| Chain sequence(s) |
A: ILWHEMWHEGLEEASRLYFGERNVKGMFEVLEPLHAMMERGPQTLKETSFNQAYGRDLMEAQEWCRKYMKSGNVKDLLQAWDLYYHVFRRISKGGGGSGGGGSGGGGSVSKGEELFTGVVPILVELDGDVNGHKFSVSGEGEGDATYGKLTLKLICTTGKLPVPWPTLVTTLGYGLQCFARYPDHMKQHDFFKSAMPEGYVQERTIFFKDDGNYKTRAEVKFEGDTLVNRIELKGIDFKEDGNILGHKLEYNYNSHNVYITADKQKNGIKANFKIRHNIEDGGVQLADHYQQNTPIGDGPVLLPDNHYLSYQSKLSKDPNEKRDHMVLLEFVTAAGITLGMDELYKGGSGGSGGSGGGGGSGPADLSGELRKGDQILSVNGVDLRNASHEQAAIALKNAGQTVTIIAQYGGRIVIHRGSTGLGFNIVGGEDGEGIFISFINYKQTS
input PDB |
| Selected Chain(s) | A |
| Distance of aggregation | 10 Å |
| FoldX usage | No |
| 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] runJob: FoldX not utilized. Treating input pdb file as it was already optimized. (00:00:00)
[INFO] Analysis: Starting Aggrescan3D on folded.pdb (00:00:01)
[INFO] Main: Simulation completed successfully. (00:00:06)
|
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 | |
| 1 | I | A | 2.1340 | |
| 2 | L | A | 1.0020 | |
| 3 | W | A | 0.0000 | |
| 4 | H | A | -1.0741 | |
| 5 | E | A | -1.1417 | |
| 6 | M | A | -0.5576 | |
| 7 | W | A | 0.0000 | |
| 8 | H | A | -2.2423 | |
| 9 | E | A | -3.0115 | |
| 10 | G | A | -2.1704 | |
| 11 | L | A | 0.0000 | |
| 12 | E | A | -2.9877 | |
| 13 | E | A | -2.3567 | |
| 14 | A | A | 0.0000 | |
| 15 | S | A | -1.8105 | |
| 16 | R | A | -2.4419 | |
| 17 | L | A | 0.0000 | |
| 18 | Y | A | -1.6486 | |
| 19 | F | A | -1.1424 | |
| 20 | G | A | -2.0874 | |
| 21 | E | A | -3.0068 | |
| 22 | R | A | -3.1168 | |
| 23 | N | A | -2.4426 | |
| 24 | V | A | -1.5420 | |
| 25 | K | A | -2.2572 | |
| 26 | G | A | 0.0000 | |
| 27 | M | A | 0.0000 | |
| 28 | F | A | -1.6680 | |
| 29 | E | A | -2.5201 | |
| 30 | V | A | -1.7835 | |
| 31 | L | A | 0.0000 | |
| 32 | E | A | -2.3077 | |
| 33 | P | A | -1.5009 | |
| 34 | L | A | 0.0000 | |
| 35 | H | A | 0.0000 | |
| 36 | A | A | -1.5809 | |
| 37 | M | A | -1.3702 | |
| 38 | M | A | -1.5147 | |
| 39 | E | A | -2.5342 | |
| 40 | R | A | -2.8688 | |
| 41 | G | A | -1.9789 | |
| 42 | P | A | -1.6824 | |
| 43 | Q | A | -1.5367 | |
| 44 | T | A | -0.5082 | |
| 45 | L | A | 0.2467 | |
| 46 | K | A | -1.4509 | |
| 47 | E | A | -1.2137 | |
| 48 | T | A | -1.0177 | |
| 49 | S | A | -1.0651 | |
| 50 | F | A | 0.0000 | |
| 51 | N | A | -1.6470 | |
| 52 | Q | A | -2.0457 | |
| 53 | A | A | -1.2989 | |
| 54 | Y | A | 0.0000 | |
| 55 | G | A | 0.0000 | |
| 56 | R | A | -2.2129 | |
| 57 | D | A | -1.6349 | |
| 58 | L | A | 0.0000 | |
| 59 | M | A | -0.7732 | |
| 60 | E | A | -1.8021 | |
| 61 | A | A | 0.0000 | |
| 62 | Q | A | -1.6020 | |
| 63 | E | A | -2.1612 | |
| 64 | W | A | -1.5224 | |
| 65 | C | A | 0.0000 | |
| 66 | R | A | -2.3032 | |
| 67 | K | A | -2.3843 | |
| 68 | Y | A | -1.3557 | |
| 69 | M | A | -0.6725 | |
| 70 | K | A | -2.1382 | |
| 71 | S | A | -1.5900 | |
| 72 | G | A | -1.1590 | |
| 73 | N | A | -1.0095 | |
| 74 | V | A | 0.4344 | |
| 75 | K | A | -1.3427 | |
| 76 | D | A | -1.3742 | |
| 77 | L | A | 0.0000 | |
| 78 | L | A | -0.3882 | |
| 79 | Q | A | -1.2524 | |
| 80 | A | A | 0.0000 | |
| 81 | W | A | 0.0000 | |
| 82 | D | A | -1.3158 | |
| 83 | L | A | -0.9622 | |
| 84 | Y | A | 0.0000 | |
| 85 | Y | A | -0.9111 | |
| 86 | H | A | -1.2093 | |
| 87 | V | A | 0.0000 | |
| 88 | F | A | -1.4731 | |
| 89 | R | A | -1.5903 | |
| 90 | R | A | -2.2340 | |
| 91 | I | A | 0.0000 | |
| 92 | S | A | -1.9817 | |
| 93 | K | A | -2.7116 | |
| 94 | G | A | -2.1407 | |
| 95 | G | A | -1.9712 | |
| 96 | G | A | -1.5643 | |
| 97 | G | A | -1.1018 | |
| 98 | S | A | -0.9443 | |
| 99 | G | A | -1.0635 | |
| 100 | G | A | -1.0962 | |
| 101 | G | A | -1.1303 | |
| 102 | G | A | -1.0695 | |
| 103 | S | A | -1.0009 | |
| 104 | G | A | -1.1200 | |
| 105 | G | A | -1.1546 | |
| 106 | G | A | -0.8557 | |
| 107 | G | A | -1.0745 | |
| 108 | S | A | -0.3716 | |
| 109 | V | A | 0.1256 | |
| 110 | S | A | -0.7760 | |
| 111 | K | A | -1.8743 | |
| 112 | G | A | 0.0000 | |
| 113 | E | A | -1.1749 | |
| 114 | E | A | -1.8782 | |
| 115 | L | A | -0.7929 | |
| 116 | F | A | 0.0000 | |
| 117 | T | A | -0.5202 | |
| 118 | G | A | -0.3997 | |
| 119 | V | A | 0.0801 | |
| 120 | V | A | 0.0000 | |
| 121 | P | A | -1.2049 | |
| 122 | I | A | 0.0000 | |
| 123 | L | A | -0.9291 | |
| 124 | V | A | 0.0000 | |
| 125 | E | A | -1.8854 | |
| 126 | L | A | 0.0000 | |
| 127 | D | A | -3.3733 | |
| 128 | G | A | 0.0000 | |
| 129 | D | A | -2.6882 | |
| 130 | V | A | 0.0000 | |
| 131 | N | A | -2.0183 | |
| 132 | G | A | -1.6369 | |
| 133 | H | A | -2.0327 | |
| 134 | K | A | -2.8903 | |
| 135 | F | A | 0.0000 | |
| 136 | S | A | -1.7835 | |
| 137 | V | A | 0.0000 | |
| 138 | S | A | -1.0277 | |
| 139 | G | A | 0.0000 | |
| 140 | E | A | -2.1881 | |
| 141 | G | A | -1.6172 | |
| 142 | E | A | -1.5881 | |
| 143 | G | A | 0.0000 | |
| 144 | D | A | 0.0000 | |
| 145 | A | A | 0.0000 | |
| 146 | T | A | -0.1628 | |
| 147 | Y | A | -0.2070 | |
| 148 | G | A | 0.0000 | |
| 149 | K | A | -0.1755 | |
| 150 | L | A | 0.0000 | |
| 151 | T | A | -0.7385 | |
| 152 | L | A | 0.0000 | |
| 153 | K | A | -1.1199 | |
| 154 | L | A | 0.0000 | |
| 155 | I | A | -1.1978 | |
| 156 | C | A | 0.0000 | |
| 157 | T | A | -0.8486 | |
| 158 | T | A | -1.4182 | |
| 159 | G | A | -1.7827 | |
| 160 | K | A | -2.3764 | |
| 161 | L | A | 0.0000 | |
| 162 | P | A | -1.1135 | |
| 163 | V | A | 0.0000 | |
| 164 | P | A | 0.0000 | |
| 165 | W | A | 0.0000 | |
| 166 | P | A | 0.0000 | |
| 167 | T | A | 0.0000 | |
| 168 | L | A | 0.0000 | |
| 169 | V | A | 0.0000 | |
| 170 | T | A | 0.0000 | |
| 171 | T | A | 0.0000 | |
| 172 | L | A | 0.0000 | |
| 173 | G | A | 0.0000 | |
| 174 | Y | A | 0.0000 | |
| 175 | G | A | 0.0000 | |
| 176 | L | A | 0.0000 | |
| 177 | Q | A | 0.0000 | |
| 178 | C | A | 0.0000 | |
| 179 | F | A | 0.0000 | |
| 180 | A | A | 0.0000 | |
| 181 | R | A | -0.7495 | |
| 182 | Y | A | 0.0000 | |
| 183 | P | A | -1.3678 | |
| 184 | D | A | -2.4282 | |
| 185 | H | A | -1.3955 | |
| 186 | M | A | 0.0000 | |
| 187 | K | A | -1.6648 | |
| 188 | Q | A | -1.5817 | |
| 189 | H | A | 0.0000 | |
| 190 | D | A | 0.0000 | |
| 191 | F | A | 0.0000 | |
| 192 | F | A | 0.0000 | |
| 193 | K | A | 0.0000 | |
| 194 | S | A | -0.7185 | |
| 195 | A | A | 0.0000 | |
| 196 | M | A | 0.0000 | |
| 197 | P | A | -1.4828 | |
| 198 | E | A | -2.1659 | |
| 199 | G | A | 0.0000 | |
| 200 | Y | A | 0.0000 | |
| 201 | V | A | -0.3816 | |
| 202 | Q | A | 0.0000 | |
| 203 | E | A | -1.9598 | |
| 204 | R | A | 0.0000 | |
| 205 | T | A | -0.7499 | |
| 206 | I | A | 0.0000 | |
| 207 | F | A | 0.2714 | |
| 208 | F | A | 0.0000 | |
| 209 | K | A | -2.1447 | |
| 210 | D | A | -2.7558 | |
| 211 | D | A | -2.3408 | |
| 212 | G | A | 0.0000 | |
| 213 | N | A | -0.8801 | |
| 214 | Y | A | 0.0000 | |
| 215 | K | A | -2.5530 | |
| 216 | T | A | 0.0000 | |
| 217 | R | A | -2.7808 | |
| 218 | A | A | 0.0000 | |
| 219 | E | A | -1.3532 | |
| 220 | V | A | 0.0000 | |
| 221 | K | A | -1.2223 | |
| 222 | F | A | -1.3822 | |
| 223 | E | A | -1.7894 | |
| 224 | G | A | -1.7639 | |
| 225 | D | A | -2.1546 | |
| 226 | T | A | -1.4198 | |
| 227 | L | A | 0.0000 | |
| 228 | V | A | 0.0000 | |
| 229 | N | A | 0.0000 | |
| 230 | R | A | -1.9905 | |
| 231 | I | A | 0.0000 | |
| 232 | E | A | -3.9156 | |
| 233 | L | A | 0.0000 | |
| 234 | K | A | -3.3909 | |
| 235 | G | A | 0.0000 | |
| 236 | I | A | -1.0344 | |
| 237 | D | A | -2.0804 | |
| 238 | F | A | 0.0000 | |
| 239 | K | A | -3.7080 | |
| 240 | E | A | -3.8256 | |
| 241 | D | A | -3.4328 | |
| 242 | G | A | -2.7218 | |
| 243 | N | A | -1.9077 | |
| 244 | I | A | 0.0000 | |
| 245 | L | A | -1.8837 | |
| 246 | G | A | -2.0888 | |
| 247 | H | A | -1.6398 | |
| 248 | K | A | -2.2296 | |
| 249 | L | A | 0.0000 | |
| 250 | E | A | -1.4879 | |
| 251 | Y | A | -0.5896 | |
| 252 | N | A | -0.8106 | |
| 253 | Y | A | -1.0053 | |
| 254 | N | A | -1.2701 | |
| 255 | S | A | -0.9459 | |
| 256 | H | A | -0.9078 | |
| 257 | N | A | -0.6715 | |
| 258 | V | A | 0.0000 | |
| 259 | Y | A | 0.1597 | |
| 260 | I | A | 0.0000 | |
| 261 | T | A | -1.0508 | |
| 262 | A | A | -1.5332 | |
| 263 | D | A | 0.0000 | |
| 264 | K | A | -2.9709 | |
| 265 | Q | A | -2.8970 | |
| 266 | K | A | -2.9704 | |
| 267 | N | A | -2.4247 | |
| 268 | G | A | 0.0000 | |
| 269 | I | A | 0.0000 | |
| 270 | K | A | -1.3745 | |
| 271 | A | A | 0.0000 | |
| 272 | N | A | -1.2371 | |
| 273 | F | A | 0.0000 | |
| 274 | K | A | -1.6547 | |
| 275 | I | A | 0.0000 | |
| 276 | R | A | -1.3885 | |
| 277 | H | A | 0.0000 | |
| 278 | N | A | -1.1847 | |
| 279 | I | A | -1.7987 | |
| 280 | E | A | -3.0765 | |
| 281 | D | A | -2.9155 | |
| 282 | G | A | -1.7292 | |
| 283 | G | A | -0.7227 | |
| 284 | V | A | 0.2208 | |
| 285 | Q | A | 0.0000 | |
| 286 | L | A | -0.8414 | |
| 287 | A | A | 0.0000 | |
| 288 | D | A | -0.9100 | |
| 289 | H | A | 0.0000 | |
| 290 | Y | A | 0.0463 | |
| 291 | Q | A | 0.0000 | |
| 292 | Q | A | -1.0577 | |
| 293 | N | A | 0.0000 | |
| 294 | T | A | -0.6024 | |
| 295 | P | A | -0.7109 | |
| 296 | I | A | -0.1417 | |
| 297 | G | A | -1.2307 | |
| 298 | D | A | -2.1293 | |
| 299 | G | A | -1.4017 | |
| 300 | P | A | -0.8444 | |
| 301 | V | A | -0.1711 | |
| 302 | L | A | 0.0644 | |
| 303 | L | A | -0.3486 | |
| 304 | P | A | 0.0000 | |
| 305 | D | A | -2.0507 | |
| 306 | N | A | -1.1291 | |
| 307 | H | A | 0.0000 | |
| 308 | Y | A | 0.1050 | |
| 309 | L | A | 0.0000 | |
| 310 | S | A | -0.2694 | |
| 311 | Y | A | 0.0000 | |
| 312 | Q | A | -0.6804 | |
| 313 | S | A | -0.7487 | |
| 314 | K | A | -1.0245 | |
| 315 | L | A | -0.4930 | |
| 316 | S | A | -0.8004 | |
| 317 | K | A | -1.7261 | |
| 318 | D | A | -1.9657 | |
| 319 | P | A | -1.7229 | |
| 320 | N | A | -2.4164 | |
| 321 | E | A | -2.6406 | |
| 322 | K | A | -3.2875 | |
| 323 | R | A | -3.4402 | |
| 324 | D | A | -2.4748 | |
| 325 | H | A | 0.0000 | |
| 326 | M | A | 0.0000 | |
| 327 | V | A | -0.5424 | |
| 328 | L | A | 0.0000 | |
| 329 | L | A | -0.0356 | |
| 330 | E | A | 0.0000 | |
| 331 | F | A | 0.0766 | |
| 332 | V | A | 0.0000 | |
| 333 | T | A | -0.3145 | |
| 334 | A | A | 0.0000 | |
| 335 | A | A | -0.2180 | |
| 336 | G | A | -0.2979 | |
| 337 | I | A | -0.1926 | |
| 338 | T | A | 0.4358 | |
| 339 | L | A | 0.5190 | |
| 340 | G | A | -0.1327 | |
| 341 | M | A | 0.2607 | |
| 342 | D | A | -1.7036 | |
| 343 | E | A | -1.6869 | |
| 344 | L | A | 0.5827 | |
| 345 | Y | A | 0.0061 | |
| 346 | K | A | -1.9674 | |
| 347 | G | A | -1.3184 | |
| 348 | G | A | -0.9389 | |
| 349 | S | A | -1.0329 | |
| 350 | G | A | -1.1831 | |
| 351 | G | A | -0.9934 | |
| 352 | S | A | -0.8617 | |
| 353 | G | A | -0.9962 | |
| 354 | G | A | -1.0114 | |
| 355 | S | A | -0.9209 | |
| 356 | G | A | -1.1302 | |
| 357 | G | A | -1.1836 | |
| 358 | G | A | -1.2004 | |
| 359 | G | A | -1.5128 | |
| 360 | G | A | -1.3401 | |
| 361 | S | A | -0.8012 | |
| 362 | G | A | 0.0000 | |
| 363 | P | A | -0.0464 | |
| 364 | A | A | 0.0000 | |
| 365 | D | A | -0.3291 | |
| 366 | L | A | 0.7380 | |
| 367 | S | A | -0.3898 | |
| 368 | G | A | -1.1932 | |
| 369 | E | A | -2.3962 | |
| 370 | L | A | 0.0000 | |
| 371 | R | A | -3.0179 | |
| 372 | K | A | -2.5863 | |
| 373 | G | A | -1.3752 | |
| 374 | D | A | 0.0000 | |
| 375 | Q | A | -0.6995 | |
| 376 | I | A | 0.0000 | |
| 377 | L | A | -0.8046 | |
| 378 | S | A | -0.8484 | |
| 379 | V | A | 0.0000 | |
| 380 | N | A | -0.8917 | |
| 381 | G | A | -0.4555 | |
| 382 | V | A | 0.0514 | |
| 383 | D | A | -1.8337 | |
| 384 | L | A | 0.0000 | |
| 385 | R | A | -2.9614 | |
| 386 | N | A | -3.4536 | |
| 387 | A | A | 0.0000 | |
| 388 | S | A | -2.6582 | |
| 389 | H | A | -2.0391 | |
| 390 | E | A | -2.4190 | |
| 391 | Q | A | -2.0072 | |
| 392 | A | A | 0.0000 | |
| 393 | A | A | -1.0886 | |
| 394 | I | A | -0.3539 | |
| 395 | A | A | -0.9090 | |
| 396 | L | A | 0.0000 | |
| 397 | K | A | -2.0687 | |
| 398 | N | A | -2.0058 | |
| 399 | A | A | -1.4511 | |
| 400 | G | A | -1.9675 | |
| 401 | Q | A | -2.2071 | |
| 402 | T | A | -1.1675 | |
| 403 | V | A | 0.0000 | |
| 404 | T | A | -0.3378 | |
| 405 | I | A | 0.0000 | |
| 406 | I | A | -0.2484 | |
| 407 | A | A | 0.0000 | |
| 408 | Q | A | -0.5373 | |
| 409 | Y | A | 0.1070 | |
| 410 | G | A | -1.1429 | |
| 411 | G | A | -1.0605 | |
| 412 | R | A | -1.7018 | |
| 413 | I | A | 0.0000 | |
| 414 | V | A | -0.0511 | |
| 415 | I | A | 0.0000 | |
| 416 | H | A | -1.3357 | |
| 417 | R | A | -1.5224 | |
| 418 | G | A | -1.1021 | |
| 419 | S | A | -0.5287 | |
| 420 | T | A | -0.4416 | |
| 421 | G | A | -1.0288 | |
| 422 | L | A | 0.0000 | |
| 423 | G | A | -0.2731 | |
| 424 | F | A | -0.6372 | |
| 425 | N | A | -0.9012 | |
| 426 | I | A | -0.1415 | |
| 427 | V | A | -0.0602 | |
| 428 | G | A | -1.4589 | |
| 429 | G | A | -2.9747 | |
| 430 | E | A | -3.6779 | |
| 431 | D | A | -3.4567 | |
| 432 | G | A | -3.1264 | |
| 433 | E | A | -3.1118 | |
| 434 | G | A | 0.0000 | |
| 435 | I | A | 0.0000 | |
| 436 | F | A | -0.4917 | |
| 437 | I | A | 0.0000 | |
| 438 | S | A | -0.5380 | |
| 439 | F | A | -0.3026 | |
| 440 | I | A | 0.0000 | |
| 441 | N | A | -0.4141 | |
| 442 | Y | A | 0.0057 | |
| 443 | K | A | -1.8810 | |
| 444 | Q | A | -1.9553 | |
| 445 | T | A | -1.0582 | |
| 446 | S | A | -0.8061 |
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