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 bmr4564_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.10 _LACS_plot.Line_1_terminator_val_y_1 -3.40 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.87 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.79 _LACS_plot.Line_2_terminator_val_x_2 8.00 _LACS_plot.Line_2_terminator_val_y_2 6.12 _LACS_plot.Y_axis_chem_shift_offset 0.20 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 168 TYR 0.20 -3.40 0 24 SER -0.20 -0.20 1 25 LYS 0.30 0.00 1 26 LYS -0.10 -0.20 1 27 ARG -0.20 -0.30 1 29 LYS -1.60 -2.10 1 34 TRP 0.00 -0.30 1 35 ASN 0.40 -0.20 1 39 SER 0.00 -0.20 1 40 ARG 0.10 -0.10 1 41 TYR -0.20 -0.40 1 44 GLN 0.30 0.20 1 46 SER 0.10 -0.20 1 50 ASN 0.20 -0.10 1 51 ARG 0.20 0.00 1 55 GLN 0.10 0.10 1 60 TRP 0.00 -0.10 1 62 GLN -1.60 -2.30 1 64 HIS 0.20 0.00 1 68 TRP 0.00 -0.10 1 72 HIS 0.20 0.00 1 76 TRP 0.00 -0.10 1 80 HIS 0.20 0.00 1 84 TRP 0.00 -0.10 1 88 HIS 0.20 0.00 1 92 TRP 0.00 -0.10 1 96 HIS 0.20 0.00 1 101 TRP 0.20 -0.10 1 106 THR 0.30 -0.10 1 107 HIS 0.50 0.20 1 109 GLN 0.30 0.00 1 110 TRP -0.20 -0.50 1 111 ASN -0.40 -0.70 1 112 LYS 0.20 -0.10 1 114 SER -0.50 -0.50 1 115 LYS 0.00 -0.10 1 117 LYS 0.30 0.00 1 118 THR -0.20 -0.60 1 119 ASN 0.10 -0.20 1 120 MET 0.20 -0.20 1 121 LYS 0.10 -0.10 1 122 HIS 0.20 0.10 1 123 VAL -0.50 -0.50 1 124 ALA -0.30 -0.10 1 126 ALA -0.30 -0.20 1 127 ALA -0.20 -0.20 1 128 ALA -0.10 -0.30 1 129 ALA 0.00 0.00 1 131 ALA -0.70 -0.40 1 132 VAL 0.30 -0.20 1 133 VAL 0.70 0.10 1 136 LEU -0.40 -0.60 1 139 TYR -1.00 0.10 1 140 MET -3.40 -2.10 1 141 LEU -3.10 -2.00 1 143 SER -0.10 -0.10 1 144 ALA 1.10 0.20 1 145 MET -6.00 -1.90 1 146 SER 1.00 0.10 1 147 ARG 1.40 0.60 1 149 LEU 1.10 -0.70 1 150 ILE -2.50 -2.00 1 151 HIS -1.50 -1.20 1 152 PHE -0.10 1.40 1 154 SER -3.80 -1.90 1 155 ASP 3.80 3.10 1 156 TYR 4.20 3.30 1 157 GLU 3.00 2.90 1 158 ASP 5.00 4.00 1 159 ARG 4.70 3.40 1 160 TYR 4.80 4.10 1 161 TYR 5.50 4.80 1 162 ARG 5.10 3.80 1 163 GLU 1.70 1.20 1 164 ASN -0.30 1.70 1 165 MET 6.50 3.70 1 166 HIS 4.40 2.50 1 167 ARG 0.40 0.00 1 170 ASN -0.60 -1.40 1 171 GLN -6.10 -1.90 1 172 VAL -4.80 -3.90 1 173 TYR -3.90 -1.00 1 174 TYR -3.50 -2.20 1 175 ARG -0.00 -0.70 1 177 VAL 3.80 2.80 1 178 ASP 1.20 -0.40 1 179 GLN 2.40 0.20 1 180 TYR -3.60 -1.10 1 181 SER 0.80 0.80 1 182 ASN -2.00 -1.00 1 183 GLN 3.30 3.10 1 184 ASN 4.40 3.00 1 185 ASN 3.80 2.80 1 187 VAL 6.40 5.10 1 188 HIS 5.10 4.10 1 189 ASP 2.70 2.70 1 191 VAL 5.00 3.90 1 192 ASN 3.80 3.30 1 193 ILE 3.00 0.70 1 194 THR 8.00 6.50 1 195 VAL 7.20 5.50 1 196 LYS 4.70 3.60 1 197 GLU 3.70 1.60 1 198 HIS 2.30 3.60 1 199 THR 3.80 3.00 1 200 VAL 3.50 2.60 1 201 THR 2.60 2.10 1 202 THR 3.10 2.00 1 203 THR 2.80 2.10 1 204 THR 2.40 1.60 1 205 LYS 0.70 -0.10 1 207 GLU -1.60 -1.10 1 208 ASN -1.60 -0.50 1 209 PHE -1.50 -1.10 1 210 THR -3.60 -1.60 1 211 GLU 4.40 3.00 1 212 THR 6.30 4.90 1 213 ASP 3.00 3.60 1 214 ILE 5.90 3.60 1 215 LYS 4.40 3.10 1 216 MET 4.90 4.40 1 217 MET 3.60 4.10 1 218 GLU 5.70 3.80 1 219 ARG 3.60 2.40 1 220 VAL 4.40 3.40 1 221 VAL 6.20 4.10 1 222 GLU 5.50 4.30 1 223 GLN 4.70 2.90 1 224 MET 3.10 4.20 1 226 ILE 6.20 5.50 1 227 THR 6.70 5.00 1 228 GLN 4.20 2.80 1 229 TYR 5.50 3.70 1 230 GLN 5.30 3.20 1 231 ARG 3.50 2.80 1 232 GLU 1.20 0.70 1 233 SER 3.80 2.40 1 234 GLN 3.40 2.00 1 235 ALA 1.80 1.00 1 236 TYR 1.90 1.70 1 237 TYR 1.50 0.80 1 238 GLN 0.90 0.20 1 239 ARG 0.40 0.00 1 241 ALA 0.10 0.90 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4564_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.10 _LACS_plot.Line_1_terminator_val_y_1 2.70 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.13 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.21 _LACS_plot.Line_2_terminator_val_x_2 8.00 _LACS_plot.Line_2_terminator_val_y_2 -1.88 _LACS_plot.Y_axis_chem_shift_offset 0.20 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 168 TYR 0.20 -3.60 0 24 SER -0.20 0.00 1 25 LYS 0.30 -0.30 1 26 LYS -0.10 -0.10 1 27 ARG -0.20 -0.10 1 29 LYS -1.60 -0.50 1 34 TRP 0.00 -0.30 1 35 ASN 0.40 -0.60 1 39 SER 0.00 -0.20 1 40 ARG 0.10 -0.20 1 41 TYR -0.20 -0.20 1 44 GLN 0.30 -0.10 1 46 SER 0.10 -0.30 1 50 ASN 0.20 -0.30 1 51 ARG 0.20 -0.20 1 55 GLN 0.10 0.00 1 60 TRP 0.00 -0.10 1 62 GLN -1.60 -0.70 1 64 HIS 0.20 -0.20 1 68 TRP 0.00 -0.10 1 72 HIS 0.20 -0.20 1 76 TRP 0.00 -0.10 1 80 HIS 0.20 -0.20 1 84 TRP 0.00 -0.10 1 88 HIS 0.20 -0.20 1 92 TRP 0.00 -0.10 1 96 HIS 0.20 -0.20 1 101 TRP 0.20 -0.30 1 106 THR 0.30 -0.40 1 107 HIS 0.50 -0.30 1 109 GLN 0.30 -0.30 1 110 TRP -0.20 -0.30 1 111 ASN -0.40 -0.30 1 112 LYS 0.20 -0.30 1 114 SER -0.50 0.00 1 115 LYS 0.00 -0.10 1 117 LYS 0.30 -0.30 1 118 THR -0.20 -0.40 1 119 ASN 0.10 -0.30 1 120 MET 0.20 -0.40 1 121 LYS 0.10 -0.20 1 122 HIS 0.20 -0.10 1 123 VAL -0.50 0.00 1 124 ALA -0.30 0.20 1 126 ALA -0.30 0.10 1 127 ALA -0.20 0.00 1 128 ALA -0.10 -0.20 1 129 ALA 0.00 0.00 1 131 ALA -0.70 0.30 1 132 VAL 0.30 -0.50 1 133 VAL 0.70 -0.60 1 136 LEU -0.40 -0.20 1 139 TYR -1.00 1.10 1 140 MET -3.40 1.30 1 141 LEU -3.10 1.10 1 143 SER -0.10 0.00 1 144 ALA 1.10 -0.90 1 145 MET -6.00 4.10 1 146 SER 1.00 -0.90 1 147 ARG 1.40 -0.80 1 149 LEU 1.10 -1.80 1 150 ILE -2.50 0.50 1 151 HIS -1.50 0.30 1 152 PHE -0.10 1.50 1 154 SER -3.80 1.90 1 155 ASP 3.80 -0.70 1 156 TYR 4.20 -0.90 1 157 GLU 3.00 -0.10 1 158 ASP 5.00 -1.00 1 159 ARG 4.70 -1.30 1 160 TYR 4.80 -0.70 1 161 TYR 5.50 -0.70 1 162 ARG 5.10 -1.30 1 163 GLU 1.70 -0.50 1 164 ASN -0.30 2.00 1 165 MET 6.50 -2.80 1 166 HIS 4.40 -1.90 1 167 ARG 0.40 -0.40 1 170 ASN -0.60 -0.80 1 171 GLN -6.10 4.20 1 172 VAL -4.80 0.90 1 173 TYR -3.90 2.90 1 174 TYR -3.50 1.30 1 175 ARG -0.00 -0.70 1 177 VAL 3.80 -1.00 1 178 ASP 1.20 -1.60 1 179 GLN 2.40 -2.20 1 180 TYR -3.60 2.50 1 181 SER 0.80 0.00 1 182 ASN -2.00 1.00 1 183 GLN 3.30 -0.20 1 184 ASN 4.40 -1.40 1 185 ASN 3.80 -1.00 1 187 VAL 6.40 -1.30 1 188 HIS 5.10 -1.00 1 189 ASP 2.70 0.00 1 191 VAL 5.00 -1.10 1 192 ASN 3.80 -0.50 1 193 ILE 3.00 -2.30 1 194 THR 8.00 -1.50 1 195 VAL 7.20 -1.70 1 196 LYS 4.70 -1.10 1 197 GLU 3.70 -2.10 1 198 HIS 2.30 1.30 1 199 THR 3.80 -0.80 1 200 VAL 3.50 -0.90 1 201 THR 2.60 -0.50 1 202 THR 3.10 -1.10 1 203 THR 2.80 -0.70 1 204 THR 2.40 -0.80 1 205 LYS 0.70 -0.80 1 207 GLU -1.60 0.50 1 208 ASN -1.60 1.10 1 209 PHE -1.50 0.40 1 210 THR -3.60 2.00 1 211 GLU 4.40 -1.40 1 212 THR 6.30 -1.40 1 213 ASP 3.00 0.60 1 214 ILE 5.90 -2.30 1 215 LYS 4.40 -1.30 1 216 MET 4.90 -0.50 1 217 MET 3.60 0.50 1 218 GLU 5.70 -1.90 1 219 ARG 3.60 -1.20 1 220 VAL 4.40 -1.00 1 221 VAL 6.20 -2.10 1 222 GLU 5.50 -1.20 1 223 GLN 4.70 -1.80 1 224 MET 3.10 1.10 1 226 ILE 6.20 -0.70 1 227 THR 6.70 -1.70 1 228 GLN 4.20 -1.40 1 229 TYR 5.50 -1.80 1 230 GLN 5.30 -2.10 1 231 ARG 3.50 -0.70 1 232 GLU 1.20 -0.50 1 233 SER 3.80 -1.40 1 234 GLN 3.40 -1.40 1 235 ALA 1.80 -0.80 1 236 TYR 1.90 -0.20 1 237 TYR 1.50 -0.70 1 238 GLN 0.90 -0.70 1 239 ARG 0.40 -0.40 1 241 ALA 0.10 0.80 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4564_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.10 _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 -0.21 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.08 _LACS_plot.Line_2_terminator_val_x_2 8.00 _LACS_plot.Line_2_terminator_val_y_2 -0.66 _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 229 TYR 5.50 -1.68 0 183 GLN 3.30 -1.55 0 24 SER -0.20 0.04 1 25 LYS 0.30 0.02 1 26 LYS -0.10 -0.01 1 27 ARG -0.20 -0.07 1 29 LYS -1.60 0.18 1 34 TRP 0.00 -0.04 1 35 ASN 0.40 -0.09 1 39 SER 0.00 -0.08 1 40 ARG 0.10 -0.07 1 41 TYR -0.20 -0.03 1 44 GLN 0.30 -0.05 1 46 SER 0.10 -0.06 1 50 ASN 0.20 -0.12 1 51 ARG 0.20 -0.13 1 55 GLN 0.10 -0.09 1 60 TRP 0.00 -0.12 1 62 GLN -1.60 0.16 1 64 HIS 0.20 -0.11 1 68 TRP 0.00 -0.12 1 72 HIS 0.20 -0.11 1 76 TRP 0.00 -0.12 1 80 HIS 0.20 -0.11 1 84 TRP 0.00 -0.12 1 88 HIS 0.20 -0.11 1 92 TRP 0.00 -0.12 1 96 HIS 0.20 -0.11 1 101 TRP 0.20 -0.10 1 106 THR 0.30 -0.10 1 107 HIS 0.50 -0.09 1 109 GLN 0.30 -0.08 1 110 TRP -0.20 -0.04 1 111 ASN -0.40 -0.17 1 112 LYS 0.20 -0.24 1 114 SER -0.50 -0.06 1 115 LYS 0.00 -0.03 1 117 LYS 0.30 0.03 1 118 THR -0.20 -0.02 1 119 ASN 0.10 -0.06 1 120 MET 0.20 -0.07 1 121 LYS 0.10 -0.07 1 122 HIS 0.20 -0.09 1 123 VAL -0.50 -0.02 1 124 ALA -0.30 -0.03 1 126 ALA -0.30 -0.02 1 127 ALA -0.20 -0.04 1 128 ALA -0.10 -0.07 1 129 ALA 0.00 -0.04 1 131 ALA -0.70 0.01 1 132 VAL 0.30 0.00 1 133 VAL 0.70 -0.07 1 136 LEU -0.40 -0.02 1 139 TYR -1.00 -0.14 1 140 MET -3.40 0.01 1 141 LEU -3.10 0.13 1 143 SER -0.10 -0.10 1 144 ALA 1.10 0.10 1 145 MET -6.00 0.24 1 146 SER 1.00 -0.16 1 147 ARG 1.40 -0.27 1 149 LEU 1.10 0.15 1 150 ILE -2.50 -0.31 1 151 HIS -1.50 0.16 1 152 PHE -0.10 -0.30 1 154 SER -3.80 0.30 1 155 ASP 3.80 -0.17 1 156 TYR 4.20 -0.39 1 157 GLU 3.00 -0.79 1 158 ASP 5.00 0.00 1 159 ARG 4.70 -0.37 1 160 TYR 4.80 -0.75 1 161 TYR 5.50 -0.46 1 162 ARG 5.10 -0.48 1 163 GLU 1.70 -0.31 1 164 ASN -0.30 -0.49 1 165 MET 6.50 -1.08 1 166 HIS 4.40 -0.55 1 167 ARG 0.40 -0.22 1 168 TYR 0.20 0.13 1 170 ASN -0.60 -0.09 1 171 GLN -6.10 0.16 1 172 VAL -4.80 0.78 1 173 TYR -3.90 1.00 1 174 TYR -3.50 0.28 1 175 ARG -0.00 -0.07 1 177 VAL 3.80 0.09 1 178 ASP 1.20 -0.25 1 179 GLN 2.40 -0.29 1 180 TYR -3.60 0.33 1 181 SER 0.80 0.04 1 182 ASN -2.00 -0.01 1 184 ASN 4.40 -0.55 1 185 ASN 3.80 -0.20 1 187 VAL 6.40 -0.70 1 188 HIS 5.10 -0.45 1 189 ASP 2.70 -0.10 1 191 VAL 5.00 -0.46 1 192 ASN 3.80 -0.47 1 193 ILE 3.00 -0.44 1 194 THR 8.00 -0.29 1 195 VAL 7.20 -0.57 1 196 LYS 4.70 -0.32 1 197 GLU 3.70 -0.35 1 198 HIS 2.30 -0.17 1 199 THR 3.80 -0.15 1 200 VAL 3.50 -0.12 1 201 THR 2.60 -0.13 1 202 THR 3.10 -0.17 1 203 THR 2.80 0.03 1 204 THR 2.40 -0.13 1 205 LYS 0.70 -0.02 1 207 GLU -1.60 -0.13 1 208 ASN -1.60 -0.09 1 209 PHE -1.50 0.63 1 210 THR -3.60 0.24 1 211 GLU 4.40 -0.31 1 212 THR 6.30 -0.58 1 213 ASP 3.00 -0.07 1 214 ILE 5.90 -0.81 1 215 LYS 4.40 -0.29 1 216 MET 4.90 -0.38 1 217 MET 3.60 -0.98 1 218 GLU 5.70 -0.75 1 219 ARG 3.60 -0.17 1 220 VAL 4.40 -0.32 1 221 VAL 6.20 -0.50 1 222 GLU 5.50 -0.80 1 223 GLN 4.70 -0.40 1 224 MET 3.10 -0.35 1 226 ILE 6.20 -0.70 1 227 THR 6.70 -0.48 1 228 GLN 4.20 -0.76 1 230 GLN 5.30 -0.65 1 231 ARG 3.50 -0.41 1 232 GLU 1.20 -0.33 1 233 SER 3.80 -0.53 1 234 GLN 3.40 -0.25 1 235 ALA 1.80 -0.19 1 236 TYR 1.90 -0.35 1 237 TYR 1.50 -0.21 1 238 GLN 0.90 -0.15 1 239 ARG 0.40 -0.11 1 241 ALA 0.10 -0.23 1 stop_ save_