| Chain sequence(s) |
A: KRNPDAGVATAVQSVIQHQTFKRMLLFGLRSLADFCSPSNQLYQENALDALDRGVLSAIQTAVTTFSDDDDLMLCASRVLWAMSVAIKEEMDPAHIARVHSEGSPVIVAVVNSSPTDPQTIEDSMNFVDNLKRAGAPVDGASLAGGMLSIFTKTALDMKTAKRVTAALAIAAETAEGSTALYNAGGTSVLLTYCLDQGDLSDAGVEMVEGAFDTVRYMAGYQCTDATTLPQCIALMDKYRGRKSASAKGSSALAAMIGPEQLQKCLNTLKTAEAGSAEYDEALVTLGSMSYISSFTDEIVRAGGVPLLIELINSGLPQMEGNPEKIASMISGAAKMLARIASNPVNVDAIVQAGGVATLCTAVSYCTESMEALGALCMALVPLASRESLAHEIVQYQTFATVLPILYQNVESPEIAALAMELVATGSQHEEIQEHMLQNQAAEICSLCCQYHTADASYQQHAISALNRLVPRLTTLHGVSEYGGIQGVIASLNANVNNEQVALL
input PDB |
| Selected Chain(s) | A |
| Distance of aggregation | 10 Å |
| FoldX usage | Yes |
| Dynamic mode | No |
| Automated mutations | No |
| Downloads | Download all the data |
| Simulation log |
[INFO] Logger: Verbosity set to: 2 - [INFO] (00:00:00)
[WARNING] runJob: Working directory already exists (possibly overwriting previous results -ow
to prevent this behavior) (00:00:00)
[INFO] runJob: Starting aggrescan3d job on: input.pdb with A chain(s) selected (00:00:00)
[INFO] runJob: Creating pdb object from: input.pdb (00:00:00)
[INFO] FoldX: Starting FoldX energy minimalization (00:00:01)
[INFO] Analysis: Starting Aggrescan3D on folded.pdb (00:05:40)
[INFO] Main: Simulation completed successfully. (00:05:44)
|
The table below lists A3D score for protein residues. Residues with A3D score > 0.0000 are marked by yellow rows.
| residue index | residue name | chain | Aggrescan3D score | mutation |
|---|---|---|---|---|
| residue index | residue name | chain | Aggrescan3D score | |
| 7 | K | A | -2.9115 | |
| 8 | R | A | -3.5192 | |
| 9 | N | A | -2.7344 | |
| 10 | P | A | -1.6815 | |
| 11 | D | A | -1.1251 | |
| 12 | A | A | -0.4736 | |
| 13 | G | A | -0.3823 | |
| 14 | V | A | 0.0000 | |
| 15 | A | A | -0.7971 | |
| 16 | T | A | -0.5347 | |
| 17 | A | A | 0.0000 | |
| 18 | V | A | 0.0000 | |
| 19 | Q | A | -1.5710 | |
| 20 | S | A | -0.5429 | |
| 21 | V | A | 0.0000 | |
| 22 | I | A | -0.5888 | |
| 23 | Q | A | -1.0191 | |
| 24 | H | A | -0.3214 | |
| 25 | Q | A | -0.3759 | |
| 26 | T | A | 0.1240 | |
| 27 | F | A | 0.7496 | |
| 28 | K | A | -0.4180 | |
| 29 | R | A | -1.0713 | |
| 30 | M | A | -0.0024 | |
| 31 | L | A | 0.0000 | |
| 32 | L | A | 0.0000 | |
| 33 | F | A | 0.8835 | |
| 34 | G | A | 0.0000 | |
| 35 | L | A | 0.0000 | |
| 36 | R | A | -1.3081 | |
| 37 | S | A | -0.8406 | |
| 38 | L | A | 0.0000 | |
| 39 | A | A | 0.0000 | |
| 40 | D | A | -2.1526 | |
| 41 | F | A | -1.1574 | |
| 42 | C | A | 0.0000 | |
| 43 | S | A | -1.0108 | |
| 44 | P | A | -0.8723 | |
| 45 | S | A | -0.9567 | |
| 46 | N | A | -1.2904 | |
| 47 | Q | A | -1.6166 | |
| 48 | L | A | 0.0000 | |
| 49 | Y | A | -0.6787 | |
| 50 | Q | A | -0.6948 | |
| 51 | E | A | -1.3408 | |
| 52 | N | A | 0.0000 | |
| 53 | A | A | 0.0000 | |
| 54 | L | A | -0.8549 | |
| 55 | D | A | -1.4366 | |
| 56 | A | A | 0.0000 | |
| 57 | L | A | 0.0000 | |
| 58 | D | A | -2.8154 | |
| 59 | R | A | -2.5979 | |
| 60 | G | A | -1.6637 | |
| 61 | V | A | 0.0000 | |
| 62 | L | A | 0.0000 | |
| 63 | S | A | -0.6031 | |
| 64 | A | A | 0.0000 | |
| 65 | I | A | 0.0000 | |
| 66 | Q | A | -0.6698 | |
| 67 | T | A | -0.2438 | |
| 68 | A | A | 0.0000 | |
| 69 | V | A | 0.0000 | |
| 70 | T | A | -0.4351 | |
| 71 | T | A | -0.4978 | |
| 72 | F | A | -0.9171 | |
| 73 | S | A | -1.5461 | |
| 74 | D | A | -2.4788 | |
| 75 | D | A | -2.1714 | |
| 76 | D | A | -2.6066 | |
| 77 | D | A | -1.8202 | |
| 78 | L | A | 0.0000 | |
| 79 | M | A | 0.0000 | |
| 80 | L | A | -0.8579 | |
| 81 | C | A | 0.0000 | |
| 82 | A | A | 0.0000 | |
| 83 | S | A | 0.0000 | |
| 84 | R | A | -0.8696 | |
| 85 | V | A | 0.0000 | |
| 86 | L | A | 0.0000 | |
| 87 | W | A | -0.3039 | |
| 88 | A | A | 0.0000 | |
| 89 | M | A | 0.0000 | |
| 90 | S | A | 0.0000 | |
| 91 | V | A | -0.8141 | |
| 92 | A | A | 0.0000 | |
| 93 | I | A | 0.0000 | |
| 94 | K | A | -2.4390 | |
| 95 | E | A | -2.7225 | |
| 96 | E | A | -2.1702 | |
| 97 | M | A | -1.1939 | |
| 98 | D | A | -1.1426 | |
| 99 | P | A | -0.7902 | |
| 100 | A | A | -0.6109 | |
| 101 | H | A | -1.3024 | |
| 102 | I | A | -0.8961 | |
| 103 | A | A | -1.1799 | |
| 104 | R | A | -2.2633 | |
| 105 | V | A | 0.0000 | |
| 106 | H | A | -1.3533 | |
| 107 | S | A | -1.3136 | |
| 108 | E | A | -1.6334 | |
| 109 | G | A | 0.0000 | |
| 110 | S | A | 0.0000 | |
| 111 | P | A | -0.3724 | |
| 112 | V | A | 0.0000 | |
| 113 | I | A | 0.0000 | |
| 114 | V | A | -0.2629 | |
| 115 | A | A | -0.4473 | |
| 116 | V | A | 0.0000 | |
| 117 | V | A | 0.0000 | |
| 118 | N | A | -1.3019 | |
| 119 | S | A | -1.3741 | |
| 120 | S | A | -0.8964 | |
| 121 | P | A | 0.0000 | |
| 122 | T | A | -0.9620 | |
| 123 | D | A | -1.4403 | |
| 124 | P | A | -1.6243 | |
| 125 | Q | A | -1.5468 | |
| 126 | T | A | 0.0000 | |
| 127 | I | A | 0.0000 | |
| 128 | E | A | -1.9471 | |
| 129 | D | A | 0.0000 | |
| 130 | S | A | 0.0000 | |
| 131 | M | A | -0.9994 | |
| 132 | N | A | -1.3904 | |
| 133 | F | A | 0.0000 | |
| 134 | V | A | -1.6708 | |
| 135 | D | A | -2.8953 | |
| 136 | N | A | 0.0000 | |
| 137 | L | A | 0.0000 | |
| 138 | K | A | -3.7010 | |
| 139 | R | A | -3.5019 | |
| 140 | A | A | -2.4454 | |
| 141 | G | A | -1.6669 | |
| 142 | A | A | 0.0000 | |
| 143 | P | A | -2.2164 | |
| 144 | V | A | 0.0000 | |
| 145 | D | A | -2.2627 | |
| 146 | G | A | -1.1474 | |
| 147 | A | A | -1.2507 | |
| 148 | S | A | -1.1090 | |
| 149 | L | A | 0.0000 | |
| 150 | A | A | 0.0000 | |
| 151 | G | A | -0.4986 | |
| 152 | G | A | 0.0000 | |
| 153 | M | A | 0.0000 | |
| 154 | L | A | 0.0000 | |
| 155 | S | A | -0.4522 | |
| 156 | I | A | 0.0000 | |
| 157 | F | A | 0.0000 | |
| 158 | T | A | -0.3512 | |
| 159 | K | A | -0.7389 | |
| 160 | T | A | -0.8705 | |
| 161 | A | A | -0.4527 | |
| 162 | L | A | 0.0000 | |
| 163 | D | A | -1.5434 | |
| 164 | M | A | 0.0000 | |
| 165 | K | A | -2.8019 | |
| 166 | T | A | 0.0000 | |
| 167 | A | A | 0.0000 | |
| 168 | K | A | -1.9133 | |
| 169 | R | A | -1.7054 | |
| 170 | V | A | 0.0000 | |
| 171 | T | A | 0.0000 | |
| 172 | A | A | -0.1633 | |
| 173 | A | A | 0.1352 | |
| 174 | L | A | 0.0000 | |
| 175 | A | A | 0.0000 | |
| 176 | I | A | 1.3895 | |
| 177 | A | A | 0.0000 | |
| 178 | A | A | 0.0000 | |
| 179 | E | A | -1.2980 | |
| 180 | T | A | -1.0145 | |
| 181 | A | A | -1.2360 | |
| 182 | E | A | -2.1113 | |
| 183 | G | A | 0.0000 | |
| 184 | S | A | 0.0000 | |
| 185 | T | A | -0.5418 | |
| 186 | A | A | -0.5652 | |
| 187 | L | A | 0.0000 | |
| 188 | Y | A | 0.0511 | |
| 189 | N | A | -0.7373 | |
| 190 | A | A | -0.3272 | |
| 191 | G | A | -0.2386 | |
| 192 | G | A | -0.3139 | |
| 193 | T | A | 0.0000 | |
| 194 | S | A | -0.1927 | |
| 195 | V | A | 0.1875 | |
| 196 | L | A | 0.0000 | |
| 197 | L | A | 0.0000 | |
| 198 | T | A | -0.4415 | |
| 199 | Y | A | 0.0000 | |
| 200 | C | A | 0.0000 | |
| 201 | L | A | -0.9118 | |
| 202 | D | A | -1.9978 | |
| 203 | Q | A | -1.6036 | |
| 204 | G | A | -1.1456 | |
| 205 | D | A | -1.3015 | |
| 206 | L | A | -0.7695 | |
| 207 | S | A | -1.4798 | |
| 208 | D | A | -2.4871 | |
| 209 | A | A | -2.2887 | |
| 210 | G | A | 0.0000 | |
| 211 | V | A | 0.0000 | |
| 212 | E | A | -2.4351 | |
| 213 | M | A | 0.0000 | |
| 214 | V | A | 0.0000 | |
| 215 | E | A | -1.3356 | |
| 216 | G | A | -0.7968 | |
| 217 | A | A | 0.0000 | |
| 218 | F | A | 0.0000 | |
| 219 | D | A | -0.6658 | |
| 220 | T | A | 0.0000 | |
| 221 | V | A | 0.0000 | |
| 222 | R | A | -1.1703 | |
| 223 | Y | A | -0.5233 | |
| 224 | M | A | 0.0000 | |
| 225 | A | A | 0.0000 | |
| 226 | G | A | -0.7593 | |
| 227 | Y | A | -0.4384 | |
| 228 | Q | A | -1.1118 | |
| 229 | C | A | 0.0000 | |
| 230 | T | A | -0.9425 | |
| 231 | D | A | -1.7207 | |
| 232 | A | A | -0.7933 | |
| 233 | T | A | -0.6190 | |
| 234 | T | A | 0.0000 | |
| 235 | L | A | 0.1729 | |
| 236 | P | A | -0.1375 | |
| 237 | Q | A | -0.0427 | |
| 238 | C | A | 0.0000 | |
| 239 | I | A | 0.0549 | |
| 240 | A | A | -0.3856 | |
| 241 | L | A | 0.0000 | |
| 242 | M | A | 0.0000 | |
| 243 | D | A | -1.5799 | |
| 244 | K | A | -1.4788 | |
| 245 | Y | A | 0.0000 | |
| 246 | R | A | -2.6401 | |
| 247 | G | A | -2.0389 | |
| 248 | R | A | -2.5334 | |
| 249 | K | A | -2.7312 | |
| 250 | S | A | -1.9370 | |
| 251 | A | A | 0.0000 | |
| 252 | S | A | -1.8764 | |
| 253 | A | A | -1.1571 | |
| 254 | K | A | -1.3568 | |
| 255 | G | A | 0.0000 | |
| 256 | S | A | 0.0000 | |
| 257 | S | A | -0.5458 | |
| 258 | A | A | 0.0000 | |
| 259 | L | A | 0.0000 | |
| 260 | A | A | -0.1805 | |
| 261 | A | A | -0.2164 | |
| 262 | M | A | -0.1629 | |
| 263 | I | A | -0.1783 | |
| 264 | G | A | -0.9733 | |
| 265 | P | A | -1.8639 | |
| 266 | E | A | -2.8785 | |
| 267 | Q | A | -2.5049 | |
| 268 | L | A | 0.0000 | |
| 269 | Q | A | -2.8910 | |
| 270 | K | A | -3.3650 | |
| 271 | C | A | 0.0000 | |
| 272 | L | A | 0.0000 | |
| 273 | N | A | -2.6972 | |
| 274 | T | A | -2.7097 | |
| 275 | L | A | 0.0000 | |
| 276 | K | A | -2.4677 | |
| 277 | T | A | -1.7757 | |
| 278 | A | A | -2.1891 | |
| 279 | E | A | -2.6314 | |
| 280 | A | A | -1.7328 | |
| 281 | G | A | -1.7890 | |
| 282 | S | A | -2.0413 | |
| 283 | A | A | -2.2528 | |
| 284 | E | A | -3.0600 | |
| 285 | Y | A | -2.7425 | |
| 286 | D | A | -2.9401 | |
| 287 | E | A | -2.6115 | |
| 288 | A | A | 0.0000 | |
| 289 | L | A | -0.2948 | |
| 290 | V | A | 0.5785 | |
| 291 | T | A | 0.1103 | |
| 292 | L | A | 0.0000 | |
| 293 | G | A | 0.2829 | |
| 294 | S | A | 0.5435 | |
| 295 | M | A | 0.0000 | |
| 296 | S | A | 0.0000 | |
| 297 | Y | A | -0.1476 | |
| 298 | I | A | 0.0000 | |
| 299 | S | A | -0.6420 | |
| 300 | S | A | -0.6306 | |
| 301 | F | A | 0.0000 | |
| 302 | T | A | 0.0000 | |
| 303 | D | A | -1.3056 | |
| 304 | E | A | -1.9794 | |
| 305 | I | A | 0.0000 | |
| 306 | V | A | -0.9374 | |
| 307 | R | A | -2.2294 | |
| 308 | A | A | -1.4910 | |
| 309 | G | A | -0.8206 | |
| 310 | G | A | 0.0000 | |
| 311 | V | A | 0.0000 | |
| 312 | P | A | -0.7758 | |
| 313 | L | A | -0.8149 | |
| 314 | L | A | 0.0000 | |
| 315 | I | A | 0.0000 | |
| 316 | E | A | -2.0130 | |
| 317 | L | A | -0.8700 | |
| 318 | I | A | 0.0000 | |
| 319 | N | A | -1.5356 | |
| 320 | S | A | -1.2912 | |
| 321 | G | A | 0.0000 | |
| 322 | L | A | 0.0000 | |
| 323 | P | A | -1.3212 | |
| 324 | Q | A | -2.5166 | |
| 325 | M | A | 0.0000 | |
| 326 | E | A | -2.7718 | |
| 327 | G | A | -2.5571 | |
| 328 | N | A | -2.8818 | |
| 329 | P | A | -2.8625 | |
| 330 | E | A | -3.2307 | |
| 331 | K | A | -3.0635 | |
| 332 | I | A | 0.0000 | |
| 333 | A | A | -1.7439 | |
| 334 | S | A | -1.5509 | |
| 335 | M | A | -0.6573 | |
| 336 | I | A | 0.0000 | |
| 337 | S | A | -0.7477 | |
| 338 | G | A | -0.3651 | |
| 339 | A | A | 0.0000 | |
| 340 | A | A | 0.0000 | |
| 341 | K | A | -0.8067 | |
| 342 | M | A | 0.0000 | |
| 343 | L | A | 0.0000 | |
| 344 | A | A | -0.4035 | |
| 345 | R | A | -0.5939 | |
| 346 | I | A | 0.0000 | |
| 347 | A | A | 0.0000 | |
| 348 | S | A | -0.3882 | |
| 349 | N | A | -0.4372 | |
| 350 | P | A | -0.1234 | |
| 351 | V | A | 0.8520 | |
| 352 | N | A | 0.0000 | |
| 353 | V | A | 0.0000 | |
| 354 | D | A | -1.3953 | |
| 355 | A | A | -0.9677 | |
| 356 | I | A | 0.0000 | |
| 357 | V | A | -0.5156 | |
| 358 | Q | A | -1.5025 | |
| 359 | A | A | -1.0207 | |
| 360 | G | A | -0.6267 | |
| 361 | G | A | 0.0000 | |
| 362 | V | A | 0.0000 | |
| 363 | A | A | -0.1104 | |
| 364 | T | A | 0.0000 | |
| 365 | L | A | 0.0000 | |
| 366 | C | A | 0.0000 | |
| 367 | T | A | 0.0381 | |
| 368 | A | A | 0.0000 | |
| 369 | V | A | 0.0000 | |
| 370 | S | A | 0.0252 | |
| 371 | Y | A | 0.4307 | |
| 372 | C | A | 0.0000 | |
| 373 | T | A | -0.5990 | |
| 374 | E | A | -1.8509 | |
| 375 | S | A | -1.5029 | |
| 376 | M | A | -1.5850 | |
| 377 | E | A | -2.2355 | |
| 378 | A | A | 0.0000 | |
| 379 | L | A | 0.0000 | |
| 380 | G | A | 0.0000 | |
| 381 | A | A | 0.0000 | |
| 382 | L | A | 0.0000 | |
| 383 | C | A | 0.0000 | |
| 384 | M | A | -0.0462 | |
| 385 | A | A | 0.0000 | |
| 386 | L | A | 0.0000 | |
| 387 | V | A | 0.0955 | |
| 388 | P | A | -0.1789 | |
| 389 | L | A | 0.0000 | |
| 390 | A | A | 0.0000 | |
| 391 | S | A | -0.9473 | |
| 392 | R | A | -1.5903 | |
| 393 | E | A | -3.0613 | |
| 394 | S | A | -1.6685 | |
| 395 | L | A | -1.3261 | |
| 396 | A | A | 0.0000 | |
| 397 | H | A | -2.1959 | |
| 398 | E | A | -2.0728 | |
| 399 | I | A | 0.0000 | |
| 400 | V | A | -1.1160 | |
| 401 | Q | A | -1.6748 | |
| 402 | Y | A | -0.7511 | |
| 403 | Q | A | -1.3901 | |
| 404 | T | A | 0.0000 | |
| 405 | F | A | 0.0000 | |
| 406 | A | A | -0.6107 | |
| 407 | T | A | -0.2940 | |
| 408 | V | A | 0.0000 | |
| 409 | L | A | 0.0000 | |
| 410 | P | A | -0.2874 | |
| 411 | I | A | 0.0000 | |
| 412 | L | A | 0.0000 | |
| 413 | Y | A | -0.3446 | |
| 414 | Q | A | -1.5059 | |
| 415 | N | A | -1.8028 | |
| 416 | V | A | 0.0000 | |
| 417 | E | A | -2.4637 | |
| 418 | S | A | -1.9138 | |
| 419 | P | A | -1.8079 | |
| 420 | E | A | -2.4736 | |
| 421 | I | A | 0.0000 | |
| 422 | A | A | 0.0000 | |
| 423 | A | A | 0.0000 | |
| 424 | L | A | 0.0000 | |
| 425 | A | A | 0.0000 | |
| 426 | M | A | 0.0000 | |
| 427 | E | A | -0.2859 | |
| 428 | L | A | 0.0000 | |
| 429 | V | A | 0.0000 | |
| 430 | A | A | 0.0000 | |
| 431 | T | A | -0.6394 | |
| 432 | G | A | 0.0000 | |
| 433 | S | A | 0.0000 | |
| 434 | Q | A | -2.0448 | |
| 435 | H | A | -2.8055 | |
| 436 | E | A | -3.5462 | |
| 437 | E | A | -3.5709 | |
| 438 | I | A | 0.0000 | |
| 439 | Q | A | 0.0000 | |
| 440 | E | A | -3.1612 | |
| 441 | H | A | -2.3440 | |
| 442 | M | A | 0.0000 | |
| 443 | L | A | 0.0000 | |
| 444 | Q | A | -2.5104 | |
| 445 | N | A | -2.6843 | |
| 446 | Q | A | -2.3468 | |
| 447 | A | A | -1.0223 | |
| 448 | A | A | -0.9249 | |
| 449 | E | A | -0.4924 | |
| 450 | I | A | 0.0910 | |
| 451 | C | A | 0.0000 | |
| 452 | S | A | 0.0000 | |
| 453 | L | A | -0.2327 | |
| 454 | C | A | -0.1024 | |
| 455 | C | A | 0.0000 | |
| 456 | Q | A | -0.5287 | |
| 457 | Y | A | -0.7487 | |
| 458 | H | A | -0.9498 | |
| 459 | T | A | -0.3350 | |
| 460 | A | A | -0.5621 | |
| 461 | D | A | -1.3465 | |
| 462 | A | A | 0.0000 | |
| 463 | S | A | -0.3673 | |
| 464 | Y | A | -0.0362 | |
| 465 | Q | A | 0.0000 | |
| 466 | Q | A | -0.3523 | |
| 467 | H | A | -0.4400 | |
| 468 | A | A | -0.3258 | |
| 469 | I | A | -0.0002 | |
| 470 | S | A | -0.5223 | |
| 471 | A | A | 0.0000 | |
| 472 | L | A | 0.0000 | |
| 473 | N | A | -0.9370 | |
| 474 | R | A | -1.2496 | |
| 475 | L | A | 0.0000 | |
| 476 | V | A | 0.6987 | |
| 477 | P | A | -0.2427 | |
| 478 | R | A | -0.7782 | |
| 479 | L | A | 0.2562 | |
| 480 | T | A | 0.1271 | |
| 481 | T | A | 0.4855 | |
| 482 | L | A | 0.9786 | |
| 483 | H | A | -0.8347 | |
| 484 | G | A | -0.7128 | |
| 485 | V | A | 0.0000 | |
| 486 | S | A | -0.8751 | |
| 487 | E | A | -1.8444 | |
| 488 | Y | A | -0.8293 | |
| 489 | G | A | -0.7113 | |
| 490 | G | A | 0.0000 | |
| 491 | I | A | 0.8023 | |
| 492 | Q | A | -0.2872 | |
| 493 | G | A | 0.0000 | |
| 494 | V | A | 1.4221 | |
| 495 | I | A | 1.6143 | |
| 496 | A | A | 0.7119 | |
| 497 | S | A | 0.8938 | |
| 498 | L | A | 1.7336 | |
| 499 | N | A | 0.1943 | |
| 500 | A | A | 0.0492 | |
| 501 | N | A | -0.5657 | |
| 502 | V | A | 0.3795 | |
| 503 | N | A | -1.7287 | |
| 504 | N | A | -2.2581 | |
| 505 | E | A | -2.4604 | |
| 506 | Q | A | -1.6274 | |
| 507 | V | A | -0.3142 | |
| 508 | A | A | 0.2583 | |
| 509 | L | A | 1.3889 | |
| 510 | L | A | 1.1393 |
ALA alanine
ARG arginine
ASN asparagine
ASP aspartic acid
CYS cysteine
GLN glutamine
GLU glutamic acid
GLY glycine
HIS histidine
ILE isoleucine
LEU leucine
LYS lysine
MET methionine
PHE phenylalanine
PRO proline
SER serine
THR threonine
TRP tryptophan
TYR tyrosine
VAL valine