| Chain sequence(s) |
A: MALAVLRVLEPFPTETPPLAVLLPPGGPWPAAELGLVLALRPAGESPAGPALLVAALEGPDAGTEEQGPGPPQLLVSRALLRLLALGSGAWVRARAVRRPPALGWALLGTSLGPGLGPRVGPLLVRRGETLPVPGPRVLETRPALQGLLGPGTRLAVTELRGRARLCPESGDSSRPPPPPVVSSFAVSGTVRRLQGVLGGTGDSLGVSRSCLRGLGLFQGEWVWVAQARESSNTSQPHLARVQVLEPRWDLSDRLGPGSGPLGEPLADGLALVPATLAFNLGCDPLEMGELRIQRYLEGSIAPEDKGSCSLLPGPPFARELHIEIVSSPHYSTNGNYDGVLYRHFQIPRVVQEGDVLCVPTIGQVEILEGSPEKLPRWREMFFKVKKTVGEAPDGPASAYLADTTHTSLYMVGSTLSPVPWLPSEESTLWSSLSPPGLRPWCLNSVLS
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 (00:00:00)
[INFO] Analysis: Starting Aggrescan3D on folded.pdb (00:03:05)
[INFO] Main: Simulation completed successfully. (00:03:08)
|
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 | M | A | 0.1201 | |
| 2 | A | A | 0.0482 | |
| 3 | L | A | 0.4245 | |
| 4 | A | A | 0.0000 | |
| 5 | V | A | -0.2657 | |
| 6 | L | A | 0.0000 | |
| 7 | R | A | -1.9942 | |
| 8 | V | A | -1.5594 | |
| 9 | L | A | -1.2174 | |
| 10 | E | A | -2.1336 | |
| 11 | P | A | -1.3271 | |
| 12 | F | A | -0.9630 | |
| 13 | P | A | -0.8954 | |
| 14 | T | A | -0.8625 | |
| 15 | E | A | -1.8381 | |
| 16 | T | A | -0.6341 | |
| 17 | P | A | -0.2644 | |
| 18 | P | A | -0.4344 | |
| 19 | L | A | 0.3515 | |
| 20 | A | A | 0.0000 | |
| 21 | V | A | 0.0000 | |
| 22 | L | A | 0.0000 | |
| 23 | L | A | 0.0000 | |
| 24 | P | A | -1.3712 | |
| 25 | P | A | -1.3564 | |
| 26 | G | A | -0.9100 | |
| 27 | G | A | -0.7390 | |
| 28 | P | A | -0.4496 | |
| 29 | W | A | -0.4126 | |
| 30 | P | A | -0.3642 | |
| 31 | A | A | -0.6434 | |
| 32 | A | A | -0.8518 | |
| 33 | E | A | -1.3271 | |
| 34 | L | A | 0.4002 | |
| 35 | G | A | -0.2183 | |
| 36 | L | A | -0.6145 | |
| 37 | V | A | -0.1758 | |
| 38 | L | A | 0.0000 | |
| 39 | A | A | 0.0000 | |
| 40 | L | A | 0.0000 | |
| 41 | R | A | 0.0000 | |
| 42 | P | A | -0.5575 | |
| 43 | A | A | -0.5495 | |
| 44 | G | A | -1.3834 | |
| 45 | E | A | -2.3561 | |
| 46 | S | A | -1.3632 | |
| 47 | P | A | -0.8792 | |
| 48 | A | A | -0.5114 | |
| 49 | G | A | -0.7624 | |
| 50 | P | A | -0.3704 | |
| 51 | A | A | -0.1765 | |
| 52 | L | A | 1.0705 | |
| 53 | L | A | 0.9870 | |
| 54 | V | A | 0.0000 | |
| 55 | A | A | 0.6014 | |
| 56 | A | A | 0.0000 | |
| 57 | L | A | -0.5197 | |
| 58 | E | A | -1.9991 | |
| 59 | G | A | -1.3653 | |
| 60 | P | A | -1.5360 | |
| 61 | D | A | -2.3521 | |
| 62 | A | A | -1.5091 | |
| 63 | G | A | -1.7523 | |
| 64 | T | A | -2.1914 | |
| 65 | E | A | -3.2233 | |
| 66 | E | A | -3.5046 | |
| 67 | Q | A | -3.0152 | |
| 68 | G | A | -2.0045 | |
| 69 | P | A | -1.1413 | |
| 70 | G | A | -0.9275 | |
| 71 | P | A | -0.3949 | |
| 72 | P | A | -0.7485 | |
| 73 | Q | A | -1.1483 | |
| 74 | L | A | 0.0000 | |
| 75 | L | A | 0.0000 | |
| 76 | V | A | 0.0000 | |
| 77 | S | A | 0.0000 | |
| 78 | R | A | -2.4035 | |
| 79 | A | A | -0.9439 | |
| 80 | L | A | 0.0000 | |
| 81 | L | A | 0.0000 | |
| 82 | R | A | -1.4698 | |
| 83 | L | A | 0.7056 | |
| 84 | L | A | 0.3188 | |
| 85 | A | A | 0.0167 | |
| 86 | L | A | -0.1752 | |
| 87 | G | A | -1.0771 | |
| 88 | S | A | -1.0748 | |
| 89 | G | A | -0.7874 | |
| 90 | A | A | -0.0475 | |
| 91 | W | A | 0.5433 | |
| 92 | V | A | 0.0000 | |
| 93 | R | A | -0.6852 | |
| 94 | A | A | 0.0000 | |
| 95 | R | A | -1.5844 | |
| 96 | A | A | -1.1868 | |
| 97 | V | A | -1.6425 | |
| 98 | R | A | -2.9072 | |
| 99 | R | A | -2.7417 | |
| 100 | P | A | -1.3482 | |
| 101 | P | A | -0.8844 | |
| 102 | A | A | -0.5761 | |
| 103 | L | A | -0.3118 | |
| 104 | G | A | -0.8934 | |
| 105 | W | A | -0.3065 | |
| 106 | A | A | 0.0000 | |
| 107 | L | A | 0.3507 | |
| 108 | L | A | 0.0000 | |
| 109 | G | A | -0.1862 | |
| 110 | T | A | -0.2311 | |
| 111 | S | A | 0.2907 | |
| 112 | L | A | 0.9774 | |
| 113 | G | A | 0.1733 | |
| 114 | P | A | -0.0363 | |
| 115 | G | A | 0.1880 | |
| 116 | L | A | 0.8526 | |
| 117 | G | A | -0.0892 | |
| 118 | P | A | -0.8137 | |
| 119 | R | A | -1.4680 | |
| 120 | V | A | -0.6018 | |
| 121 | G | A | -0.5991 | |
| 122 | P | A | -0.0376 | |
| 123 | L | A | 0.9418 | |
| 124 | L | A | 1.5174 | |
| 125 | V | A | -0.2768 | |
| 126 | R | A | -2.2485 | |
| 127 | R | A | -3.0969 | |
| 128 | G | A | -2.4857 | |
| 129 | E | A | -2.7994 | |
| 130 | T | A | -1.0646 | |
| 131 | L | A | 0.2325 | |
| 132 | P | A | 0.1596 | |
| 133 | V | A | 0.5259 | |
| 134 | P | A | -0.1902 | |
| 135 | G | A | -0.6444 | |
| 136 | P | A | -0.8301 | |
| 137 | R | A | -0.9553 | |
| 138 | V | A | 0.0264 | |
| 139 | L | A | -0.2885 | |
| 140 | E | A | -1.4208 | |
| 141 | T | A | -1.0338 | |
| 142 | R | A | -1.9934 | |
| 143 | P | A | -1.0266 | |
| 144 | A | A | -0.0155 | |
| 145 | L | A | -0.0575 | |
| 146 | Q | A | -0.7469 | |
| 147 | G | A | -0.0569 | |
| 148 | L | A | 1.3529 | |
| 149 | L | A | 0.8698 | |
| 150 | G | A | -0.1084 | |
| 151 | P | A | -0.5369 | |
| 152 | G | A | -0.6204 | |
| 153 | T | A | -0.2799 | |
| 154 | R | A | -0.6519 | |
| 155 | L | A | 1.2158 | |
| 156 | A | A | 1.2286 | |
| 157 | V | A | 1.7558 | |
| 158 | T | A | 0.2844 | |
| 159 | E | A | -1.2753 | |
| 160 | L | A | -0.4334 | |
| 161 | R | A | -2.3956 | |
| 162 | G | A | -2.2863 | |
| 163 | R | A | -2.6920 | |
| 164 | A | A | -1.6183 | |
| 165 | R | A | -1.4697 | |
| 166 | L | A | 0.7316 | |
| 167 | C | A | 0.4796 | |
| 168 | P | A | -0.6747 | |
| 169 | E | A | -1.9868 | |
| 170 | S | A | -1.8208 | |
| 171 | G | A | -1.9484 | |
| 172 | D | A | -2.5904 | |
| 173 | S | A | -1.8452 | |
| 174 | S | A | -1.8821 | |
| 175 | R | A | -2.5741 | |
| 176 | P | A | -1.4627 | |
| 177 | P | A | -1.1087 | |
| 178 | P | A | -0.5992 | |
| 179 | P | A | 0.1534 | |
| 180 | P | A | 0.8618 | |
| 181 | V | A | 2.3225 | |
| 182 | V | A | 3.0273 | |
| 183 | S | A | 2.1422 | |
| 184 | S | A | 1.9846 | |
| 185 | F | A | 2.5320 | |
| 186 | A | A | 2.2648 | |
| 187 | V | A | 2.5990 | |
| 188 | S | A | 1.4324 | |
| 189 | G | A | 0.6733 | |
| 190 | T | A | 0.5755 | |
| 191 | V | A | -0.0122 | |
| 192 | R | A | -1.4395 | |
| 193 | R | A | -2.5604 | |
| 194 | L | A | 0.0000 | |
| 195 | Q | A | -1.2815 | |
| 196 | G | A | 0.0000 | |
| 197 | V | A | 0.6792 | |
| 198 | L | A | 0.4589 | |
| 199 | G | A | 0.0362 | |
| 200 | G | A | -0.6399 | |
| 201 | T | A | -0.8092 | |
| 202 | G | A | -1.2745 | |
| 203 | D | A | -1.8300 | |
| 204 | S | A | -1.3490 | |
| 205 | L | A | 0.0000 | |
| 206 | G | A | 0.0000 | |
| 207 | V | A | 0.0000 | |
| 208 | S | A | -1.9494 | |
| 209 | R | A | -2.9356 | |
| 210 | S | A | -2.2660 | |
| 211 | C | A | 0.0000 | |
| 212 | L | A | 0.0000 | |
| 213 | R | A | -2.4488 | |
| 214 | G | A | -1.8358 | |
| 215 | L | A | 0.0000 | |
| 216 | G | A | -0.2120 | |
| 217 | L | A | 0.2308 | |
| 218 | F | A | 0.4821 | |
| 219 | Q | A | -0.9431 | |
| 220 | G | A | -0.5300 | |
| 221 | E | A | 0.0000 | |
| 222 | W | A | -0.1423 | |
| 223 | V | A | 0.0000 | |
| 224 | W | A | -0.1608 | |
| 225 | V | A | 0.0000 | |
| 226 | A | A | 0.0000 | |
| 227 | Q | A | -1.8405 | |
| 228 | A | A | -2.3487 | |
| 229 | R | A | -3.2960 | |
| 230 | E | A | -3.0315 | |
| 231 | S | A | -1.9829 | |
| 232 | S | A | -1.8618 | |
| 233 | N | A | -2.0626 | |
| 234 | T | A | -1.2657 | |
| 235 | S | A | -1.3795 | |
| 236 | Q | A | -1.3569 | |
| 237 | P | A | -0.7461 | |
| 238 | H | A | 0.0000 | |
| 239 | L | A | 0.0000 | |
| 240 | A | A | 0.0000 | |
| 241 | R | A | -1.3349 | |
| 242 | V | A | 0.0000 | |
| 243 | Q | A | -1.3548 | |
| 244 | V | A | 0.0000 | |
| 245 | L | A | -1.4337 | |
| 246 | E | A | -2.5852 | |
| 247 | P | A | -2.2260 | |
| 248 | R | A | -2.4364 | |
| 249 | W | A | -1.5219 | |
| 250 | D | A | -2.2160 | |
| 251 | L | A | -0.9901 | |
| 252 | S | A | -1.4285 | |
| 253 | D | A | -2.6399 | |
| 254 | R | A | -2.1292 | |
| 255 | L | A | -0.2582 | |
| 256 | G | A | -0.7689 | |
| 257 | P | A | -0.8820 | |
| 258 | G | A | -0.5373 | |
| 259 | S | A | -0.3160 | |
| 260 | G | A | -0.2228 | |
| 261 | P | A | -0.1649 | |
| 262 | L | A | 0.2213 | |
| 263 | G | A | -1.0550 | |
| 264 | E | A | -1.6084 | |
| 265 | P | A | -1.6644 | |
| 266 | L | A | -1.2027 | |
| 267 | A | A | -1.1246 | |
| 268 | D | A | -2.1315 | |
| 269 | G | A | -1.5519 | |
| 270 | L | A | -0.5137 | |
| 271 | A | A | 0.0000 | |
| 272 | L | A | 0.3679 | |
| 273 | V | A | 0.0000 | |
| 274 | P | A | 0.0000 | |
| 275 | A | A | 0.2034 | |
| 276 | T | A | 0.1576 | |
| 277 | L | A | 0.0000 | |
| 278 | A | A | 0.0000 | |
| 279 | F | A | 0.2760 | |
| 280 | N | A | -0.1930 | |
| 281 | L | A | 0.0000 | |
| 282 | G | A | -0.8473 | |
| 283 | C | A | -1.0053 | |
| 284 | D | A | -1.7393 | |
| 285 | P | A | -0.2032 | |
| 286 | L | A | 0.2629 | |
| 287 | E | A | -1.6127 | |
| 288 | M | A | 0.0000 | |
| 289 | G | A | -1.4168 | |
| 290 | E | A | -2.1970 | |
| 291 | L | A | 0.0000 | |
| 292 | R | A | -1.8876 | |
| 293 | I | A | 0.0000 | |
| 294 | Q | A | -0.4957 | |
| 295 | R | A | 0.0000 | |
| 296 | Y | A | 0.0000 | |
| 297 | L | A | 0.3131 | |
| 298 | E | A | -1.2140 | |
| 299 | G | A | -0.7495 | |
| 300 | S | A | 0.5360 | |
| 301 | I | A | 1.2016 | |
| 302 | A | A | -0.3504 | |
| 303 | P | A | -1.5901 | |
| 304 | E | A | -2.9882 | |
| 305 | D | A | -3.2241 | |
| 306 | K | A | -3.2489 | |
| 307 | G | A | -1.9263 | |
| 308 | S | A | -0.5742 | |
| 309 | C | A | 0.7316 | |
| 310 | S | A | 0.6502 | |
| 311 | L | A | 1.6248 | |
| 312 | L | A | 1.0518 | |
| 313 | P | A | 0.4566 | |
| 314 | G | A | -0.1561 | |
| 315 | P | A | 0.0000 | |
| 316 | P | A | -0.7699 | |
| 317 | F | A | -0.5324 | |
| 318 | A | A | 0.0000 | |
| 319 | R | A | -2.3305 | |
| 320 | E | A | -1.1018 | |
| 321 | L | A | 0.0000 | |
| 322 | H | A | -0.4474 | |
| 323 | I | A | 0.0000 | |
| 324 | E | A | -0.2372 | |
| 325 | I | A | 0.0000 | |
| 326 | V | A | 0.0000 | |
| 327 | S | A | -0.1588 | |
| 328 | S | A | -0.3023 | |
| 329 | P | A | -0.8264 | |
| 330 | H | A | -1.8663 | |
| 331 | Y | A | 0.0000 | |
| 332 | S | A | -1.2156 | |
| 333 | T | A | -1.2776 | |
| 334 | N | A | -1.8134 | |
| 335 | G | A | -1.9514 | |
| 336 | N | A | -2.4586 | |
| 337 | Y | A | 0.0000 | |
| 338 | D | A | -1.7741 | |
| 339 | G | A | -1.2300 | |
| 340 | V | A | 0.0000 | |
| 341 | L | A | 0.0000 | |
| 342 | Y | A | 0.2952 | |
| 343 | R | A | -0.7132 | |
| 344 | H | A | 0.0000 | |
| 345 | F | A | 0.0000 | |
| 346 | Q | A | -0.3094 | |
| 347 | I | A | 1.2545 | |
| 348 | P | A | 0.3850 | |
| 349 | R | A | -0.2448 | |
| 350 | V | A | -0.2166 | |
| 351 | V | A | 0.0000 | |
| 352 | Q | A | 0.0000 | |
| 353 | E | A | -2.8603 | |
| 354 | G | A | -2.0077 | |
| 355 | D | A | 0.0000 | |
| 356 | V | A | 0.0000 | |
| 357 | L | A | 0.0000 | |
| 358 | C | A | -0.3182 | |
| 359 | V | A | 0.0000 | |
| 360 | P | A | -0.5046 | |
| 361 | T | A | 0.0000 | |
| 362 | I | A | 1.2854 | |
| 363 | G | A | 0.4294 | |
| 364 | Q | A | 0.3746 | |
| 365 | V | A | 1.0072 | |
| 366 | E | A | -1.4354 | |
| 367 | I | A | -0.4350 | |
| 368 | L | A | -0.6530 | |
| 369 | E | A | -1.8448 | |
| 370 | G | A | -1.9175 | |
| 371 | S | A | -1.5294 | |
| 372 | P | A | -1.7713 | |
| 373 | E | A | -2.5410 | |
| 374 | K | A | -2.7646 | |
| 375 | L | A | -1.7135 | |
| 376 | P | A | -1.5877 | |
| 377 | R | A | -2.8064 | |
| 378 | W | A | -1.8208 | |
| 379 | R | A | -2.0810 | |
| 380 | E | A | -1.2701 | |
| 381 | M | A | 0.0000 | |
| 382 | F | A | 0.0555 | |
| 383 | F | A | 0.0000 | |
| 384 | K | A | -1.1704 | |
| 385 | V | A | 0.0000 | |
| 386 | K | A | -2.4759 | |
| 387 | K | A | -2.2736 | |
| 388 | T | A | -1.5283 | |
| 389 | V | A | -1.1201 | |
| 390 | G | A | -1.4817 | |
| 391 | E | A | -2.4466 | |
| 392 | A | A | -1.8614 | |
| 393 | P | A | -1.6871 | |
| 394 | D | A | -2.5689 | |
| 395 | G | A | -1.6730 | |
| 396 | P | A | -1.2180 | |
| 397 | A | A | -1.0715 | |
| 398 | S | A | -0.7326 | |
| 399 | A | A | 0.0000 | |
| 400 | Y | A | 0.0000 | |
| 401 | L | A | 0.0000 | |
| 402 | A | A | 0.0000 | |
| 403 | D | A | 0.0000 | |
| 404 | T | A | -0.1563 | |
| 405 | T | A | -0.7157 | |
| 406 | H | A | -1.4112 | |
| 407 | T | A | -1.0139 | |
| 408 | S | A | -0.5218 | |
| 409 | L | A | 0.5888 | |
| 410 | Y | A | 0.9891 | |
| 411 | M | A | 1.0158 | |
| 412 | V | A | 1.4156 | |
| 413 | G | A | 0.2900 | |
| 414 | S | A | -0.0167 | |
| 415 | T | A | 0.3826 | |
| 416 | L | A | 1.4006 | |
| 417 | S | A | 0.0000 | |
| 418 | P | A | 0.6085 | |
| 419 | V | A | 1.2442 | |
| 420 | P | A | 0.0000 | |
| 421 | W | A | 1.5165 | |
| 422 | L | A | 0.5976 | |
| 423 | P | A | -0.6457 | |
| 424 | S | A | -1.8453 | |
| 425 | E | A | -2.8756 | |
| 426 | E | A | -2.7334 | |
| 427 | S | A | -1.0988 | |
| 428 | T | A | 0.1432 | |
| 429 | L | A | 1.8478 | |
| 430 | W | A | 1.9900 | |
| 431 | S | A | 0.6682 | |
| 432 | S | A | 0.9502 | |
| 433 | L | A | 1.7030 | |
| 434 | S | A | 0.4542 | |
| 435 | P | A | 0.0800 | |
| 436 | P | A | -0.1594 | |
| 437 | G | A | -0.8655 | |
| 438 | L | A | -0.2148 | |
| 439 | R | A | -1.1196 | |
| 440 | P | A | -0.0620 | |
| 441 | W | A | 1.0543 | |
| 442 | C | A | 1.5119 | |
| 443 | L | A | 1.9521 | |
| 444 | N | A | 0.5540 | |
| 445 | S | A | 1.1490 | |
| 446 | V | A | 2.4869 | |
| 447 | L | A | 2.2153 | |
| 448 | S | A | 0.8456 |
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