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 bmr25942_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -1.24 _LACS_plot.Line_1_terminator_val_y_1 -0.41 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.60 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.24 _LACS_plot.Line_2_terminator_val_x_2 4.79 _LACS_plot.Line_2_terminator_val_y_2 3.99 _LACS_plot.Y_axis_chem_shift_offset -0.33 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 109 ASP 4.75 1.61 0 10 THR 0.58 0.80 1 11 LYS 0.74 0.90 1 12 ALA 0.50 0.89 1 13 VAL 1.41 1.29 1 15 VAL 1.82 1.46 1 16 LEU 0.90 0.62 1 17 LYS 0.55 0.48 1 19 ASP 1.10 -0.81 1 22 VAL 4.79 3.66 1 23 GLN 3.97 3.07 1 25 ILE 4.23 3.74 1 26 ILE 4.61 3.87 1 27 ASN 3.15 2.82 1 28 PHE 3.51 3.61 1 29 GLU 4.46 2.57 1 30 GLN 2.81 2.56 1 31 LYS 1.83 1.74 1 32 GLU 0.92 -0.30 1 33 SER 1.10 1.30 1 34 ASN 0.04 0.52 1 37 VAL 2.70 2.17 1 38 LYS 2.01 1.50 1 39 VAL 3.52 3.01 1 40 TRP 1.71 2.09 1 42 SER 2.91 2.97 1 43 ILE 3.44 3.21 1 44 LYS 0.74 0.92 1 46 LEU 2.13 2.47 1 47 THR 3.38 2.86 1 48 GLU 3.00 1.38 1 50 LEU 1.07 0.92 1 51 HIS 1.87 1.68 1 53 PHE 0.24 0.77 1 54 HIS -0.13 0.35 1 55 VAL 1.06 1.00 1 56 HIS 0.15 0.33 1 58 PHE 0.03 0.26 1 60 ASP 1.58 -0.55 1 61 ASN 0.48 0.63 1 62 THR 0.54 0.62 1 63 ALA -0.26 0.32 1 66 THR 0.23 0.45 1 67 SER 0.00 0.37 1 68 ALA -0.32 0.31 1 71 HIS -0.17 0.14 1 72 PHE -0.63 0.02 1 73 ASN -1.24 -0.52 1 75 LEU 0.98 0.57 1 76 SER 0.32 0.57 1 77 ARG 0.19 0.24 1 78 LYS 0.21 0.33 1 79 HIS -0.12 0.34 1 83 LYS 1.01 0.72 1 84 ASP 1.23 -0.25 1 85 GLU 0.56 -0.37 1 86 GLU 0.84 -0.11 1 87 ARG 0.14 0.32 1 88 HIS 0.24 0.58 1 89 VAL 1.07 0.93 1 91 ASP 0.97 -0.72 1 92 LEU 1.06 1.06 1 94 ASN 0.05 0.38 1 95 VAL 1.74 1.43 1 96 THR 1.61 1.42 1 97 ALA 0.55 0.75 1 98 ASP 1.78 -0.63 1 99 LYS 1.71 1.43 1 100 ASP 1.53 -0.55 1 102 VAL 1.04 0.86 1 103 ALA 0.23 0.61 1 104 ASP 2.87 0.23 1 105 VAL 1.59 1.46 1 106 SER 1.03 1.11 1 107 ILE 3.83 3.22 1 108 GLU 4.45 2.96 1 110 SER 4.14 3.85 1 111 VAL 4.43 3.78 1 112 ILE 3.22 2.86 1 113 SER 2.64 2.49 1 114 LEU 1.27 1.36 1 115 SER 1.97 2.25 1 117 ASP 1.98 -0.59 1 118 HIS 1.44 1.23 1 120 ILE 1.63 1.98 1 121 ILE 1.87 2.02 1 123 ARG 2.30 2.17 1 124 THR 2.41 1.90 1 125 LEU 2.17 2.24 1 126 VAL 3.04 2.54 1 127 VAL 2.67 2.18 1 128 HIS 1.07 1.12 1 129 GLU 0.45 -0.27 1 130 LYS 0.61 0.27 1 131 ALA 0.95 1.02 1 132 ASP 1.91 -0.45 1 133 ASP 1.79 -0.45 1 134 LEU 0.87 0.93 1 136 LYS 0.41 0.45 1 139 ASN 0.24 0.50 1 140 GLU 1.06 0.04 1 141 GLU 1.80 0.86 1 142 SER 0.46 0.67 1 143 THR 0.69 0.80 1 144 LYS 0.71 0.72 1 145 THR 0.21 0.41 1 147 ASN 0.06 0.53 1 148 ALA 0.99 1.22 1 150 SER 0.56 0.81 1 151 ARG 1.92 1.77 1 152 LEU 1.15 1.27 1 153 ALA 1.27 1.34 1 156 VAL 2.39 2.01 1 157 ILE 1.53 1.44 1 159 ILE 1.61 1.54 1 160 ALA 0.88 1.05 1 161 GLN 0.21 0.38 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25942_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -1.24 _LACS_plot.Line_1_terminator_val_y_1 0.83 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.40 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.76 _LACS_plot.Line_2_terminator_val_x_2 4.79 _LACS_plot.Line_2_terminator_val_y_2 -0.80 _LACS_plot.Y_axis_chem_shift_offset -0.33 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 109 ASP 4.75 -3.14 0 10 THR 0.58 0.22 1 11 LYS 0.74 0.16 1 12 ALA 0.50 0.39 1 13 VAL 1.41 -0.12 1 15 VAL 1.82 -0.36 1 16 LEU 0.90 -0.28 1 17 LYS 0.55 -0.07 1 19 ASP 1.10 -1.91 1 22 VAL 4.79 -1.13 1 23 GLN 3.97 -0.90 1 25 ILE 4.23 -0.49 1 26 ILE 4.61 -0.74 1 27 ASN 3.15 -0.33 1 28 PHE 3.51 0.10 1 29 GLU 4.46 -1.89 1 30 GLN 2.81 -0.25 1 31 LYS 1.83 -0.09 1 32 GLU 0.92 -1.22 1 33 SER 1.10 0.20 1 34 ASN 0.04 0.48 1 37 VAL 2.70 -0.53 1 38 LYS 2.01 -0.51 1 39 VAL 3.52 -0.51 1 40 TRP 1.71 0.38 1 42 SER 2.91 0.06 1 43 ILE 3.44 -0.23 1 44 LYS 0.74 0.18 1 46 LEU 2.13 0.34 1 47 THR 3.38 -0.52 1 48 GLU 3.00 -1.62 1 50 LEU 1.07 -0.15 1 51 HIS 1.87 -0.19 1 53 PHE 0.24 0.53 1 54 HIS -0.13 0.48 1 55 VAL 1.06 -0.06 1 56 HIS 0.15 0.18 1 58 PHE 0.03 0.23 1 60 ASP 1.58 -2.13 1 61 ASN 0.48 0.15 1 62 THR 0.54 0.08 1 63 ALA -0.26 0.58 1 66 THR 0.23 0.22 1 67 SER 0.00 0.37 1 68 ALA -0.32 0.63 1 71 HIS -0.17 0.31 1 72 PHE -0.63 0.65 1 73 ASN -1.24 0.72 1 75 LEU 0.98 -0.41 1 76 SER 0.32 0.25 1 77 ARG 0.19 0.05 1 78 LYS 0.21 0.12 1 79 HIS -0.12 0.46 1 83 LYS 1.01 -0.29 1 84 ASP 1.23 -1.48 1 85 GLU 0.56 -0.93 1 86 GLU 0.84 -0.95 1 87 ARG 0.14 0.18 1 88 HIS 0.24 0.34 1 89 VAL 1.07 -0.14 1 91 ASP 0.97 -1.69 1 92 LEU 1.06 0.00 1 94 ASN 0.05 0.33 1 95 VAL 1.74 -0.31 1 96 THR 1.61 -0.19 1 97 ALA 0.55 0.20 1 98 ASP 1.78 -2.41 1 99 LYS 1.71 -0.28 1 100 ASP 1.53 -2.08 1 102 VAL 1.04 -0.18 1 103 ALA 0.23 0.38 1 104 ASP 2.87 -2.64 1 105 VAL 1.59 -0.13 1 106 SER 1.03 0.08 1 107 ILE 3.83 -0.61 1 108 GLU 4.45 -1.49 1 110 SER 4.14 -0.29 1 111 VAL 4.43 -0.65 1 112 ILE 3.22 -0.36 1 113 SER 2.64 -0.15 1 114 LEU 1.27 0.09 1 115 SER 1.97 0.28 1 117 ASP 1.98 -2.57 1 118 HIS 1.44 -0.21 1 120 ILE 1.63 0.35 1 121 ILE 1.87 0.15 1 123 ARG 2.30 -0.13 1 124 THR 2.41 -0.51 1 125 LEU 2.17 0.07 1 126 VAL 3.04 -0.50 1 127 VAL 2.67 -0.49 1 128 HIS 1.07 0.05 1 129 GLU 0.45 -0.72 1 130 LYS 0.61 -0.34 1 131 ALA 0.95 0.07 1 132 ASP 1.91 -2.36 1 133 ASP 1.79 -2.24 1 134 LEU 0.87 0.06 1 136 LYS 0.41 0.04 1 139 ASN 0.24 0.26 1 140 GLU 1.06 -1.02 1 141 GLU 1.80 -0.94 1 142 SER 0.46 0.21 1 143 THR 0.69 0.11 1 144 LYS 0.71 0.01 1 145 THR 0.21 0.20 1 147 ASN 0.06 0.47 1 148 ALA 0.99 0.23 1 150 SER 0.56 0.25 1 151 ARG 1.92 -0.15 1 152 LEU 1.15 0.12 1 153 ALA 1.27 0.07 1 156 VAL 2.39 -0.38 1 157 ILE 1.53 -0.09 1 159 ILE 1.61 -0.07 1 160 ALA 0.88 0.17 1 161 GLN 0.21 0.17 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25942_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -1.24 _LACS_plot.Line_1_terminator_val_y_1 0.05 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.11 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.09 _LACS_plot.Line_2_terminator_val_x_2 4.79 _LACS_plot.Line_2_terminator_val_y_2 -0.25 _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 112 ILE 3.22 0.08 0 73 ASN -1.24 -0.17 0 29 GLU 4.46 -0.47 0 10 THR 0.58 -0.08 1 11 LYS 0.74 -0.05 1 12 ALA 0.50 -0.07 1 13 VAL 1.41 -0.14 1 15 VAL 1.82 -0.08 1 16 LEU 0.90 -0.06 1 17 LYS 0.55 0.00 1 19 ASP 1.10 0.09 1 22 VAL 4.79 -0.36 1 23 GLN 3.97 -0.36 1 25 ILE 4.23 -0.29 1 26 ILE 4.61 -0.41 1 27 ASN 3.15 -0.25 1 28 PHE 3.51 -0.33 1 30 GLN 2.81 -0.32 1 31 LYS 1.83 -0.14 1 32 GLU 0.92 -0.08 1 33 SER 1.10 -0.18 1 34 ASN 0.04 0.03 1 37 VAL 2.70 -0.18 1 38 LYS 2.01 -0.01 1 39 VAL 3.52 -0.26 1 40 TRP 1.71 -0.11 1 42 SER 2.91 -0.05 1 43 ILE 3.44 -0.30 1 46 LEU 2.13 -0.16 1 47 THR 3.38 -0.08 1 48 GLU 3.00 -0.18 1 50 LEU 1.07 -0.08 1 51 HIS 1.87 -0.14 1 53 PHE 0.24 -0.13 1 54 HIS -0.13 0.02 1 55 VAL 1.06 -0.05 1 56 HIS 0.15 -0.09 1 58 PHE 0.03 0.01 1 60 ASP 1.58 0.00 1 61 ASN 0.48 0.00 1 62 THR 0.54 -0.08 1 63 ALA -0.26 -0.02 1 66 THR 0.23 0.04 1 67 SER 0.00 -0.02 1 68 ALA -0.32 0.04 1 71 HIS -0.17 0.03 1 72 PHE -0.63 -0.02 1 75 LEU 0.98 -0.06 1 76 SER 0.32 -0.14 1 77 ARG 0.19 -0.01 1 78 LYS 0.21 -0.07 1 79 HIS -0.12 -0.01 1 83 LYS 1.01 -0.07 1 84 ASP 1.23 -0.07 1 85 GLU 0.56 -0.02 1 86 GLU 0.84 -0.01 1 87 ARG 0.14 -0.08 1 88 HIS 0.24 0.01 1 89 VAL 1.07 -0.07 1 91 ASP 0.97 0.07 1 92 LEU 1.06 -0.06 1 94 ASN 0.05 -0.11 1 95 VAL 1.74 -0.01 1 96 THR 1.61 -0.11 1 97 ALA 0.55 -0.05 1 98 ASP 1.78 -0.02 1 99 LYS 1.71 -0.09 1 100 ASP 1.53 0.06 1 102 VAL 1.04 -0.06 1 103 ALA 0.23 -0.01 1 104 ASP 2.87 -0.05 1 105 VAL 1.59 -0.07 1 106 SER 1.03 0.08 1 107 ILE 3.83 -0.26 1 108 GLU 4.45 -0.16 1 109 ASP 4.75 -0.17 1 110 SER 4.14 -0.14 1 111 VAL 4.43 -0.20 1 113 SER 2.64 -0.13 1 114 LEU 1.27 -0.01 1 115 SER 1.97 -0.21 1 117 ASP 1.98 0.09 1 118 HIS 1.44 -0.09 1 120 ILE 1.63 0.09 1 121 ILE 1.87 0.10 1 123 ARG 2.30 -0.12 1 124 THR 2.41 -0.05 1 125 LEU 2.17 -0.05 1 126 VAL 3.04 -0.17 1 127 VAL 2.67 -0.15 1 128 HIS 1.07 -0.13 1 129 GLU 0.45 -0.03 1 131 ALA 0.95 -0.08 1 132 ASP 1.91 -0.06 1 133 ASP 1.79 0.00 1 134 LEU 0.87 -0.06 1 136 LYS 0.41 0.01 1 139 ASN 0.24 -0.12 1 140 GLU 1.06 -0.06 1 141 GLU 1.80 -0.08 1 142 SER 0.46 0.00 1 143 THR 0.69 -0.11 1 144 LYS 0.71 0.05 1 145 THR 0.21 -0.01 1 147 ASN 0.06 -0.03 1 148 ALA 0.99 -0.09 1 150 SER 0.56 -0.07 1 151 ARG 1.92 -0.10 1 152 LEU 1.15 -0.12 1 153 ALA 1.27 -0.13 1 157 ILE 1.53 -0.13 1 159 ILE 1.61 -0.14 1 160 ALA 0.88 -0.13 1 161 GLN 0.21 -0.05 1 stop_ save_