| Chain sequence(s) |
A: MHGEGDPQDEAHNMGNHLPLLPRESEEEHEMEVEDQDSLERKKPRIINFDTSLPTSHTYLGADMEEFHGRTLHDDDSCQVIPVLPQVWMILDPGQTLPLQLFHPQEVSMVRNLIQKDRTFAVLAYSNVQEREAQFGTTAEIYAYREEQDFGILIVKVKAIGRQRFKVLELRTQSDGIQQAKVQILPEWVLPSTMSAVQLESLNKCQIFPSFPVSREDQCSYKWWQKYQKRKFHCANLTSWPRWLYSLYDAETLMDRIKKQLREWDENLKDDSLPSNPIDFSYRVAACLPIDDVLRIQLLKIGSAIQRLRCELCIMNKCTSLCCKQCQETEITTKNEIFSLEGGGPITAFVNWHGEVHETLEVYKACNLNLIGRPSTEHSWFPGYAWTVAQCKICASHIGWKFTATKKDMSPQKFWGLCRWALLPTIPDTEDEISPDKVILCL
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 (00:07:56)
[INFO] Main: Simulation completed successfully. (00:08:00)
|
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 | 0.2032 | |
| 2 | H | A | -1.2709 | |
| 3 | G | A | -1.8721 | |
| 4 | E | A | -2.8703 | |
| 5 | G | A | -2.8872 | |
| 6 | D | A | -3.5416 | |
| 7 | P | A | -2.9631 | |
| 8 | Q | A | -3.5311 | |
| 9 | D | A | -4.0725 | |
| 10 | E | A | -3.8621 | |
| 11 | A | A | -2.7224 | |
| 12 | H | A | -2.9975 | |
| 13 | N | A | -2.1903 | |
| 14 | M | A | 0.0000 | |
| 15 | G | A | -1.2155 | |
| 16 | N | A | -1.8517 | |
| 17 | H | A | -1.3569 | |
| 18 | L | A | 0.0161 | |
| 19 | P | A | 0.8469 | |
| 20 | L | A | 1.9427 | |
| 21 | L | A | 1.4816 | |
| 22 | P | A | -0.4935 | |
| 23 | R | A | -2.5851 | |
| 24 | E | A | -3.2311 | |
| 25 | S | A | -3.0954 | |
| 26 | E | A | -4.1697 | |
| 27 | E | A | -4.3575 | |
| 28 | E | A | -4.2013 | |
| 29 | H | A | -3.5497 | |
| 30 | E | A | -3.0055 | |
| 31 | M | A | -1.3724 | |
| 32 | E | A | -1.7569 | |
| 33 | V | A | -0.6885 | |
| 34 | E | A | -2.7267 | |
| 35 | D | A | -3.4889 | |
| 36 | Q | A | -2.8797 | |
| 37 | D | A | -3.1987 | |
| 38 | S | A | -1.5253 | |
| 39 | L | A | -0.7892 | |
| 40 | E | A | -2.7637 | |
| 41 | R | A | -3.3993 | |
| 42 | K | A | -3.3666 | |
| 43 | K | A | -2.3329 | |
| 44 | P | A | 0.0000 | |
| 45 | R | A | -1.6660 | |
| 46 | I | A | 0.9476 | |
| 47 | I | A | 0.2226 | |
| 48 | N | A | -0.8623 | |
| 49 | F | A | -0.8397 | |
| 50 | D | A | -1.7456 | |
| 51 | T | A | -0.9519 | |
| 52 | S | A | -0.6911 | |
| 53 | L | A | -0.1441 | |
| 54 | P | A | 0.0000 | |
| 55 | T | A | -0.0912 | |
| 56 | S | A | -0.0445 | |
| 57 | H | A | 0.0000 | |
| 58 | T | A | -0.0422 | |
| 59 | Y | A | 0.2558 | |
| 60 | L | A | 0.0000 | |
| 61 | G | A | -0.5613 | |
| 62 | A | A | -1.0466 | |
| 63 | D | A | -2.5121 | |
| 64 | M | A | -2.4033 | |
| 65 | E | A | -3.1708 | |
| 66 | E | A | -2.9916 | |
| 67 | F | A | -1.7319 | |
| 68 | H | A | -1.8317 | |
| 69 | G | A | -1.7815 | |
| 70 | R | A | -2.2440 | |
| 71 | T | A | -1.1414 | |
| 72 | L | A | -0.6910 | |
| 73 | H | A | -1.5370 | |
| 74 | D | A | -2.9717 | |
| 75 | D | A | -3.4675 | |
| 76 | D | A | -3.1122 | |
| 77 | S | A | -1.8969 | |
| 78 | C | A | -0.2712 | |
| 79 | Q | A | 0.2336 | |
| 80 | V | A | 1.1766 | |
| 81 | I | A | 0.0000 | |
| 82 | P | A | -0.1849 | |
| 83 | V | A | 0.0000 | |
| 84 | L | A | 0.0000 | |
| 85 | P | A | -0.4971 | |
| 86 | Q | A | -0.9042 | |
| 87 | V | A | 0.0000 | |
| 88 | W | A | 0.3319 | |
| 89 | M | A | 0.0000 | |
| 90 | I | A | 0.0000 | |
| 91 | L | A | 0.0000 | |
| 92 | D | A | 0.0000 | |
| 93 | P | A | -0.6937 | |
| 94 | G | A | -0.8766 | |
| 95 | Q | A | -0.5196 | |
| 96 | T | A | -0.0621 | |
| 97 | L | A | 0.0000 | |
| 98 | P | A | 0.0000 | |
| 99 | L | A | 0.0000 | |
| 100 | Q | A | -0.0395 | |
| 101 | L | A | 0.0000 | |
| 102 | F | A | 1.8696 | |
| 103 | H | A | 0.5848 | |
| 104 | P | A | 0.1622 | |
| 105 | Q | A | -0.8175 | |
| 106 | E | A | 0.0000 | |
| 107 | V | A | 0.0000 | |
| 108 | S | A | -1.1252 | |
| 109 | M | A | 0.0000 | |
| 110 | V | A | 0.0000 | |
| 111 | R | A | -2.1609 | |
| 112 | N | A | -2.4181 | |
| 113 | L | A | 0.0000 | |
| 114 | I | A | -1.7609 | |
| 115 | Q | A | -2.7333 | |
| 116 | K | A | -3.1690 | |
| 117 | D | A | -2.5787 | |
| 118 | R | A | -1.8095 | |
| 119 | T | A | 0.0000 | |
| 120 | F | A | 0.0000 | |
| 121 | A | A | 0.0000 | |
| 122 | V | A | 0.0000 | |
| 123 | L | A | 0.0000 | |
| 124 | A | A | 0.0000 | |
| 125 | Y | A | 0.0000 | |
| 126 | S | A | -1.1897 | |
| 127 | N | A | -1.8981 | |
| 128 | V | A | -1.4319 | |
| 129 | Q | A | -2.6540 | |
| 130 | E | A | -3.7526 | |
| 131 | R | A | -3.8737 | |
| 132 | E | A | -3.5997 | |
| 133 | A | A | -1.9668 | |
| 134 | Q | A | -1.6969 | |
| 135 | F | A | -0.8403 | |
| 136 | G | A | 0.0000 | |
| 137 | T | A | 0.0000 | |
| 138 | T | A | 0.0000 | |
| 139 | A | A | 0.0000 | |
| 140 | E | A | 0.0000 | |
| 141 | I | A | 0.0000 | |
| 142 | Y | A | -0.9231 | |
| 143 | A | A | 0.0000 | |
| 144 | Y | A | 0.0000 | |
| 145 | R | A | -2.0264 | |
| 146 | E | A | -1.8616 | |
| 147 | E | A | -1.3499 | |
| 148 | Q | A | -1.0459 | |
| 149 | D | A | -0.0702 | |
| 150 | F | A | 1.5763 | |
| 151 | G | A | 0.6703 | |
| 152 | I | A | 1.6476 | |
| 153 | L | A | 0.6777 | |
| 154 | I | A | 0.0000 | |
| 155 | V | A | 0.0000 | |
| 156 | K | A | 0.0000 | |
| 157 | V | A | 0.0000 | |
| 158 | K | A | -0.3051 | |
| 159 | A | A | 0.0000 | |
| 160 | I | A | 0.1734 | |
| 161 | G | A | 0.0000 | |
| 162 | R | A | -0.6395 | |
| 163 | Q | A | -0.6522 | |
| 164 | R | A | 0.0000 | |
| 165 | F | A | 0.0000 | |
| 166 | K | A | -1.1699 | |
| 167 | V | A | 0.0000 | |
| 168 | L | A | 0.1283 | |
| 169 | E | A | -1.0920 | |
| 170 | L | A | -0.9531 | |
| 171 | R | A | -2.1470 | |
| 172 | T | A | -1.7801 | |
| 173 | Q | A | -2.0477 | |
| 174 | S | A | -1.7527 | |
| 175 | D | A | -2.3564 | |
| 176 | G | A | -1.7591 | |
| 177 | I | A | 0.0000 | |
| 178 | Q | A | -1.5066 | |
| 179 | Q | A | -0.9749 | |
| 180 | A | A | 0.0000 | |
| 181 | K | A | -0.5281 | |
| 182 | V | A | 0.0000 | |
| 183 | Q | A | -1.1613 | |
| 184 | I | A | 0.0000 | |
| 185 | L | A | -1.4173 | |
| 186 | P | A | -1.0448 | |
| 187 | E | A | 0.4738 | |
| 188 | W | A | 2.1529 | |
| 189 | V | A | 2.7946 | |
| 190 | L | A | 2.2378 | |
| 191 | P | A | 0.7816 | |
| 192 | S | A | 0.1705 | |
| 193 | T | A | 0.1976 | |
| 194 | M | A | 0.0000 | |
| 195 | S | A | -0.2098 | |
| 196 | A | A | -0.0829 | |
| 197 | V | A | -0.0374 | |
| 198 | Q | A | -0.7228 | |
| 199 | L | A | -0.4260 | |
| 200 | E | A | -2.0350 | |
| 201 | S | A | -1.2206 | |
| 202 | L | A | -1.0419 | |
| 203 | N | A | -1.4630 | |
| 204 | K | A | -1.5566 | |
| 205 | C | A | -0.4914 | |
| 206 | Q | A | -0.1140 | |
| 207 | I | A | 1.6250 | |
| 208 | F | A | 1.4244 | |
| 209 | P | A | 0.9154 | |
| 210 | S | A | 1.2160 | |
| 211 | F | A | 1.9212 | |
| 212 | P | A | 0.8365 | |
| 213 | V | A | 1.3458 | |
| 214 | S | A | -0.9076 | |
| 215 | R | A | -3.0055 | |
| 216 | E | A | -3.4983 | |
| 217 | D | A | -3.4646 | |
| 218 | Q | A | -2.5462 | |
| 219 | C | A | -1.5028 | |
| 220 | S | A | -1.2710 | |
| 221 | Y | A | -0.7114 | |
| 222 | K | A | -1.8053 | |
| 223 | W | A | 0.0000 | |
| 224 | W | A | -0.7557 | |
| 225 | Q | A | -1.8505 | |
| 226 | K | A | -2.1597 | |
| 227 | Y | A | 0.0000 | |
| 228 | Q | A | -1.8379 | |
| 229 | K | A | -2.4893 | |
| 230 | R | A | -1.9422 | |
| 231 | K | A | -1.1766 | |
| 232 | F | A | 0.0000 | |
| 233 | H | A | -1.4898 | |
| 234 | C | A | 0.0000 | |
| 235 | A | A | 0.0000 | |
| 236 | N | A | -0.6426 | |
| 237 | L | A | 0.8398 | |
| 238 | T | A | 0.4439 | |
| 239 | S | A | 0.3080 | |
| 240 | W | A | 1.0873 | |
| 241 | P | A | 0.3780 | |
| 242 | R | A | -0.4543 | |
| 243 | W | A | 1.1420 | |
| 244 | L | A | 1.2132 | |
| 245 | Y | A | 0.9297 | |
| 246 | S | A | 0.0000 | |
| 247 | L | A | 1.0055 | |
| 248 | Y | A | 1.1707 | |
| 249 | D | A | 0.0000 | |
| 250 | A | A | -0.4003 | |
| 251 | E | A | -1.2478 | |
| 252 | T | A | 0.0000 | |
| 253 | L | A | 0.0000 | |
| 254 | M | A | -1.4921 | |
| 255 | D | A | -2.1958 | |
| 256 | R | A | -2.6203 | |
| 257 | I | A | 0.0000 | |
| 258 | K | A | -3.0499 | |
| 259 | K | A | -3.5103 | |
| 260 | Q | A | -2.8437 | |
| 261 | L | A | 0.0000 | |
| 262 | R | A | -4.1556 | |
| 263 | E | A | -3.8240 | |
| 264 | W | A | 0.0000 | |
| 265 | D | A | -2.8353 | |
| 266 | E | A | -3.6133 | |
| 267 | N | A | -3.2594 | |
| 268 | L | A | 0.0000 | |
| 269 | K | A | -4.0516 | |
| 270 | D | A | -3.9406 | |
| 271 | D | A | -3.2938 | |
| 272 | S | A | -2.1992 | |
| 273 | L | A | -2.0466 | |
| 274 | P | A | -1.6120 | |
| 275 | S | A | -1.7151 | |
| 276 | N | A | -1.8637 | |
| 277 | P | A | -1.0228 | |
| 278 | I | A | -0.6940 | |
| 279 | D | A | -2.2441 | |
| 280 | F | A | 0.0000 | |
| 281 | S | A | 0.0000 | |
| 282 | Y | A | 0.0000 | |
| 283 | R | A | -1.0219 | |
| 284 | V | A | 0.0000 | |
| 285 | A | A | 0.0000 | |
| 286 | A | A | -0.2542 | |
| 287 | C | A | 0.0000 | |
| 288 | L | A | 0.0000 | |
| 289 | P | A | 0.0000 | |
| 290 | I | A | 0.0000 | |
| 291 | D | A | 0.1815 | |
| 292 | D | A | 0.3228 | |
| 293 | V | A | 1.3484 | |
| 294 | L | A | 0.0000 | |
| 295 | R | A | 0.0000 | |
| 296 | I | A | 0.1074 | |
| 297 | Q | A | 0.2129 | |
| 298 | L | A | 0.0000 | |
| 299 | L | A | 0.0000 | |
| 300 | K | A | -1.2345 | |
| 301 | I | A | 0.0000 | |
| 302 | G | A | 0.1808 | |
| 303 | S | A | 0.8537 | |
| 304 | A | A | 0.0000 | |
| 305 | I | A | 0.8142 | |
| 306 | Q | A | 0.4733 | |
| 307 | R | A | 0.0000 | |
| 308 | L | A | 0.0000 | |
| 309 | R | A | 0.0526 | |
| 310 | C | A | 0.0000 | |
| 311 | E | A | 0.0000 | |
| 312 | L | A | -0.6656 | |
| 313 | C | A | -0.3853 | |
| 314 | I | A | 0.0000 | |
| 315 | M | A | 0.0000 | |
| 316 | N | A | -1.4819 | |
| 317 | K | A | -1.4209 | |
| 318 | C | A | -0.5979 | |
| 319 | T | A | -0.6801 | |
| 320 | S | A | -0.5953 | |
| 321 | L | A | 0.0000 | |
| 322 | C | A | 0.0000 | |
| 323 | C | A | 0.0000 | |
| 324 | K | A | -1.9948 | |
| 325 | Q | A | -1.8626 | |
| 326 | C | A | -1.5139 | |
| 327 | Q | A | -2.7371 | |
| 328 | E | A | -2.8745 | |
| 329 | T | A | -1.8012 | |
| 330 | E | A | -1.7494 | |
| 331 | I | A | 0.0000 | |
| 332 | T | A | 0.0000 | |
| 333 | T | A | -1.0104 | |
| 334 | K | A | -1.2608 | |
| 335 | N | A | -2.0497 | |
| 336 | E | A | -1.6198 | |
| 337 | I | A | 0.0000 | |
| 338 | F | A | 0.0000 | |
| 339 | S | A | -0.8948 | |
| 340 | L | A | 0.0000 | |
| 341 | E | A | 0.0000 | |
| 342 | G | A | -1.1092 | |
| 343 | G | A | -0.4995 | |
| 344 | G | A | -0.3448 | |
| 345 | P | A | 0.0000 | |
| 346 | I | A | 0.0000 | |
| 347 | T | A | -0.0670 | |
| 348 | A | A | 0.0000 | |
| 349 | F | A | 0.0000 | |
| 350 | V | A | 0.0000 | |
| 351 | N | A | 0.0000 | |
| 352 | W | A | -0.2298 | |
| 353 | H | A | -0.6934 | |
| 354 | G | A | -0.4456 | |
| 355 | E | A | -1.0246 | |
| 356 | V | A | 0.0000 | |
| 357 | H | A | 0.0000 | |
| 358 | E | A | 0.0000 | |
| 359 | T | A | 0.0000 | |
| 360 | L | A | 0.0000 | |
| 361 | E | A | 0.0000 | |
| 362 | V | A | 0.0000 | |
| 363 | Y | A | -1.1375 | |
| 364 | K | A | -1.4405 | |
| 365 | A | A | -0.5863 | |
| 366 | C | A | -1.0551 | |
| 367 | N | A | -0.6924 | |
| 368 | L | A | -0.4234 | |
| 369 | N | A | -0.4720 | |
| 370 | L | A | -0.4968 | |
| 371 | I | A | -0.6297 | |
| 372 | G | A | -1.7268 | |
| 373 | R | A | -2.1322 | |
| 374 | P | A | -1.2638 | |
| 375 | S | A | 0.0000 | |
| 376 | T | A | -1.2273 | |
| 377 | E | A | -2.2284 | |
| 378 | H | A | -1.5569 | |
| 379 | S | A | -0.9651 | |
| 380 | W | A | 0.0000 | |
| 381 | F | A | 0.0000 | |
| 382 | P | A | -0.5813 | |
| 383 | G | A | -0.7316 | |
| 384 | Y | A | 0.0000 | |
| 385 | A | A | -0.8807 | |
| 386 | W | A | 0.0000 | |
| 387 | T | A | 0.0000 | |
| 388 | V | A | 0.0000 | |
| 389 | A | A | 0.0000 | |
| 390 | Q | A | -0.3036 | |
| 391 | C | A | 0.0000 | |
| 392 | K | A | -0.4391 | |
| 393 | I | A | 1.1711 | |
| 394 | C | A | 0.6346 | |
| 395 | A | A | 0.3126 | |
| 396 | S | A | -0.0598 | |
| 397 | H | A | -0.4944 | |
| 398 | I | A | 0.0000 | |
| 399 | G | A | 0.0000 | |
| 400 | W | A | 0.0000 | |
| 401 | K | A | -0.3614 | |
| 402 | F | A | 0.0000 | |
| 403 | T | A | -1.0366 | |
| 404 | A | A | -1.7937 | |
| 405 | T | A | -1.8002 | |
| 406 | K | A | -3.3073 | |
| 407 | K | A | -3.6364 | |
| 408 | D | A | -3.4137 | |
| 409 | M | A | 0.0000 | |
| 410 | S | A | -1.2919 | |
| 411 | P | A | 0.0000 | |
| 412 | Q | A | -2.2059 | |
| 413 | K | A | -1.1479 | |
| 414 | F | A | 0.0000 | |
| 415 | W | A | 0.0000 | |
| 416 | G | A | 0.0000 | |
| 417 | L | A | 0.0000 | |
| 418 | C | A | 0.0000 | |
| 419 | R | A | 0.0000 | |
| 420 | W | A | 0.4770 | |
| 421 | A | A | 0.0000 | |
| 422 | L | A | 0.0000 | |
| 423 | L | A | -0.8125 | |
| 424 | P | A | -0.3805 | |
| 425 | T | A | -0.7137 | |
| 426 | I | A | -0.3221 | |
| 427 | P | A | -1.3607 | |
| 428 | D | A | -2.7324 | |
| 429 | T | A | -2.7352 | |
| 430 | E | A | -3.3906 | |
| 431 | D | A | -3.3883 | |
| 432 | E | A | -2.7391 | |
| 433 | I | A | -0.4396 | |
| 434 | S | A | -0.7840 | |
| 435 | P | A | -1.3946 | |
| 436 | D | A | -2.1170 | |
| 437 | K | A | -1.0481 | |
| 438 | V | A | 1.0158 | |
| 439 | I | A | 1.8087 | |
| 440 | L | A | 0.0000 | |
| 441 | C | A | 1.4866 | |
| 442 | L | A | 2.0475 |
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