 4.63 -0.17 1 82 ARG 4.70 -0.30 1 83 GLU 3.43 -0.17 1 84 LYS 4.62 -0.17 1 85 HIS 4.52 -0.82 1 86 ALA 3.49 -0.22 1 87 LEU 3.12 -0.19 1 88 LEU 2.17 -0.32 1 89 GLU 4.25 -0.60 1 91 ARG 3.85 -0.20 1 92 THR 8.23 -0.56 1 93 LYS 4.88 -0.33 1 94 GLU 3.69 -0.21 1 95 LEU 3.13 -0.15 1 97 TYR 4.06 -0.16 1 99 VAL 6.42 -0.43 1 100 LYS 4.37 -0.36 1 101 LYS 3.75 -0.34 1 102 HIS 1.57 -0.35 1 103 LEU 4.07 -0.79 1 104 GLN 3.31 -0.37 1 105 ASP 2.71 -0.26 1 106 LEU 3.14 -0.40 1 107 SER 5.13 -0.49 1 109 ARG 5.12 -0.77 1 110 ILE 2.72 -0.47 1 111 SER 3.26 -0.30 1 112 ARG 3.04 -0.16 1 113 ALA 0.94 -0.08 1 114 ARG 1.30 -0.11 1 115 HIS -0.02 -0.12 1 116 ASN 0.18 -0.53 1 117 GLU -0.22 -0.12 1 118 LEU 1.63 -0.20 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6950_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -3.07 _LACS_plot.Line_1_terminator_val_y_1 -0.80 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.48 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.14 _LACS_plot.Line_2_terminator_val_x_2 9.91 _LACS_plot.Line_2_terminator_val_y_2 4.23 _LACS_plot.Y_axis_chem_shift_offset -0.70 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 98 THR 9.91 2.05 0 10 GLU 0.19 -0.74 1 11 ALA -1.01 -0.72 1 12 GLU -0.69 -0.86 1 13 PHE -1.81 -1.19 1 14 GLU -3.07 -0.25 1 17 ARG 2.67 2.78 1 18 VAL 5.24 0.76 1 19 ILE 5.10 1.89 1 20 ASP 3.91 2.61 1 21 LEU 2.40 0.68 1 22 TRP 0.18 2.31 1 23 ASP 4.09 3.67 1 24 LEU 2.89 2.44 1 25 ALA 3.93 1.31 1 26 GLN 2.17 0.99 1 27 SER -0.17 -0.78 1 28 ALA -0.80 -2.32 1 29 ASN 2.43 -0.61 1 30 LEU -1.81 0.88 1 31 THR -1.79 0.32 1 32 ASP 5.50 2.90 1 33 LYS 3.78 3.45 1 34 GLU 1.75 3.38 1 35 LEU 3.46 1.22 1 36 GLU 3.50 2.43 1 37 ALA 3.82 3.23 1 38 PHE 4.44 1.40 1 39 ARG 5.88 2.10 1 40 GLU 3.58 2.55 1 41 GLU 4.02 3.65 1 42 LEU 3.20 -0.50 1 43 LYS 4.02 3.59 1 44 HIS 2.82 4.31 1 45 PHE 2.06 1.06 1 46 GLU 3.67 1.46 1 47 ALA 3.63 3.15 1 48 LYS 3.67 2.13 1 49 ILE 5.44 1.62 1 50 GLU 3.25 2.92 1 51 LYS 4.70 1.59 1 52 HIS 3.14 3.20 1 53 ASN 4.46 2.98 1 54 HIS 3.61 4.23 1 55 TYR 6.64 1.82 1 56 GLN 5.09 2.97 1 57 LYS 4.81 2.79 1 58 GLN 3.79 3.21 1 59 LEU 3.90 0.21 1 60 GLU 3.72 3.41 1 61 ILE 4.12 2.03 1 62 ALA 3.72 3.10 1 63 HIS 3.49 4.71 1 64 GLU 4.11 2.91 1 65 LYS 4.69 3.08 1 66 LEU 3.82 -0.20 1 67 ARG 4.60 3.78 1 68 HIS 3.28 3.75 1 69 ALA 4.25 2.12 1 70 GLU 2.50 2.52 1 71 SER 3.44 1.17 1 72 VAL 1.16 1.26 1 74 ASP 1.30 0.14 1 76 GLU 2.64 1.95 1 77 ARG 2.96 3.90 1 78 VAL 5.95 0.89 1 79 SER -0.07 2.78 1 80 ARG 2.94 3.18 1 81 SER 4.63 2.75 1 82 ARG 4.70 2.28 1 83 GLU 3.43 2.44 1 84 LYS 4.62 2.22 1 85 HIS 4.52 1.74 1 86 ALA 3.49 3.73 1 87 LEU 3.12 2.70 1 88 LEU 2.17 2.25 1 89 GLU 4.25 2.36 1 91 ARG 3.85 2.64 1 92 THR 8.23 2.04 1 93 LYS 4.88 2.82 1 94 GLU 3.69 2.99 1 95 LEU 3.13 1.43 1 97 TYR 4.06 2.23 1 99 VAL 6.42 0.75 1 100 LYS 4.37 2.32 1 101 LYS 3.75 2.60 1 102 HIS 1.57 3.39 1 103 LEU 4.07 1.82 1 104 GLN 3.31 2.94 1 105 ASP 2.71 2.68 1 106 LEU 3.14 1.20 1 107 SER 5.13 3.08 1 109 ARG 5.12 2.72 1 110 ILE 2.72 0.47 1 111 SER 3.26 1.64 1 112 ARG 3.04 0.71 1 113 ALA 0.94 0.15 1 114 ARG 1.30 0.01 1 115 HIS -0.02 0.59 1 116 ASN 0.18 -0.48 1 117 GLU -0.22 -1.26 1 stop_ save_