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 bmr15663_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.15 _LACS_plot.Line_1_terminator_val_y_1 -1.96 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.37 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.73 _LACS_plot.Line_2_terminator_val_x_2 8.19 _LACS_plot.Line_2_terminator_val_y_2 7.16 _LACS_plot.Y_axis_chem_shift_offset -0.73 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 113 LEU 2.37 -2.73 0 10 ALA 4.15 3.82 1 11 GLU 4.48 4.36 1 12 GLU 1.56 2.85 1 13 GLN 5.30 5.38 1 14 GLN 4.61 4.11 1 15 GLU 3.33 3.48 1 16 TYR 2.85 1.02 1 17 LYS 5.54 5.66 1 18 GLU 3.67 3.81 1 19 ALA 3.41 3.67 1 20 PHE 4.91 5.13 1 21 GLN 3.44 3.49 1 22 LEU 2.47 3.10 1 23 PHE 3.04 2.86 1 24 ASP 0.88 -0.64 1 25 LYS 3.00 3.12 1 26 ASP 0.36 -1.14 1 27 ASN 3.17 2.46 1 28 ASP -0.45 -0.52 1 29 ASN 2.23 2.08 1 30 LYS -7.15 -1.26 1 31 LEU -4.22 -1.68 1 32 THR -2.66 -0.23 1 33 ALA 4.67 4.37 1 34 GLU 3.27 3.71 1 35 GLU 1.05 2.96 1 36 LEU 3.54 3.36 1 38 THR 6.17 5.41 1 39 VAL 5.04 3.62 1 40 MET 5.52 6.42 1 41 ARG 3.76 3.71 1 42 ALA 3.15 3.18 1 43 LEU -0.52 0.14 1 45 ALA -1.85 -0.44 1 46 ASN 0.16 1.27 1 48 THR -3.13 -0.71 1 49 LYS 5.09 4.59 1 50 GLN 4.77 4.10 1 51 LYS 3.32 2.87 1 52 ILE 5.07 3.23 1 53 SER 5.20 4.65 1 54 GLU 3.04 3.47 1 55 ILE 5.04 5.24 1 56 VAL 5.52 5.26 1 57 LYS 3.79 3.64 1 58 ASP 1.93 2.99 1 59 TYR 1.37 2.42 1 60 ASP -0.08 -0.18 1 61 LYS 2.38 2.74 1 62 ASP -0.32 -0.14 1 63 ASN 3.23 2.46 1 64 SER 0.31 2.11 1 66 LYS -6.31 -1.28 1 67 PHE -3.07 -0.16 1 68 ASP -2.33 -1.02 1 69 GLN 4.18 5.38 1 70 GLU 4.08 4.22 1 71 THR 7.23 6.17 1 72 PHE 3.97 4.25 1 73 LEU 5.55 4.48 1 74 THR 6.66 6.16 1 75 ILE 5.87 5.48 1 76 MET 3.19 0.54 1 77 LEU 3.51 3.84 1 78 GLU 1.90 2.47 1 79 TYR 2.15 3.18 1 81 GLN 0.07 0.99 1 82 GLU 0.01 0.98 1 83 VAL 0.55 1.14 1 84 ASP -0.10 0.99 1 85 SER 0.83 1.52 1 86 THR 3.70 3.77 1 87 GLU 2.40 3.13 1 88 ASP 0.61 1.36 1 89 ILE 0.40 1.23 1 90 LYS 0.19 0.72 1 91 LYS -4.29 -1.69 1 92 ALA 1.42 1.78 1 95 ILE 8.20 6.46 1 96 PHE -0.40 2.62 1 97 ASP 3.28 4.37 1 98 LYS 5.31 4.87 1 99 GLU 7.05 4.34 1 100 LYS 3.39 3.36 1 101 ASN 1.93 4.34 1 105 SER -1.62 0.13 1 106 ALA 0.41 3.82 1 107 SER 4.22 3.65 1 108 GLU 1.83 2.34 1 109 LEU 3.37 3.50 1 110 LYS 2.70 4.32 1 111 HIS 5.39 5.01 1 112 VAL 0.46 -0.08 1 114 THR 0.86 1.46 1 115 THR 0.74 0.96 1 116 LEU -0.40 0.34 1 118 GLU 0.46 0.26 1 119 LYS -3.13 -0.16 1 120 LEU -2.36 -0.22 1 121 THR 4.37 4.50 1 122 GLU 4.03 3.80 1 123 GLN 1.92 3.22 1 124 GLU 6.87 6.01 1 125 VAL 4.39 4.49 1 126 ASP 2.73 4.68 1 127 ASP 4.29 3.47 1 128 LEU 2.63 1.09 1 129 LEU 6.15 5.57 1 130 LYS 3.00 5.62 1 131 GLU 0.72 2.13 1 132 ILE 0.72 0.50 1 134 VAL 0.22 0.84 1 135 GLU 0.52 0.64 1 136 GLU 0.51 -0.16 1 138 LEU 0.39 0.97 1 139 ILE 3.46 3.84 1 140 ASN 4.52 4.43 1 142 ASP 4.04 4.07 1 143 ASP 2.41 -0.32 1 144 PHE -0.02 0.88 1 145 VAL 2.59 0.99 1 146 LYS 0.70 0.17 1 147 LEU 3.06 1.32 1 148 ILE -0.73 1.37 1 149 THR 0.72 1.65 1 150 SER 1.03 2.13 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15663_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.15 _LACS_plot.Line_1_terminator_val_y_1 5.19 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.63 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.27 _LACS_plot.Line_2_terminator_val_x_2 8.19 _LACS_plot.Line_2_terminator_val_y_2 -1.03 _LACS_plot.Y_axis_chem_shift_offset -0.73 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 113 LEU 2.37 -5.10 0 10 ALA 4.15 -0.33 1 11 GLU 4.48 -0.12 1 12 GLU 1.56 1.29 1 13 GLN 5.30 0.08 1 14 GLN 4.61 -0.50 1 15 GLU 3.33 0.15 1 16 TYR 2.85 -1.83 1 17 LYS 5.54 0.12 1 18 GLU 3.67 0.14 1 19 ALA 3.41 0.26 1 20 PHE 4.91 0.22 1 21 GLN 3.44 0.05 1 22 LEU 2.47 0.63 1 23 PHE 3.04 -0.18 1 24 ASP 0.88 -1.52 1 25 LYS 3.00 0.12 1 26 ASP 0.36 -1.50 1 27 ASN 3.17 -0.71 1 28 ASP -0.45 -0.07 1 29 ASN 2.23 -0.15 1 30 LYS -7.15 5.89 1 31 LEU -4.22 2.54 1 32 THR -2.66 2.43 1 33 ALA 4.67 -0.30 1 34 GLU 3.27 0.44 1 35 GLU 1.05 1.91 1 36 LEU 3.54 -0.18 1 38 THR 6.17 -0.76 1 39 VAL 5.04 -1.42 1 40 MET 5.52 0.90 1 41 ARG 3.76 -0.05 1 42 ALA 3.15 0.03 1 43 LEU -0.52 0.66 1 45 ALA -1.85 1.41 1 46 ASN 0.16 1.11 1 48 THR -3.13 2.42 1 49 LYS 5.09 -0.50 1 50 GLN 4.77 -0.67 1 51 LYS 3.32 -0.45 1 52 ILE 5.07 -1.84 1 53 SER 5.20 -0.55 1 54 GLU 3.04 0.43 1 55 ILE 5.04 0.20 1 56 VAL 5.52 -0.26 1 57 LYS 3.79 -0.15 1 58 ASP 1.93 1.06 1 59 TYR 1.37 1.05 1 60 ASP -0.08 -0.10 1 61 LYS 2.38 0.36 1 62 ASP -0.32 0.18 1 63 ASN 3.23 -0.77 1 64 SER 0.31 1.80 1 66 LYS -6.31 5.03 1 67 PHE -3.07 2.91 1 68 ASP -2.33 1.31 1 69 GLN 4.18 1.20 1 70 GLU 4.08 0.14 1 71 THR 7.23 -1.06 1 72 PHE 3.97 0.28 1 73 LEU 5.55 -1.07 1 74 THR 6.66 -0.50 1 75 ILE 5.87 -0.39 1 76 MET 3.19 -2.65 1 77 LEU 3.51 0.33 1 78 GLU 1.90 0.57 1 79 TYR 2.15 1.03 1 81 GLN 0.07 0.92 1 82 GLU 0.01 0.97 1 83 VAL 0.55 0.59 1 84 ASP -0.10 1.09 1 85 SER 0.83 0.69 1 86 THR 3.70 0.07 1 87 GLU 2.40 0.73 1 88 ASP 0.61 0.75 1 89 ILE 0.40 0.83 1 90 LYS 0.19 0.53 1 91 LYS -4.29 2.60 1 92 ALA 1.42 0.36 1 95 ILE 8.20 -1.74 1 96 PHE -0.40 3.02 1 97 ASP 3.28 1.09 1 98 LYS 5.31 -0.44 1 99 GLU 7.05 -2.71 1 100 LYS 3.39 -0.03 1 101 ASN 1.93 2.41 1 105 SER -1.62 1.75 1 106 ALA 0.41 3.41 1 107 SER 4.22 -0.57 1 108 GLU 1.83 0.51 1 109 LEU 3.37 0.13 1 110 LYS 2.70 1.62 1 111 HIS 5.39 -0.38 1 112 VAL 0.46 -0.54 1 114 THR 0.86 0.60 1 115 THR 0.74 0.22 1 116 LEU -0.40 0.74 1 118 GLU 0.46 -0.20 1 119 LYS -3.13 2.97 1 120 LEU -2.36 2.14 1 121 THR 4.37 0.13 1 122 GLU 4.03 -0.23 1 123 GLN 1.92 1.30 1 124 GLU 6.87 -0.86 1 125 VAL 4.39 0.10 1 126 ASP 2.73 1.95 1 127 ASP 4.29 -0.82 1 128 LEU 2.63 -1.54 1 129 LEU 6.15 -0.58 1 130 LYS 3.00 2.62 1 131 GLU 0.72 1.41 1 132 ILE 0.72 -0.22 1 134 VAL 0.22 0.62 1 135 GLU 0.52 0.12 1 136 GLU 0.51 -0.67 1 138 LEU 0.39 0.58 1 139 ILE 3.46 0.38 1 140 ASN 4.52 -0.09 1 142 ASP 4.04 0.03 1 143 ASP 2.41 -2.73 1 144 PHE -0.02 0.90 1 145 VAL 2.59 -1.60 1 146 LYS 0.70 -0.53 1 147 LEU 3.06 -1.74 1 148 ILE -0.73 2.10 1 149 THR 0.72 0.93 1 150 SER 1.03 1.10 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15663_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.15 _LACS_plot.Line_1_terminator_val_y_1 0.71 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.21 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.18 _LACS_plot.Line_2_terminator_val_x_2 8.19 _LACS_plot.Line_2_terminator_val_y_2 -0.81 _LACS_plot.Y_axis_chem_shift_offset 0.01 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 96 PHE -0.40 -1.43 0 10 ALA 4.15 -0.42 1 11 GLU 4.48 -0.45 1 12 GLU 1.56 -0.78 1 13 GLN 5.30 -0.78 1 14 GLN 4.61 -0.43 1 15 GLU 3.33 -0.34 1 16 TYR 2.85 0.20 1 17 LYS 5.54 -0.36 1 18 GLU 3.67 -0.28 1 19 ALA 3.41 -0.01 1 20 PHE 4.91 -1.15 1 21 GLN 3.44 -0.27 1 22 LEU 2.47 -0.43 1 23 PHE 3.04 -0.55 1 24 ASP 0.88 0.03 1 25 LYS 3.00 -0.36 1 26 ASP 0.36 -0.14 1 27 ASN 3.17 -0.29 1 28 ASP -0.45 0.03 1 29 ASN 2.23 -0.40 1 30 LYS -7.15 0.79 1 31 LEU -4.22 0.99 1 32 THR -2.66 0.48 1 33 ALA 4.67 -0.37 1 34 GLU 3.27 -0.34 1 35 GLU 1.05 -0.34 1 36 LEU 3.54 -0.60 1 38 THR 6.17 -0.18 1 39 VAL 5.04 -0.17 1 40 MET 5.52 -0.90 1 41 ARG 3.76 0.00 1 42 ALA 3.15 -0.04 1 43 LEU -0.52 0.00 1 45 ALA -1.85 0.10 1 46 ASN 0.16 -0.40 1 48 THR -3.13 0.42 1 49 LYS 5.09 -0.47 1 50 GLN 4.77 -0.33 1 51 LYS 3.32 -0.25 1 52 ILE 5.07 -0.59 1 53 SER 5.20 -0.46 1 54 GLU 3.04 -0.39 1 55 ILE 5.04 -0.38 1 56 VAL 5.52 -0.39 1 57 LYS 3.79 -0.25 1 58 ASP 1.93 -0.30 1 59 TYR 1.37 0.10 1 60 ASP -0.08 0.36 1 61 LYS 2.38 -0.20 1 62 ASP -0.32 0.00 1 63 ASN 3.23 -0.45 1 64 SER 0.31 -0.24 1 66 LYS -6.31 0.52 1 67 PHE -3.07 0.27 1 68 ASP -2.33 0.41 1 69 GLN 4.18 -1.31 1 70 GLU 4.08 -0.45 1 71 THR 7.23 0.10 1 72 PHE 3.97 -0.66 1 73 LEU 5.55 -0.98 1 74 THR 6.66 0.04 1 75 ILE 5.87 -1.14 1 76 MET 3.19 -0.36 1 77 LEU 3.51 -0.33 1 78 GLU 1.90 -0.37 1 79 TYR 2.15 -0.26 1 81 GLN 0.07 -0.11 1 82 GLU 0.01 -0.12 1 83 VAL 0.55 -0.11 1 84 ASP -0.10 -0.03 1 85 SER 0.83 0.00 1 86 THR 3.70 -0.11 1 87 GLU 2.40 0.32 1 89 ILE 0.40 -0.11 1 91 LYS -4.29 0.43 1 92 ALA 1.42 -0.14 1 95 ILE 8.20 -0.92 1 97 ASP 3.28 -0.57 1 99 GLU 7.05 -0.56 1 100 LYS 3.39 -0.47 1 101 ASN 1.93 -0.09 1 105 SER -1.62 -0.29 1 106 ALA 0.41 -0.15 1 107 SER 4.22 -0.35 1 108 GLU 1.83 -0.28 1 109 LEU 3.37 0.15 1 110 LYS 2.70 -0.88 1 111 HIS 0.46 0.27 1 113 LEU 2.37 0.12 1 114 THR 0.74 0.48 1 116 LEU -0.40 -0.51 1 118 GLU 0.46 -0.11 1 119 LYS -3.13 0.38 1 120 LEU -2.36 0.27 1 121 THR 4.37 -0.58 1 122 GLU 4.03 -0.38 1 123 GLN 1.92 -0.34 1 124 GLU 6.87 -0.66 1 125 VAL 4.39 -0.30 1 126 ASP 2.73 -0.52 1 127 ASP 2.63 -0.49 1 129 LEU 0.72 0.00 1 132 ILE 0.72 -0.03 1 134 VAL 0.52 -0.23 1 136 GLU 0.39 -0.10 1 139 ILE 4.52 -0.34 1 142 ASP 4.04 -0.79 1 143 ASP 2.41 -0.39 1 144 PHE -0.02 0.04 1 145 VAL 2.59 -0.10 1 146 LYS 3.06 0.31 1 148 ILE -0.73 -0.06 1 149 THR 0.72 -0.08 1 150 SER 1.03 -0.19 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15663_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.15 _LACS_plot.Line_1_terminator_val_y_1 -4.66 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.76 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -2.95 _LACS_plot.Line_2_terminator_val_x_2 8.19 _LACS_plot.Line_2_terminator_val_y_2 -0.07 _LACS_plot.Y_axis_chem_shift_offset 2.39 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 138 LEU 0.39 4.16 0 10 ALA 4.15 0.03 1 11 GLU 4.48 -0.20 1 12 GLU 1.56 -1.75 1 13 GLN 5.30 -1.02 1 14 GLN 4.61 -0.91 1 15 GLU 3.33 0.89 1 16 TYR 2.85 -0.15 1 17 LYS 5.54 -0.33 1 18 GLU 3.67 -0.17 1 19 ALA 3.41 -2.16 1 20 PHE 4.91 -2.78 1 21 GLN 3.44 0.27 1 22 LEU 2.47 -1.82 1 23 PHE 3.04 -3.87 1 24 ASP 0.88 -1.32 1 25 LYS 3.00 -2.30 1 26 ASP 0.36 -3.38 1 27 ASN 3.17 -3.84 1 28 ASP -0.45 -2.19 1 29 ASN 2.23 -4.04 1 30 LYS -7.15 -4.10 1 31 LEU -4.22 -2.43 1 32 THR -2.66 -2.23 1 33 ALA 4.67 -0.74 1 34 GLU 3.27 0.24 1 35 GLU 1.05 -0.97 1 36 LEU 3.54 -1.95 1 38 THR 6.17 -0.43 1 39 VAL 5.04 -2.64 1 40 MET 5.52 -0.67 1 41 ARG 3.76 1.30 1 42 ALA 3.15 -1.27 1 43 LEU -0.52 -3.26 1 45 ALA -1.85 -5.12 1 46 ASN 0.16 -4.20 1 48 THR -3.13 -2.72 1 49 LYS 5.09 0.01 1 50 GLN 4.77 -0.70 1 51 LYS 3.32 -0.75 1 52 ILE 5.07 -1.86 1 53 SER 5.20 -0.22 1 54 GLU 3.04 -1.41 1 55 ILE 5.04 -0.87 1 56 VAL 5.52 -1.11 1 57 LYS 3.79 -0.64 1 58 ASP 1.93 -0.78 1 59 TYR 1.37 -2.68 1 60 ASP -0.08 -1.91 1 61 LYS 2.38 -2.06 1 62 ASP -0.32 -3.11 1 63 ASN 3.23 -3.18 1 64 SER 0.31 -0.65 1 66 LYS -6.31 -4.57 1 67 PHE -3.07 -3.12 1 68 ASP -2.33 -4.23 1 69 GLN 4.18 -1.35 1 70 GLU 4.08 0.24 1 71 THR 7.23 -1.58 1 72 PHE 3.97 -2.92 1 73 LEU 5.55 -1.54 1 74 THR 6.66 -1.37 1 75 ILE 5.87 -0.76 1 76 MET 3.19 0.76 1 77 LEU 3.51 -2.08 1 78 GLU 1.90 -1.20 1 79 TYR 2.15 -1.85 1 81 GLN 0.07 -2.59 1 82 GLU 0.01 -2.70 1 83 VAL 0.55 -3.10 1 84 ASP -0.10 -2.44 1 85 SER 0.83 -1.94 1 86 THR 3.70 -1.95 1 87 GLU 2.40 -2.83 1 88 ASP 0.61 -0.71 1 89 ILE 0.40 -4.14 1 90 LYS 0.19 -3.14 1 91 LYS -4.29 -3.77 1 92 ALA 1.42 -2.62 1 95 ILE 8.20 -0.27 1 96 PHE -0.40 -0.38 1 97 ASP 3.28 -1.10 1 98 LYS 5.31 0.78 1 99 GLU 7.05 -0.24 1 100 LYS 3.39 -1.51 1 101 ASN 1.93 0.47 1 105 SER -1.62 -1.75 1 106 ALA 0.41 -1.21 1 107 SER 4.22 -0.73 1 108 GLU 1.83 -1.01 1 109 LEU 3.37 -0.53 1 110 LYS 2.70 1.22 1 111 HIS 5.39 0.10 1 112 VAL 0.46 -3.07 1 113 LEU 2.37 -2.45 1 114 THR 0.86 -2.68 1 115 THR 0.74 -3.27 1 116 LEU -0.40 -3.27 1 118 GLU 0.46 -3.63 1 119 LYS -3.13 -2.91 1 120 LEU -2.36 -2.85 1 121 THR 4.37 -1.01 1 122 GLU 4.03 -1.02 1 123 GLN 1.92 0.67 1 124 GLU 6.87 -2.09 1 125 VAL 4.39 0.22 1 126 ASP 2.73 -0.12 1 127 ASP 4.29 -0.76 1 128 LEU 2.63 -4.02 1 129 LEU 6.15 -3.74 1 130 LYS 3.00 -3.37 1 131 GLU 0.72 -3.29 1 132 ILE 0.72 -2.22 1 134 VAL 0.22 -1.34 1 135 GLU 0.52 -5.46 1 136 GLU 0.51 -7.00 1 139 ILE 3.46 -2.62 1 140 ASN 4.52 0.16 1 142 ASP 4.04 0.00 1 143 ASP 2.41 -0.21 1 144 PHE -0.02 -3.28 1 145 VAL 2.59 -2.01 1 146 LYS 0.70 -4.94 1 147 LEU 3.06 -3.24 1 148 ILE -0.73 -0.18 1 149 THR 0.72 -3.99 1 150 SER 1.03 1.88 1 stop_ save_