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 bmr6900_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -5.82 _LACS_plot.Line_1_terminator_val_y_1 -3.21 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.66 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.89 _LACS_plot.Line_2_terminator_val_x_2 8.36 _LACS_plot.Line_2_terminator_val_y_2 6.24 _LACS_plot.Y_axis_chem_shift_offset -0.45 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 126 ILE -5.82 -2.52 0 70 ILE 6.20 1.50 0 11 VAL 0.98 0.63 1 12 ASN 0.99 0.64 1 13 HIS 1.82 2.76 1 14 LEU 1.90 1.52 1 15 VAL 4.49 3.01 1 16 LYS 4.33 3.16 1 17 GLU 3.96 3.17 1 18 ILE 5.04 3.08 1 19 ASP 3.29 3.78 1 20 MET 3.86 3.42 1 21 LEU 4.17 3.83 1 22 LEU 3.33 2.95 1 23 LYS 5.01 4.28 1 24 GLU 3.54 2.36 1 25 TYR 3.74 2.46 1 26 LEU 3.31 2.00 1 27 LEU 1.08 1.45 1 28 SER -0.46 0.94 1 30 ASP 0.14 -0.44 1 31 ILE 4.55 4.35 1 32 SER 4.70 3.38 1 33 GLU 2.36 1.67 1 34 ALA 3.83 3.07 1 35 GLU 3.79 3.74 1 36 HIS 4.70 4.47 1 38 LEU 3.04 2.65 1 39 LYS 5.22 4.00 1 40 GLU 2.15 1.78 1 41 LEU 0.86 1.58 1 42 GLU 2.37 0.40 1 43 VAL -2.29 -2.45 1 45 HIS 1.75 1.97 1 46 PHE -3.27 -2.04 1 47 HIS 3.89 3.49 1 48 HIS 1.68 4.13 1 49 GLU 3.01 1.20 1 50 LEU 5.46 3.47 1 51 VAL 6.09 5.44 1 52 TYR 3.25 3.84 1 53 GLU 3.87 2.56 1 54 ALA 4.40 2.74 1 55 ILE 6.82 4.84 1 56 VAL 8.36 6.23 1 57 MET 5.65 4.45 1 58 VAL 6.73 4.93 1 59 LEU 4.31 2.73 1 60 GLU -0.15 0.28 1 61 SER 0.13 0.87 1 62 THR -0.49 -0.12 1 64 GLU -0.55 0.61 1 65 SER 4.12 3.32 1 66 ALA 5.04 3.42 1 67 PHE 4.08 3.68 1 68 LYS 3.65 3.23 1 69 MET 4.05 4.30 1 71 LEU 5.55 4.69 1 72 ASP 4.75 3.63 1 73 LEU 4.40 3.43 1 74 LEU 4.62 3.45 1 75 LYS 4.85 4.47 1 76 SER 4.45 4.07 1 77 LEU 2.92 2.21 1 78 TRP 2.72 2.61 1 79 LYS 4.27 3.27 1 80 SER -0.22 -0.30 1 81 SER 3.60 1.18 1 82 THR 5.86 4.23 1 83 ILE -2.60 -1.84 1 84 THR -2.86 -1.21 1 85 ILE 4.37 3.88 1 86 ASP 3.15 3.17 1 87 GLN 3.64 2.97 1 88 MET 3.06 3.00 1 89 LYS 4.03 3.75 1 90 ARG 3.58 3.00 1 92 TYR 5.08 4.70 1 93 GLU 4.00 3.56 1 94 ARG 4.26 4.05 1 95 ILE 3.97 0.89 1 96 TYR 2.68 -0.36 1 97 ASN 1.83 2.44 1 98 GLU -1.02 0.41 1 99 ILE 4.22 4.29 1 101 ASP 1.67 1.80 1 102 ILE 3.00 3.14 1 103 ASN 0.59 1.57 1 104 LEU 1.59 1.23 1 105 ASP -0.29 0.86 1 106 VAL 2.15 2.35 1 108 HIS 2.26 1.97 1 109 SER 5.12 4.35 1 110 TYR 6.05 4.76 1 111 SER 4.26 3.28 1 112 VAL 5.80 4.52 1 113 LEU 4.69 3.44 1 114 GLU 4.48 2.93 1 115 ARG 3.66 3.61 1 116 PHE 5.44 5.26 1 117 VAL 6.44 5.38 1 118 GLU 4.22 3.04 1 119 GLU 4.40 3.24 1 121 PHE 3.42 2.80 1 122 GLN 4.59 2.67 1 123 ALA -0.23 -0.33 1 125 ILE 1.35 0.52 1 127 SER -3.32 -1.56 1 128 LYS 3.72 2.92 1 129 GLN 5.12 3.68 1 130 LEU 2.11 2.00 1 131 ARG 5.00 2.90 1 132 ASP 3.33 2.08 1 133 LEU -1.32 -0.36 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6900_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -5.82 _LACS_plot.Line_1_terminator_val_y_1 2.61 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.34 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.11 _LACS_plot.Line_2_terminator_val_x_2 8.36 _LACS_plot.Line_2_terminator_val_y_2 -2.12 _LACS_plot.Y_axis_chem_shift_offset -0.45 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 126 ILE -5.82 3.30 0 70 ILE 6.20 -4.70 0 11 VAL 0.98 -0.35 1 12 ASN 0.99 -0.35 1 13 HIS 1.82 0.94 1 14 LEU 1.90 -0.38 1 15 VAL 4.49 -1.48 1 16 LYS 4.33 -1.17 1 17 GLU 3.96 -0.79 1 18 ILE 5.04 -1.96 1 19 ASP 3.29 0.49 1 20 MET 3.86 -0.44 1 21 LEU 4.17 -0.34 1 22 LEU 3.33 -0.38 1 23 LYS 5.01 -0.73 1 24 GLU 3.54 -1.18 1 25 TYR 3.74 -1.28 1 26 LEU 3.31 -1.31 1 27 LEU 1.08 0.37 1 28 SER -0.46 1.40 1 30 ASP 0.14 -0.58 1 31 ILE 4.55 -0.20 1 32 SER 4.70 -1.32 1 33 GLU 2.36 -0.69 1 34 ALA 3.83 -0.76 1 35 GLU 3.79 -0.05 1 36 HIS 4.70 -0.23 1 38 LEU 3.04 -0.39 1 39 LYS 5.22 -1.22 1 40 GLU 2.15 -0.37 1 41 LEU 0.86 0.72 1 42 GLU 2.37 -1.97 1 43 VAL -2.29 -0.16 1 45 HIS 1.75 0.22 1 46 PHE -3.27 1.23 1 47 HIS 3.89 -0.40 1 48 HIS 1.68 2.45 1 49 GLU 3.01 -1.81 1 50 LEU 5.46 -1.99 1 51 VAL 6.09 -0.65 1 52 TYR 3.25 0.59 1 53 GLU 3.87 -1.31 1 54 ALA 4.40 -1.66 1 55 ILE 6.82 -1.98 1 56 VAL 8.36 -2.13 1 57 MET 5.65 -1.20 1 58 VAL 6.73 -1.80 1 59 LEU 4.31 -1.58 1 60 GLU -0.15 0.43 1 61 SER 0.13 0.74 1 62 THR -0.49 0.37 1 64 GLU -0.55 1.16 1 65 SER 4.12 -0.80 1 66 ALA 5.04 -1.62 1 67 PHE 4.08 -0.40 1 68 LYS 3.65 -0.42 1 69 MET 4.05 0.25 1 71 LEU 5.55 -0.86 1 72 ASP 4.75 -1.12 1 73 LEU 4.40 -0.97 1 74 LEU 4.62 -1.17 1 75 LYS 4.85 -0.38 1 76 SER 4.45 -0.38 1 77 LEU 2.92 -0.71 1 78 TRP 2.72 -0.11 1 79 LYS 4.27 -1.00 1 80 SER -0.22 -0.08 1 81 SER 3.60 -2.42 1 82 THR 5.86 -1.63 1 83 ILE -2.60 0.76 1 84 THR -2.86 1.65 1 85 ILE 4.37 -0.49 1 86 ASP 3.15 0.02 1 87 GLN 3.64 -0.67 1 88 MET 3.06 -0.06 1 89 LYS 4.03 -0.28 1 90 ARG 3.58 -0.58 1 92 TYR 5.08 -0.38 1 93 GLU 4.00 -0.44 1 94 ARG 4.26 -0.21 1 95 ILE 3.97 -3.08 1 96 TYR 2.68 -3.04 1 97 ASN 1.83 0.61 1 98 GLU -1.02 1.43 1 99 ILE 4.22 0.07 1 101 ASP 1.67 0.13 1 102 ILE 3.00 0.14 1 103 ASN 0.59 0.98 1 104 LEU 1.59 -0.36 1 105 ASP -0.29 1.15 1 106 VAL 2.15 0.20 1 108 HIS 2.26 -0.29 1 109 SER 5.12 -0.77 1 110 TYR 6.05 -1.29 1 111 SER 4.26 -0.98 1 112 VAL 5.80 -1.28 1 113 LEU 4.69 -1.25 1 114 GLU 4.48 -1.55 1 115 ARG 3.66 -0.05 1 116 PHE 5.44 -0.18 1 117 VAL 6.44 -1.06 1 118 GLU 4.22 -1.18 1 119 GLU 4.40 -1.16 1 121 PHE 3.42 -0.62 1 122 GLN 4.59 -1.92 1 123 ALA -0.23 -0.10 1 125 ILE 1.35 -0.83 1 127 SER -3.32 1.76 1 128 LYS 3.72 -0.80 1 129 GLN 5.12 -1.44 1 130 LEU 2.11 -0.11 1 131 ARG 5.00 -2.10 1 132 ASP 3.33 -1.25 1 133 LEU -1.32 0.96 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6900_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -5.82 _LACS_plot.Line_1_terminator_val_y_1 0.36 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.18 _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 8.36 _LACS_plot.Line_2_terminator_val_y_2 -0.68 _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 125 ILE 1.35 -1.38 0 11 VAL 0.98 -0.15 1 12 ASN 0.99 -0.15 1 13 HIS 1.82 -0.30 1 14 LEU 1.90 -0.25 1 15 VAL 4.49 -0.43 1 16 LYS 4.33 -0.28 1 17 GLU 3.96 -0.28 1 18 ILE 5.04 -0.58 1 19 ASP 3.29 -0.31 1 20 MET 3.86 -0.39 1 21 LEU 4.17 -0.21 1 22 LEU 3.33 -0.35 1 23 LYS 5.01 -0.47 1 24 GLU 3.54 -0.25 1 25 TYR 3.74 0.11 1 26 LEU 3.31 -0.64 1 27 LEU 1.08 -0.12 1 28 SER -0.46 -0.02 1 30 ASP 0.14 0.16 1 31 ILE 4.55 -0.60 1 32 SER 4.70 -0.16 1 33 GLU 2.36 -0.07 1 34 ALA 3.83 -0.09 1 35 GLU 3.79 -0.76 1 36 HIS 4.70 -0.47 1 38 LEU 3.04 -0.45 1 39 LYS 5.22 -0.28 1 40 GLU 2.15 -0.31 1 41 LEU 0.86 -0.26 1 42 GLU 2.37 -0.47 1 43 VAL -2.29 0.34 1 45 HIS 1.75 -0.20 1 46 PHE -3.27 0.34 1 47 HIS 3.89 -0.35 1 48 HIS 1.68 -0.45 1 49 GLU 3.01 -0.23 1 50 LEU 5.46 -0.43 1 51 VAL 6.09 -0.96 1 52 TYR 3.25 -0.82 1 53 GLU 3.87 -0.89 1 54 ALA 4.40 -0.48 1 55 ILE 6.82 -1.26 1 56 VAL 8.36 -1.06 1 57 MET 5.65 -0.52 1 58 VAL 6.73 -0.91 1 59 LEU 4.31 -0.45 1 60 GLU -0.15 -0.19 1 61 SER 0.13 -0.01 1 62 THR -0.49 0.22 1 64 GLU -0.55 0.09 1 65 SER 4.12 -0.15 1 66 ALA 5.04 -0.33 1 67 PHE 4.08 -0.65 1 68 LYS 3.65 -0.15 1 69 MET 4.05 -0.08 1 70 ILE 6.20 -0.12 1 71 LEU 5.55 -0.39 1 72 ASP 4.75 -0.21 1 73 LEU 4.40 -0.42 1 74 LEU 4.62 -0.47 1 75 LYS 4.85 -0.29 1 76 SER 4.45 -0.22 1 77 LEU 2.92 -0.16 1 78 TRP 2.72 0.07 1 79 LYS 4.27 -0.57 1 80 SER -0.22 -0.05 1 81 SER 3.60 -0.40 1 82 THR 5.86 -0.31 1 83 ILE -2.60 0.81 1 84 THR -2.86 0.13 1 85 ILE 4.37 -0.05 1 86 ASP 3.15 -0.17 1 87 GLN 3.64 -0.29 1 88 MET 3.06 -0.17 1 89 LYS 4.03 -0.37 1 90 ARG 3.58 -0.16 1 92 TYR 5.08 -0.88 1 93 GLU 4.00 -0.68 1 94 ARG 4.26 -0.19 1 95 ILE 3.97 -0.15 1 96 TYR 2.68 -0.17 1 97 ASN 1.83 -0.09 1 98 GLU -1.02 0.22 1 99 ILE 4.22 -0.19 1 101 ASP 1.67 0.00 1 102 ILE 3.00 -0.24 1 103 ASN 0.59 -0.11 1 104 LEU 1.59 -0.13 1 105 ASP -0.29 0.09 1 106 VAL 2.15 -0.32 1 108 HIS 2.26 0.07 1 109 SER 5.12 -0.34 1 110 TYR 6.05 -0.46 1 111 SER 4.26 -0.17 1 112 VAL 5.80 -0.31 1 113 LEU 4.69 -0.31 1 114 GLU 4.48 -0.16 1 115 ARG 3.66 -0.06 1 116 PHE 5.44 -0.59 1 117 VAL 6.44 -0.53 1 118 GLU 4.22 -0.01 1 119 GLU 4.40 -0.27 1 121 PHE 3.42 -0.38 1 122 GLN 4.59 -0.76 1 123 ALA -0.23 -0.04 1 126 ILE -5.82 0.13 1 127 SER -3.32 0.02 1 128 LYS 3.72 -1.01 1 129 GLN 5.12 -0.37 1 130 LEU 2.11 -0.13 1 131 ARG 5.00 -0.63 1 132 ASP 3.33 -0.36 1 133 LEU -1.32 -0.24 1 stop_ save_