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 bmr16395_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.97 _LACS_plot.Line_1_terminator_val_y_1 -3.60 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.01 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -2.25 _LACS_plot.Line_2_terminator_val_x_2 9.78 _LACS_plot.Line_2_terminator_val_y_2 6.41 _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 162 LYS 4.99 -1.85 0 10 THR 4.15 3.01 1 12 LEU -0.66 -1.44 1 13 ARG -4.16 -2.31 1 14 PHE -7.97 -3.31 1 15 ILE -3.26 -2.95 1 16 ASP -3.81 -2.58 1 17 LEU 0.03 -1.56 1 18 PHE 5.21 0.38 1 19 ALA 3.81 3.87 1 21 LEU -0.74 -0.44 1 24 PHE 6.30 3.96 1 25 ARG 5.23 2.43 1 26 LEU 2.97 2.32 1 27 ALA 2.37 2.02 1 33 ALA -1.68 -0.94 1 34 GLU -5.17 -2.65 1 36 VAL -1.22 -2.22 1 37 TYR 0.26 1.35 1 38 SER -4.57 -2.12 1 39 ASN -4.92 0.05 1 40 GLU -2.88 -0.85 1 41 TRP -1.88 -2.38 1 42 ASP -1.44 0.06 1 43 LYS 4.10 2.30 1 44 TYR 4.92 1.43 1 45 ALA 4.77 1.75 1 46 GLN 5.85 3.69 1 47 GLU 3.05 2.40 1 48 VAL 2.74 1.80 1 49 TYR 4.59 4.30 1 50 GLU 4.04 2.84 1 51 MET 3.12 3.21 1 52 ASN 0.77 2.42 1 53 PHE 0.26 -0.06 1 55 GLU -5.92 -3.27 1 56 LYS -1.53 -1.38 1 58 GLU 0.08 -0.57 1 60 ASP -0.87 -0.18 1 61 ILE 2.07 -0.25 1 62 THR 3.10 1.98 1 63 GLN -1.47 -2.04 1 64 VAL 0.29 -0.38 1 65 ASN 1.00 -0.05 1 66 GLU 4.07 1.77 1 67 LYS 4.04 2.30 1 68 THR 0.17 -0.42 1 69 ILE 0.88 -1.09 1 71 ASP 2.37 0.65 1 72 HIS 0.11 0.74 1 73 ASP -2.16 1.75 1 77 ALA -2.64 0.32 1 79 PHE -0.12 -3.62 1 82 GLN 6.58 5.02 1 83 ALA 1.30 -0.35 1 84 PHE -3.86 -1.90 1 85 SER 0.35 -0.67 1 86 ILE 0.74 0.57 1 87 SER -1.76 -2.01 1 90 GLN 3.88 1.55 1 91 LYS 3.15 0.86 1 93 PHE 2.32 0.21 1 94 GLU 0.50 -0.48 1 95 ASP -5.92 -2.08 1 97 ARG 2.03 -0.98 1 99 THR 0.86 -0.17 1 100 LEU 3.03 -0.05 1 101 PHE 4.09 2.71 1 102 PHE 6.69 2.70 1 103 ASP 4.39 3.83 1 104 ILE 7.66 4.64 1 105 ALA 5.03 2.34 1 106 ARG 4.08 2.41 1 119 GLU -4.94 -3.43 1 120 ASN -1.85 0.00 1 121 VAL 0.15 -0.83 1 122 LYS 5.85 4.20 1 123 ASN 1.91 2.05 1 124 PHE 3.45 4.29 1 125 ALA 2.26 1.14 1 126 SER -1.40 -1.22 1 127 HIS 2.02 4.22 1 128 ASP 2.11 -0.33 1 129 ASN 2.84 1.12 1 131 ASN 3.46 2.57 1 133 LEU 3.97 1.84 1 134 GLU 3.73 2.27 1 135 VAL 6.25 3.97 1 136 VAL 6.50 3.36 1 137 LYS 5.14 3.08 1 138 ASN 4.25 2.64 1 139 THR 6.86 5.13 1 145 TYR -3.00 -0.75 1 146 SER -2.24 -1.66 1 147 PHE -1.96 0.73 1 148 HIS -2.72 -0.91 1 149 ALA -5.32 -2.18 1 150 LYS -2.00 -0.38 1 151 VAL 1.33 -1.34 1 152 LEU -3.44 -2.22 1 153 ASN -3.01 -2.25 1 154 ALA 4.99 3.46 1 155 LEU 3.57 1.17 1 156 ASP -0.25 0.65 1 157 TYR -0.16 -0.90 1 159 ILE -6.56 -6.61 1 161 GLN -3.35 -1.64 1 163 ARG 0.20 -0.99 1 164 GLU -1.68 -0.66 1 165 ARG -5.37 -4.25 1 172 ARG 2.76 1.62 1 173 ASN 4.49 2.86 1 174 ASP 3.48 0.66 1 175 LEU 1.52 -0.05 1 176 ASN 2.29 0.21 1 177 ILE 2.90 -1.69 1 178 GLN -0.79 -0.56 1 179 ASN -0.88 -0.84 1 180 PHE 1.66 0.94 1 181 GLN -4.16 -3.08 1 182 PHE 4.14 2.24 1 184 LYS 1.11 0.08 1 186 PHE -2.97 -2.64 1 187 GLU 0.57 0.42 1 188 LEU 1.70 0.03 1 189 ASN -1.97 -1.02 1 190 THR -1.75 -0.40 1 191 PHE -1.21 -0.40 1 192 VAL 9.78 6.59 1 193 LYS 4.71 1.14 1 194 ASP 1.75 2.12 1 195 LEU -0.56 -1.52 1 196 LEU 1.42 -0.65 1 197 LEU 0.93 -0.33 1 199 ASP 3.82 2.54 1 200 SER 4.11 2.03 1 201 GLU -0.83 -0.19 1 202 VAL -1.47 -2.11 1 203 GLU 3.26 2.25 1 204 HIS 2.62 2.24 1 205 LEU 0.39 -1.22 1 206 VAL 2.49 1.03 1 207 ILE -3.06 -2.21 1 208 ASP -2.08 -2.09 1 209 ARG -2.38 -3.41 1 210 LYS 2.67 0.40 1 211 ASP 1.08 -1.98 1 212 LEU 1.40 0.34 1 213 VAL -1.27 -0.87 1 214 MET 1.23 -2.22 1 215 THR 1.09 -0.11 1 216 ASN -4.42 -1.36 1 217 GLN -1.31 -1.34 1 218 GLU 0.02 -1.04 1 219 ILE -0.96 -0.96 1 220 GLU -0.01 0.14 1 221 GLN -2.24 -2.11 1 222 THR -0.70 -2.15 1 223 THR -3.85 -1.67 1 225 LYS 0.34 -1.03 1 226 THR -1.15 -1.30 1 227 VAL 1.26 -0.05 1 228 ARG -1.66 -0.82 1 229 LEU -6.50 -2.25 1 231 ILE -4.14 -4.03 1 232 VAL 0.99 -0.72 1 234 LYS 2.48 2.79 1 237 GLN -0.01 -2.62 1 239 GLU -4.42 -1.54 1 240 ARG -1.97 -2.53 1 241 ILE -2.71 -0.63 1 242 TYR -0.11 -1.00 1 243 SER 2.61 1.18 1 244 THR 3.47 1.12 1 245 ARG -2.67 -3.11 1 247 ILE -0.62 -1.63 1 248 ALA 1.03 -0.43 1 249 ILE 2.06 1.73 1 250 THR 2.64 0.24 1 251 LEU -3.93 -2.82 1 252 SER -2.63 1.10 1 253 ALA 0.26 -1.60 1 254 TYR 0.42 -0.58 1 258 ILE 2.45 -2.35 1 259 PHE 0.59 0.90 1 260 ALA 8.81 4.74 1 261 LYS -0.58 -0.71 1 262 THR -3.88 -1.39 1 265 TYR -1.53 -2.02 1 266 LEU -0.67 -1.32 1 267 VAL 2.56 0.61 1 268 ASN -3.48 -2.48 1 270 LYS -3.80 -4.13 1 271 THR -6.37 -2.50 1 272 ARG -1.17 -0.95 1 273 LYS -0.91 -1.59 1 274 LEU -2.31 2.04 1 275 HIS 4.45 0.56 1 277 ARG 3.18 2.00 1 278 GLU 4.19 1.91 1 280 ALA 4.37 3.95 1 281 ARG 4.01 1.52 1 282 VAL -0.36 -2.60 1 283 MET 3.37 1.34 1 285 TYR 4.09 1.56 1 287 ASP 1.07 -0.36 1 288 SER 1.14 1.28 1 289 TYR 1.12 -0.24 1 290 LYS -1.13 -2.12 1 291 VAL 2.76 4.69 1 292 HIS 0.77 -2.20 1 294 SER 6.17 3.82 1 295 THR 4.71 0.95 1 297 GLN 4.63 2.52 1 298 ALA 3.53 3.00 1 299 TYR 2.89 2.66 1 300 LYS 5.75 1.81 1 301 GLN 8.57 6.17 1 302 PHE -3.38 -0.51 1 304 ASN -2.63 -1.95 1 305 SER -6.62 -5.56 1 306 VAL 0.87 -2.22 1 307 VAL 6.13 2.56 1 308 ILE 6.93 3.75 1 309 ASN 5.72 4.00 1 310 VAL 3.70 2.51 1 311 LEU 4.01 4.71 1 312 GLN 5.32 3.50 1 313 TYR 6.60 5.05 1 314 ILE 4.24 2.32 1 315 ALA 5.63 4.38 1 316 TYR 5.10 2.30 1 317 ASN 7.29 5.35 1 318 ILE 4.45 2.68 1 320 SER 2.52 1.33 1 322 LEU 1.10 0.34 1 323 ASN 2.27 0.88 1 324 LEU 0.72 -0.16 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16395_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.97 _LACS_plot.Line_1_terminator_val_y_1 4.37 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.99 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.25 _LACS_plot.Line_2_terminator_val_x_2 9.78 _LACS_plot.Line_2_terminator_val_y_2 -3.37 _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 162 LYS 4.99 -6.84 0 10 THR 4.15 -1.14 1 12 LEU -0.66 -0.78 1 13 ARG -4.16 1.85 1 14 PHE -7.97 4.66 1 15 ILE -3.26 0.31 1 16 ASP -3.81 1.23 1 17 LEU 0.03 -1.59 1 18 PHE 5.21 -4.83 1 19 ALA 3.81 0.06 1 21 LEU -0.74 0.30 1 24 PHE 6.30 -2.34 1 25 ARG 5.23 -2.80 1 26 LEU 2.97 -0.65 1 27 ALA 2.37 -0.35 1 33 ALA -1.68 0.74 1 34 GLU -5.17 2.52 1 36 VAL -1.22 -1.00 1 37 TYR 0.26 1.09 1 38 SER -4.57 2.45 1 39 ASN -4.92 4.97 1 40 GLU -2.88 2.03 1 41 TRP -1.88 -0.50 1 42 ASP -1.44 1.50 1 43 LYS 4.10 -1.80 1 44 TYR 4.92 -3.49 1 45 ALA 4.77 -3.02 1 46 GLN 5.85 -2.16 1 47 GLU 3.05 -0.65 1 48 VAL 2.74 -0.94 1 49 TYR 4.59 -0.29 1 50 GLU 4.04 -1.20 1 51 MET 3.12 0.09 1 52 ASN 0.77 1.65 1 53 PHE 0.26 -0.32 1 55 GLU -5.92 2.65 1 56 LYS -1.53 0.15 1 58 GLU 0.08 -0.65 1 60 ASP -0.87 0.69 1 61 ILE 2.07 -2.32 1 62 THR 3.10 -1.12 1 63 GLN -1.47 -0.57 1 64 VAL 0.29 -0.67 1 65 ASN 1.00 -1.05 1 66 GLU 4.07 -2.30 1 67 LYS 4.04 -1.74 1 68 THR 0.17 -0.59 1 69 ILE 0.88 -1.97 1 71 ASP 2.37 -1.72 1 72 HIS 0.11 0.63 1 73 ASP -2.16 3.91 1 77 ALA -2.64 2.96 1 79 PHE -0.12 -3.50 1 82 GLN 6.58 -1.56 1 83 ALA 1.30 -1.65 1 84 PHE -3.86 1.96 1 85 SER 0.35 -1.02 1 86 ILE 0.74 -0.17 1 87 SER -1.76 -0.25 1 90 GLN 3.88 -2.33 1 91 LYS 3.15 -2.29 1 93 PHE 2.32 -2.11 1 94 GLU 0.50 -0.98 1 95 ASP -5.92 3.84 1 97 ARG 2.03 -3.01 1 99 THR 0.86 -1.03 1 100 LEU 3.03 -3.08 1 101 PHE 4.09 -1.38 1 102 PHE 6.69 -3.99 1 103 ASP 4.39 -0.56 1 104 ILE 7.66 -3.02 1 105 ALA 5.03 -2.69 1 106 ARG 4.08 -1.67 1 119 GLU -4.94 1.51 1 120 ASN -1.85 1.85 1 121 VAL 0.15 -0.98 1 122 LYS 5.85 -1.65 1 123 ASN 1.91 0.14 1 124 PHE 3.45 0.84 1 125 ALA 2.26 -1.12 1 126 SER -1.40 0.18 1 127 HIS 2.02 2.20 1 128 ASP 2.11 -2.44 1 129 ASN 2.84 -1.72 1 131 ASN 3.46 -0.89 1 133 LEU 3.97 -2.13 1 134 GLU 3.73 -1.46 1 135 VAL 6.25 -2.28 1 136 VAL 6.50 -3.14 1 137 LYS 5.14 -2.06 1 138 ASN 4.25 -1.61 1 139 THR 6.86 -1.73 1 145 TYR -3.00 2.25 1 146 SER -2.24 0.58 1 147 PHE -1.96 2.69 1 148 HIS -2.72 1.81 1 149 ALA -5.32 3.14 1 150 LYS -2.00 1.62 1 151 VAL 1.33 -2.67 1 152 LEU -3.44 1.22 1 153 ASN -3.01 0.76 1 154 ALA 4.99 -1.53 1 155 LEU 3.57 -2.40 1 156 ASP -0.25 0.90 1 157 TYR -0.16 -0.74 1 159 ILE -6.56 -0.05 1 161 GLN -3.35 1.71 1 163 ARG 0.20 -1.19 1 164 GLU -1.68 1.02 1 165 ARG -5.37 1.12 1 172 ARG 2.76 -1.14 1 173 ASN 4.49 -1.63 1 174 ASP 3.48 -2.82 1 175 LEU 1.52 -1.57 1 176 ASN 2.29 -2.08 1 177 ILE 2.90 -4.59 1 178 GLN -0.79 0.23 1 179 ASN -0.88 0.04 1 180 PHE 1.66 -0.72 1 181 GLN -4.16 1.08 1 182 PHE 4.14 -1.90 1 184 LYS 1.11 -1.03 1 186 PHE -2.97 0.33 1 187 GLU 0.57 -0.15 1 188 LEU 1.70 -1.67 1 189 ASN -1.97 0.95 1 190 THR -1.75 1.35 1 191 PHE -1.21 0.81 1 192 VAL 9.78 -3.19 1 193 LYS 4.71 -3.57 1 194 ASP 1.75 0.37 1 195 LEU -0.56 -0.96 1 196 LEU 1.42 -2.07 1 197 LEU 0.93 -1.26 1 199 ASP 3.82 -1.28 1 200 SER 4.11 -2.08 1 201 GLU -0.83 0.64 1 202 VAL -1.47 -0.64 1 203 GLU 3.26 -1.01 1 204 HIS 2.62 -0.38 1 205 LEU 0.39 -1.61 1 206 VAL 2.49 -1.46 1 207 ILE -3.06 0.85 1 208 ASP -2.08 -0.01 1 209 ARG -2.38 -1.03 1 210 LYS 2.67 -2.27 1 211 ASP 1.08 -3.06 1 212 LEU 1.40 -1.06 1 213 VAL -1.27 0.40 1 214 MET 1.23 -3.45 1 215 THR 1.09 -1.20 1 216 ASN -4.42 3.06 1 217 GLN -1.31 -0.03 1 218 GLU 0.02 -1.06 1 219 ILE -0.96 0.00 1 220 GLU -0.01 0.15 1 221 GLN -2.24 0.13 1 222 THR -0.70 -1.45 1 223 THR -3.85 2.18 1 225 LYS 0.34 -1.37 1 226 THR -1.15 -0.15 1 227 VAL 1.26 -1.31 1 228 ARG -1.66 0.84 1 229 LEU -6.50 4.25 1 231 ILE -4.14 0.11 1 232 VAL 0.99 -1.71 1 234 LYS 2.48 0.31 1 237 GLN -0.01 -2.61 1 239 GLU -4.42 2.88 1 240 ARG -1.97 -0.56 1 241 ILE -2.71 2.08 1 242 TYR -0.11 -0.89 1 243 SER 2.61 -1.43 1 244 THR 3.47 -2.35 1 245 ARG -2.67 -0.44 1 247 ILE -0.62 -1.01 1 248 ALA 1.03 -1.46 1 249 ILE 2.06 -0.33 1 250 THR 2.64 -2.40 1 251 LEU -3.93 1.11 1 252 SER -2.63 3.73 1 253 ALA 0.26 -1.86 1 254 TYR 0.42 -1.00 1 258 ILE 2.45 -4.80 1 259 PHE 0.59 0.31 1 260 ALA 8.81 -4.07 1 261 LYS -0.58 -0.13 1 262 THR -3.88 2.49 1 265 TYR -1.53 -0.49 1 266 LEU -0.67 -0.65 1 267 VAL 2.56 -1.95 1 268 ASN -3.48 1.00 1 270 LYS -3.80 -0.33 1 271 THR -6.37 3.87 1 272 ARG -1.17 0.22 1 273 LYS -0.91 -0.68 1 274 LEU -2.31 4.35 1 275 HIS 4.45 -3.89 1 277 ARG 3.18 -1.18 1 278 GLU 4.19 -2.28 1 280 ALA 4.37 -0.42 1 281 ARG 4.01 -2.49 1 282 VAL -0.36 -2.24 1 283 MET 3.37 -2.03 1 285 TYR 4.09 -2.53 1 287 ASP 1.07 -1.43 1 288 SER 1.14 0.14 1 289 TYR 1.12 -1.36 1 290 LYS -1.13 -0.99 1 291 VAL 2.76 1.93 1 292 HIS 0.77 -2.97 1 294 SER 6.17 -2.35 1 295 THR 4.71 -3.76 1 297 GLN 4.63 -2.11 1 298 ALA 3.53 -0.53 1 299 TYR 2.89 -0.23 1 300 LYS 5.75 -3.94 1 301 GLN 8.57 -2.40 1 302 PHE -3.38 2.87 1 304 ASN -2.63 0.68 1 305 SER -6.62 1.06 1 306 VAL 0.87 -3.09 1 307 VAL 6.13 -3.57 1 308 ILE 6.93 -3.18 1 309 ASN 5.72 -1.72 1 310 VAL 3.70 -1.19 1 311 LEU 4.01 0.70 1 312 GLN 5.32 -1.82 1 313 TYR 6.60 -1.55 1 314 ILE 4.24 -1.92 1 315 ALA 5.63 -1.25 1 316 TYR 5.10 -2.80 1 317 ASN 7.29 -1.94 1 318 ILE 4.45 -1.77 1 320 SER 2.52 -1.19 1 322 LEU 1.10 -0.76 1 323 ASN 2.27 -1.39 1 324 LEU 0.72 -0.88 1 stop_ save_