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 bmr26787_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.95 _LACS_plot.Line_1_terminator_val_y_1 -2.55 _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 -1.46 _LACS_plot.Line_2_terminator_val_x_2 7.38 _LACS_plot.Line_2_terminator_val_y_2 5.67 _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 23 SER -3.61 3.11 0 10 TYR -3.00 -2.13 1 11 LYS -1.11 -0.66 1 12 LEU -4.89 -2.82 1 13 VAL -2.45 -0.67 1 14 MET -0.98 -1.61 1 15 LEU -5.51 -2.14 1 17 ALA -0.06 0.09 1 20 VAL 1.38 0.59 1 22 LYS 7.38 4.18 1 24 ALA 3.10 3.04 1 25 MET 3.54 5.12 1 26 THR -1.74 -3.73 1 30 ILE 2.46 1.69 1 31 SER -2.48 -0.34 1 32 HIS 5.15 2.44 1 33 ARG -4.22 -1.52 1 34 PHE -1.75 -1.64 1 44 ASP -4.36 -2.03 1 45 ALA -5.39 -2.78 1 46 TYR -4.19 -0.75 1 47 LYS -3.72 -1.12 1 48 ILE -3.05 -0.80 1 49 ARG -1.85 -1.17 1 50 ILE -5.83 -2.33 1 51 ARG 1.12 2.64 1 57 ALA -4.06 -1.30 1 58 ASN -0.34 -0.47 1 59 LEU -2.65 -1.26 1 60 ASP -2.68 -0.36 1 65 ALA -3.07 -0.97 1 67 GLN 1.30 0.86 1 68 ALA 0.40 0.33 1 69 GLU 0.78 0.89 1 70 PHE 0.35 -0.22 1 71 THR -2.54 -0.87 1 72 ALA 3.52 2.64 1 73 MET 3.27 3.36 1 74 ARG 4.62 3.17 1 80 ALA -1.69 -0.68 1 82 GLU -1.32 0.62 1 84 PHE -5.16 -0.94 1 86 ILE 0.27 0.01 1 88 TYR -2.64 -1.93 1 89 SER -5.46 -4.46 1 90 ILE 4.02 3.20 1 91 THR 0.53 -0.40 1 92 ASP -3.42 -2.00 1 93 ARG 5.49 3.99 1 94 ARG 6.15 4.01 1 95 SER 3.75 3.54 1 96 PHE 1.43 2.02 1 97 HIS 3.01 3.80 1 98 GLU 2.14 1.92 1 99 VAL 7.31 5.44 1 100 ARG 5.96 4.63 1 101 GLU 3.46 2.01 1 102 PHE 5.70 5.12 1 103 LYS 2.74 2.53 1 104 GLN 3.80 2.54 1 105 LEU 4.17 3.36 1 106 ILE 5.25 4.84 1 107 TYR 4.26 3.44 1 108 ARG 4.32 3.64 1 109 VAL 3.16 2.90 1 110 ARG 0.32 -0.24 1 111 ARG 4.81 0.49 1 112 THR -0.04 -0.17 1 117 VAL -6.95 -2.99 1 118 VAL -4.04 -0.59 1 119 LEU -4.59 -1.39 1 120 VAL -5.80 -2.31 1 123 LYS 5.17 1.55 1 124 SER 3.53 2.64 1 125 ASP -0.12 0.42 1 126 LEU 1.22 -2.24 1 127 LYS 4.06 3.74 1 128 GLN 3.46 1.81 1 129 LEU -1.86 -1.74 1 130 ARG 2.23 2.97 1 131 GLN -2.81 0.01 1 132 VAL -3.02 -1.33 1 133 THR -0.89 0.04 1 134 LYS 5.11 4.21 1 135 GLU 4.94 3.73 1 136 GLU 3.41 2.87 1 138 LEU 2.49 2.18 1 139 ALA 3.57 2.38 1 140 LEU 3.39 1.91 1 141 ALA 2.61 2.40 1 142 ARG 4.62 3.37 1 143 GLU 4.04 3.13 1 144 PHE -0.01 -1.06 1 148 PHE -5.83 -1.80 1 149 PHE -5.69 -1.00 1 150 GLU -3.33 -1.25 1 151 THR -5.41 -1.97 1 152 SER -2.70 -0.98 1 153 ALA 3.78 2.56 1 154 ALA 2.45 1.30 1 155 TYR 0.07 -1.46 1 156 ARG 3.23 1.82 1 157 TYR -2.67 -3.53 1 158 TYR 6.64 3.06 1 159 ILE 3.14 0.12 1 160 ASP 4.75 3.92 1 161 ASP 3.36 2.58 1 162 VAL 4.71 3.85 1 163 PHE 3.82 4.49 1 164 HIS 2.07 4.11 1 165 ALA 3.44 2.62 1 166 LEU 3.49 2.44 1 167 VAL 6.79 4.96 1 168 ARG 5.88 4.82 1 169 GLU 2.29 2.45 1 170 ILE 5.54 5.08 1 173 LYS 3.83 2.55 1 174 GLU 2.13 2.12 1 175 LYS 2.01 1.67 1 176 GLU 0.60 0.72 1 177 ALA 0.21 0.37 1 178 VAL 0.48 0.03 1 179 LEU 0.67 1.73 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26787_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.95 _LACS_plot.Line_1_terminator_val_y_1 4.40 _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 0.54 _LACS_plot.Line_2_terminator_val_x_2 7.38 _LACS_plot.Line_2_terminator_val_y_2 -1.71 _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 23 SER -3.61 6.72 0 10 TYR -3.00 0.87 1 11 LYS -1.11 0.45 1 12 LEU -4.89 2.07 1 13 VAL -2.45 1.78 1 14 MET -0.98 -0.63 1 15 LEU -5.51 3.37 1 17 ALA -0.06 0.15 1 20 VAL 1.38 -0.79 1 22 LYS 7.38 -3.20 1 24 ALA 3.10 -0.06 1 25 MET 3.54 1.58 1 26 THR -1.74 -1.99 1 30 ILE 2.46 -0.77 1 31 SER -2.48 2.14 1 32 HIS 5.15 -2.71 1 33 ARG -4.22 2.70 1 34 PHE -1.75 0.11 1 44 ASP -4.36 2.33 1 45 ALA -5.39 2.61 1 46 TYR -4.19 3.44 1 47 LYS -3.72 2.60 1 48 ILE -3.05 2.25 1 49 ARG -1.85 0.68 1 50 ILE -5.83 3.50 1 51 ARG 1.12 1.52 1 57 ALA -4.06 2.76 1 58 ASN -0.34 -0.13 1 59 LEU -2.65 1.39 1 60 ASP -2.68 2.32 1 65 ALA -3.07 2.10 1 67 GLN 1.30 -0.44 1 68 ALA 0.40 -0.07 1 69 GLU 0.78 0.11 1 70 PHE 0.35 -0.57 1 71 THR -2.54 1.67 1 72 ALA 3.52 -0.88 1 73 MET 3.27 0.09 1 74 ARG 4.62 -1.45 1 80 ALA -1.69 1.01 1 82 GLU -1.32 1.94 1 84 PHE -5.16 4.22 1 86 ILE 0.27 -0.26 1 88 TYR -2.64 0.71 1 89 SER -5.46 1.00 1 90 ILE 4.02 -0.82 1 91 THR 0.53 -0.93 1 92 ASP -3.42 1.42 1 93 ARG 5.49 -1.50 1 94 ARG 6.15 -2.14 1 95 SER 3.75 -0.21 1 96 PHE 1.43 0.59 1 97 HIS 3.01 0.79 1 98 GLU 2.14 -0.22 1 99 VAL 7.31 -1.87 1 100 ARG 5.96 -1.33 1 101 GLU 3.46 -1.45 1 102 PHE 5.70 -0.58 1 103 LYS 2.74 -0.21 1 104 GLN 3.80 -1.26 1 105 LEU 4.17 -0.81 1 106 ILE 5.25 -0.41 1 107 TYR 4.26 -0.82 1 108 ARG 4.32 -0.68 1 109 VAL 3.16 -0.26 1 110 ARG 0.32 -0.56 1 111 ARG 4.81 -4.32 1 112 THR -0.04 -0.13 1 117 VAL -6.95 3.96 1 118 VAL -4.04 3.45 1 119 LEU -4.59 3.20 1 120 VAL -5.80 3.49 1 123 LYS 5.17 -3.62 1 124 SER 3.53 -0.89 1 125 ASP -0.12 0.54 1 126 LEU 1.22 -3.46 1 127 LYS 4.06 -0.32 1 128 GLN 3.46 -1.65 1 129 LEU -1.86 0.12 1 130 ARG 2.23 0.74 1 131 GLN -2.81 2.82 1 132 VAL -3.02 1.69 1 133 THR -0.89 0.93 1 134 LYS 5.11 -0.90 1 135 GLU 4.94 -1.21 1 136 GLU 3.41 -0.54 1 138 LEU 2.49 -0.31 1 139 ALA 3.57 -1.19 1 140 LEU 3.39 -1.48 1 141 ALA 2.61 -0.21 1 142 ARG 4.62 -1.25 1 143 GLU 4.04 -0.91 1 144 PHE -0.01 -1.05 1 148 PHE -5.83 4.03 1 149 PHE -5.69 4.69 1 150 GLU -3.33 2.08 1 151 THR -5.41 3.44 1 152 SER -2.70 1.72 1 153 ALA 3.78 -1.22 1 154 ALA 2.45 -1.15 1 155 TYR 0.07 -1.53 1 156 ARG 3.23 -1.41 1 157 TYR -2.67 -0.86 1 158 TYR 6.64 -3.58 1 159 ILE 3.14 -3.02 1 160 ASP 4.75 -0.83 1 161 ASP 3.36 -0.78 1 162 VAL 4.71 -0.86 1 163 PHE 3.82 0.67 1 164 HIS 2.07 2.04 1 165 ALA 3.44 -0.82 1 166 LEU 3.49 -1.05 1 167 VAL 6.79 -1.83 1 168 ARG 5.88 -1.06 1 169 GLU 2.29 0.16 1 170 ILE 5.54 -0.46 1 173 LYS 3.83 -1.28 1 174 GLU 2.13 -0.01 1 175 LYS 2.01 -0.34 1 176 GLU 0.60 0.12 1 177 ALA 0.21 0.16 1 178 VAL 0.48 -0.45 1 179 LEU 0.67 1.06 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26787_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.95 _LACS_plot.Line_1_terminator_val_y_1 3.66 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.13 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.60 _LACS_plot.Line_2_terminator_val_x_2 7.30 _LACS_plot.Line_2_terminator_val_y_2 -2.23 _LACS_plot.Y_axis_chem_shift_offset -0.75 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 158 TYR 6.64 4.39 0 179 LEU 0.67 -6.70 0 32 HIS 5.15 5.83 0 10 TYR -3.00 2.44 1 11 LYS -1.11 1.51 1 12 LEU -4.89 0.02 1 13 VAL -2.45 2.50 1 14 MET -0.98 2.41 1 15 LEU -5.51 1.14 1 17 ALA -0.06 -1.12 1 20 VAL 1.38 2.87 1 23 SER -3.61 2.61 1 24 ALA 3.10 -4.14 1 25 MET 3.54 -0.80 1 26 THR -1.74 4.93 1 30 ILE 2.46 -0.90 1 31 SER -2.48 4.97 1 33 ARG -4.22 4.23 1 34 PHE -1.75 4.15 1 44 ASP -4.36 4.91 1 45 ALA -5.39 -1.18 1 46 TYR -4.19 3.07 1 47 LYS -3.72 0.23 1 48 ILE -3.05 6.12 1 49 ARG -1.85 1.55 1 50 ILE -5.83 3.10 1 51 ARG 1.12 4.08 1 57 ALA -4.06 1.04 1 58 ASN -0.34 4.61 1 59 LEU -2.65 0.04 1 60 ASP -2.68 1.39 1 65 ALA -3.07 -2.28 1 67 GLN 1.30 1.22 1 68 ALA 0.40 -2.19 1 69 GLU 0.78 0.78 1 70 PHE 0.35 1.33 1 71 THR -2.54 3.86 1 72 ALA 3.52 -4.75 1 73 MET 3.27 -0.49 1 74 ARG 4.62 -1.20 1 80 ALA -1.69 -3.12 1 82 GLU -1.32 0.95 1 84 PHE -5.16 4.15 1 86 ILE 0.27 3.25 1 88 TYR -2.64 5.00 1 89 SER -5.46 2.12 1 90 ILE 4.02 0.29 1 91 THR 0.53 5.29 1 92 ASP -3.42 0.70 1 93 ARG 5.49 -0.60 1 94 ARG 6.15 -2.52 1 95 SER 3.75 2.71 1 96 PHE 1.43 -0.23 1 97 HIS 3.01 0.55 1 98 GLU 2.14 -0.89 1 99 VAL 7.31 -1.05 1 100 ARG 5.96 -1.70 1 101 GLU 3.46 -3.13 1 102 PHE 5.70 0.37 1 103 LYS 2.74 -1.88 1 104 GLN 3.80 -0.41 1 105 LEU 4.17 -2.25 1 106 ILE 5.25 -0.65 1 107 TYR 4.26 -0.59 1 108 ARG 4.32 -1.46 1 109 VAL 3.16 -0.23 1 110 ARG 0.32 0.14 1 111 ARG 4.81 2.59 1 112 THR -0.04 7.07 1 117 VAL -6.95 1.91 1 118 VAL -4.04 4.79 1 119 LEU -4.59 1.89 1 120 VAL -5.80 3.58 1 123 LYS 5.17 -1.17 1 124 SER 3.53 4.72 1 125 ASP -0.12 -0.04 1 126 LEU 1.22 -2.10 1 127 LYS 4.06 -2.46 1 128 GLN 3.46 1.03 1 129 LEU -1.86 -0.49 1 130 ARG 2.23 0.80 1 131 GLN -2.81 2.78 1 132 VAL -3.02 1.45 1 133 THR -0.89 1.90 1 134 LYS 5.11 -1.56 1 135 GLU 4.94 -2.51 1 136 GLU 3.41 -2.92 1 138 LEU 2.49 -3.80 1 139 ALA 3.57 -4.99 1 140 LEU 3.39 -1.69 1 141 ALA 2.61 -4.73 1 142 ARG 4.62 -3.17 1 143 GLU 4.04 -2.29 1 144 PHE -0.01 3.33 1 148 PHE -5.83 4.00 1 149 PHE -5.69 4.11 1 150 GLU -3.33 -1.24 1 151 THR -5.41 3.02 1 152 SER -2.70 2.33 1 153 ALA 3.78 -1.11 1 154 ALA 2.45 -1.98 1 155 TYR 0.07 3.97 1 156 ARG 3.23 2.38 1 157 TYR -2.67 1.32 1 159 ILE 3.14 -0.19 1 160 ASP 4.75 -0.20 1 161 ASP 3.36 -0.49 1 162 VAL 4.71 1.18 1 163 PHE 3.82 -0.85 1 164 HIS 2.07 1.78 1 165 ALA 3.44 -5.03 1 166 LEU 3.49 -2.32 1 167 VAL 6.79 -0.51 1 168 ARG 5.88 -2.45 1 169 GLU 2.29 -1.91 1 170 ILE 5.54 -1.82 1 173 LYS 3.83 -2.41 1 174 GLU 2.13 -1.65 1 175 LYS 2.01 -1.07 1 176 GLU 0.60 0.04 1 177 ALA 0.21 -2.03 1 178 VAL 0.48 1.74 1 stop_ save_