| Chain sequence(s) |
A: FRDCADVYQAGFNKSGIYTIYINNMPEPKKVFCNMDVNGGGWTVIQHREDGSLDFQRGWKEYKMGFGNPSGEYWLGNEFIFAITSQRQYMLRIELMDWEGNRAYSQYDRFHIGNEKQNYRLYLKGHTGTAGKQSSLILHGADFSTKDADNDNCMCKCALMLTGGWWFDACGPSNLNGMFYTAGQNHGKLNGIKWHYFKGPSYSLRSTTMMIRPLD B: FRDCADVYQAGFNKSGIYTIYINNMPEPKKVFCNMDVNGGGWTVIQHREDGSLDFQRGWKEYKMGFGNPSGEYWLGNEFIFAITSQRQYMLRIELMDWEGNRAYSQYDRFHIGNEKQNYRLYLKGHTGTAGKQSSLILHGADFSTKDADNDNCMCKCALMLTGGWWFDACGPSNLNGMFYTAGQNHGKLNGIKWHYFKGPSYSLRSTTMMIRPLD |
| Distance of aggregation | 10 Å |
| Dynamic mode | No |
| Mutated residues | IA299I, TA301L |
| Energy difference between WT (input) and mutated protein (by FoldX) | -1.29708 kcal/mol
Changes in protein stability upon mutation are calculated using the FoldX forcefield. Computational prediction of protein stability is used with the intention of preventing the experimental characterization of proteins bearing mutations that significantly destabilize their structure. Mutations resulting in a predicted reduction in protein stability ≥ 1 kcal/mol are considered disruptive. |
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 | |
| 283 | F | A | 1.8298 | |
| 284 | R | A | 0.3790 | |
| 285 | D | A | 0.0000 | |
| 286 | C | A | 0.0000 | |
| 287 | A | A | -0.1503 | |
| 288 | D | A | 0.0000 | |
| 289 | V | A | 0.0000 | |
| 290 | Y | A | -0.1625 | |
| 291 | Q | A | -0.7521 | |
| 292 | A | A | -0.0964 | |
| 293 | G | A | -0.4997 | |
| 294 | F | A | 0.1989 | |
| 295 | N | A | -1.7558 | |
| 296 | K | A | -2.0936 | |
| 297 | S | A | -1.0792 | |
| 298 | G | A | 0.0139 | |
| 299 | I | A | 0.4762 | mutated: IA299I |
| 300 | Y | A | 0.7449 | |
| 301 | L | A | 0.7918 | mutated: TA301L |
| 302 | I | A | 0.0000 | |
| 303 | Y | A | 0.6744 | |
| 304 | I | A | 0.0000 | |
| 305 | N | A | -1.7115 | |
| 306 | N | A | -1.9470 | |
| 307 | M | A | -1.3867 | |
| 308 | P | A | -1.4556 | |
| 309 | E | A | -2.2054 | |
| 310 | P | A | -1.0044 | |
| 311 | K | A | -0.9390 | |
| 312 | K | A | -1.1029 | |
| 313 | V | A | 0.0000 | |
| 314 | F | A | 0.3314 | |
| 315 | C | A | 0.0000 | |
| 316 | N | A | -1.0832 | |
| 317 | M | A | 0.0000 | |
| 318 | D | A | -2.6886 | |
| 319 | V | A | -1.4966 | |
| 320 | N | A | -1.8802 | |
| 321 | G | A | -1.5950 | |
| 322 | G | A | 0.0000 | |
| 323 | G | A | 0.0000 | |
| 324 | W | A | 0.0000 | |
| 325 | T | A | 0.0000 | |
| 326 | V | A | 0.0000 | |
| 327 | I | A | 0.0000 | |
| 328 | Q | A | 0.0000 | |
| 329 | H | A | -0.9680 | |
| 330 | R | A | 0.0000 | |
| 331 | E | A | -2.8828 | |
| 332 | D | A | -2.8515 | |
| 333 | G | A | -1.6920 | |
| 334 | S | A | -1.3772 | |
| 335 | L | A | -1.3801 | |
| 336 | D | A | -1.5295 | |
| 337 | F | A | 0.0000 | |
| 338 | Q | A | -1.3989 | |
| 339 | R | A | -1.9684 | |
| 340 | G | A | -1.9666 | |
| 341 | W | A | -1.9084 | |
| 342 | K | A | -2.3322 | |
| 343 | E | A | -1.7713 | |
| 344 | Y | A | 0.0000 | |
| 345 | K | A | -1.1036 | |
| 346 | M | A | -0.5458 | |
| 347 | G | A | -0.7377 | |
| 348 | F | A | -0.8394 | |
| 349 | G | A | -1.2801 | |
| 350 | N | A | -1.6194 | |
| 351 | P | A | -0.8464 | |
| 352 | S | A | -0.6653 | |
| 353 | G | A | -1.3215 | |
| 354 | E | A | 0.0000 | |
| 355 | Y | A | 0.0000 | |
| 356 | W | A | 0.0000 | |
| 357 | L | A | 0.0000 | |
| 358 | G | A | 0.0000 | |
| 359 | N | A | 0.0000 | |
| 360 | E | A | -0.5292 | |
| 361 | F | A | 0.0000 | |
| 362 | I | A | 0.0000 | |
| 363 | F | A | 0.1367 | |
| 364 | A | A | 0.0000 | |
| 365 | I | A | 0.0000 | |
| 366 | T | A | 0.0000 | |
| 367 | S | A | -0.8436 | |
| 368 | Q | A | 0.0000 | |
| 369 | R | A | -1.3131 | |
| 370 | Q | A | -1.0855 | |
| 371 | Y | A | 0.0000 | |
| 372 | M | A | -0.8303 | |
| 373 | L | A | 0.0000 | |
| 374 | R | A | 0.0000 | |
| 375 | I | A | 0.0000 | |
| 376 | E | A | 0.0000 | |
| 377 | L | A | 0.0000 | |
| 378 | M | A | -1.5339 | |
| 379 | D | A | 0.0000 | |
| 380 | W | A | -1.5753 | |
| 381 | E | A | -2.6035 | |
| 382 | G | A | -2.2642 | |
| 383 | N | A | -2.6910 | |
| 384 | R | A | -2.5060 | |
| 385 | A | A | 0.0000 | |
| 386 | Y | A | -0.0228 | |
| 387 | S | A | 0.0000 | |
| 388 | Q | A | -0.7639 | |
| 389 | Y | A | 0.0000 | |
| 390 | D | A | -2.0033 | |
| 391 | R | A | 0.0000 | |
| 392 | F | A | 0.0000 | |
| 393 | H | A | 0.0000 | |
| 394 | I | A | 0.0000 | |
| 395 | G | A | 0.0000 | |
| 396 | N | A | -1.1263 | |
| 397 | E | A | -1.7814 | |
| 398 | K | A | -2.3501 | |
| 399 | Q | A | 0.0000 | |
| 400 | N | A | -1.2395 | |
| 401 | Y | A | 0.0000 | |
| 402 | R | A | 0.0000 | |
| 403 | L | A | 0.0000 | |
| 404 | Y | A | 0.0000 | |
| 405 | L | A | 0.0000 | |
| 406 | K | A | -1.2971 | |
| 407 | G | A | -1.3805 | |
| 408 | H | A | -1.4849 | |
| 409 | T | A | -1.2538 | |
| 410 | G | A | -0.8015 | |
| 411 | T | A | -0.7267 | |
| 412 | A | A | 0.0000 | |
| 413 | G | A | -1.1481 | |
| 414 | K | A | -2.2763 | |
| 415 | Q | A | -1.9780 | |
| 416 | S | A | 0.0000 | |
| 417 | S | A | 0.0000 | |
| 418 | L | A | 0.0000 | |
| 419 | I | A | -0.0670 | |
| 420 | L | A | -0.1270 | |
| 421 | H | A | -0.6989 | |
| 422 | G | A | 0.0000 | |
| 423 | A | A | 0.0000 | |
| 424 | D | A | 0.0000 | |
| 425 | F | A | 0.0000 | |
| 426 | S | A | 0.0000 | |
| 427 | T | A | 0.0000 | |
| 428 | K | A | -2.2480 | |
| 429 | D | A | -2.9650 | |
| 430 | A | A | -2.4793 | |
| 431 | D | A | -2.7272 | |
| 432 | N | A | -1.9552 | |
| 433 | D | A | -1.3594 | |
| 434 | N | A | -1.0438 | |
| 435 | C | A | -0.3485 | |
| 436 | M | A | 0.5434 | |
| 437 | C | A | 0.0451 | |
| 438 | K | A | -1.2925 | |
| 439 | C | A | 0.0000 | |
| 440 | A | A | 0.0000 | |
| 441 | L | A | 0.3358 | |
| 442 | M | A | 1.0917 | |
| 443 | L | A | 0.0000 | |
| 444 | T | A | 0.0268 | |
| 445 | G | A | 0.0000 | |
| 446 | G | A | 0.0000 | |
| 447 | W | A | 0.0000 | |
| 448 | W | A | 0.0000 | |
| 449 | F | A | 0.0000 | |
| 450 | D | A | -0.7876 | |
| 451 | A | A | -0.3554 | |
| 452 | C | A | -0.2276 | |
| 453 | G | A | -0.3592 | |
| 454 | P | A | -0.2302 | |
| 455 | S | A | 0.0000 | |
| 456 | N | A | 0.0000 | |
| 457 | L | A | 0.0000 | |
| 458 | N | A | 0.0000 | |
| 459 | G | A | 0.0000 | |
| 460 | M | A | 0.0600 | |
| 461 | F | A | -0.5449 | |
| 462 | Y | A | -0.4291 | |
| 463 | T | A | -0.4184 | |
| 464 | A | A | -0.8518 | |
| 465 | G | A | 0.0000 | |
| 466 | Q | A | -1.9678 | |
| 467 | N | A | -2.2097 | |
| 468 | H | A | -2.1001 | |
| 469 | G | A | -1.7516 | |
| 470 | K | A | -1.5423 | |
| 471 | L | A | 0.4739 | |
| 472 | N | A | 0.3608 | |
| 473 | G | A | 0.0000 | |
| 474 | I | A | 0.0000 | |
| 475 | K | A | 0.0000 | |
| 476 | W | A | 0.0000 | |
| 477 | H | A | -0.3552 | |
| 478 | Y | A | -0.3670 | |
| 479 | F | A | -0.1879 | |
| 480 | K | A | -0.4880 | |
| 481 | G | A | -0.2080 | |
| 482 | P | A | -0.2872 | |
| 483 | S | A | -0.8531 | |
| 484 | Y | A | -0.9196 | |
| 485 | S | A | 0.0000 | |
| 486 | L | A | 0.0000 | |
| 487 | R | A | -1.7524 | |
| 488 | S | A | -1.4725 | |
| 489 | T | A | 0.0000 | |
| 490 | T | A | -0.2643 | |
| 491 | M | A | 0.0000 | |
| 492 | M | A | 0.0000 | |
| 493 | I | A | 0.0000 | |
| 494 | R | A | -0.4342 | |
| 495 | P | A | 0.0000 | |
| 496 | L | A | -0.6752 | |
| 497 | D | A | -1.5628 | |
| 283 | F | B | 1.7471 | |
| 284 | R | B | 0.3212 | |
| 285 | D | B | 0.0000 | |
| 286 | C | B | 0.0000 | |
| 287 | A | B | -0.1600 | |
| 288 | D | B | 0.0000 | |
| 289 | V | B | 0.0000 | |
| 290 | Y | B | -0.2172 | |
| 291 | Q | B | -0.7866 | |
| 292 | A | B | -0.1452 | |
| 293 | G | B | -0.5839 | |
| 294 | F | B | 0.0255 | |
| 295 | N | B | -1.8251 | |
| 296 | K | B | -2.1504 | |
| 297 | S | B | -1.1172 | |
| 298 | G | B | -0.0589 | |
| 299 | I | B | 0.1538 | |
| 300 | Y | B | 0.2520 | |
| 301 | T | B | -0.0647 | |
| 302 | I | B | 0.0000 | |
| 303 | Y | B | 0.4820 | |
| 304 | I | B | 0.0000 | |
| 305 | N | B | -1.7071 | |
| 306 | N | B | -1.9483 | |
| 307 | M | B | -1.4054 | |
| 308 | P | B | -1.4677 | |
| 309 | E | B | -2.2480 | |
| 310 | P | B | -1.2693 | |
| 311 | K | B | -1.3237 | |
| 312 | K | B | -1.6583 | |
| 313 | V | B | 0.0000 | |
| 314 | F | B | 0.1597 | |
| 315 | C | B | 0.0000 | |
| 316 | N | B | -1.0719 | |
| 317 | M | B | 0.0000 | |
| 318 | D | B | -2.6646 | |
| 319 | V | B | -1.4601 | |
| 320 | N | B | -1.8619 | |
| 321 | G | B | -1.5794 | |
| 322 | G | B | 0.0000 | |
| 323 | G | B | 0.0000 | |
| 324 | W | B | 0.0000 | |
| 325 | T | B | 0.0000 | |
| 326 | V | B | 0.0000 | |
| 327 | I | B | 0.0000 | |
| 328 | Q | B | 0.0000 | |
| 329 | H | B | -0.8483 | |
| 330 | R | B | 0.0000 | |
| 331 | E | B | -2.5525 | |
| 332 | D | B | -2.6945 | |
| 333 | G | B | -1.7079 | |
| 334 | S | B | -1.3931 | |
| 335 | L | B | -1.5639 | |
| 336 | D | B | -1.9817 | |
| 337 | F | B | 0.0000 | |
| 338 | Q | B | -1.7051 | |
| 339 | R | B | -2.2490 | |
| 340 | G | B | 0.0000 | |
| 341 | W | B | -2.0419 | |
| 342 | K | B | -2.4415 | |
| 343 | E | B | -2.0350 | |
| 344 | Y | B | 0.0000 | |
| 345 | K | B | -1.1825 | |
| 346 | M | B | -0.6182 | |
| 347 | G | B | -0.8797 | |
| 348 | F | B | 0.0000 | |
| 349 | G | B | -1.4019 | |
| 350 | N | B | -1.6590 | |
| 351 | P | B | -0.9044 | |
| 352 | S | B | -0.6800 | |
| 353 | G | B | -1.1730 | |
| 354 | E | B | 0.0000 | |
| 355 | Y | B | 0.0000 | |
| 356 | W | B | 0.0000 | |
| 357 | L | B | 0.0000 | |
| 358 | G | B | 0.0000 | |
| 359 | N | B | 0.0000 | |
| 360 | E | B | -0.5304 | |
| 361 | F | B | 0.0000 | |
| 362 | I | B | 0.0000 | |
| 363 | F | B | 0.1165 | |
| 364 | A | B | 0.0000 | |
| 365 | I | B | 0.0000 | |
| 366 | T | B | 0.0000 | |
| 367 | S | B | -0.8850 | |
| 368 | Q | B | 0.0000 | |
| 369 | R | B | -1.4215 | |
| 370 | Q | B | -1.2523 | |
| 371 | Y | B | 0.0000 | |
| 372 | M | B | 0.0000 | |
| 373 | L | B | 0.0000 | |
| 374 | R | B | 0.0000 | |
| 375 | I | B | 0.0000 | |
| 376 | E | B | 0.0000 | |
| 377 | L | B | 0.0000 | |
| 378 | M | B | -1.6147 | |
| 379 | D | B | 0.0000 | |
| 380 | W | B | -1.5756 | |
| 381 | E | B | -2.6084 | |
| 382 | G | B | -2.2969 | |
| 383 | N | B | -2.7535 | |
| 384 | R | B | -2.6148 | |
| 385 | A | B | 0.0000 | |
| 386 | Y | B | -0.0584 | |
| 387 | S | B | 0.0000 | |
| 388 | Q | B | -0.9058 | |
| 389 | Y | B | 0.0000 | |
| 390 | D | B | -2.2667 | |
| 391 | R | B | -1.4649 | |
| 392 | F | B | 0.0000 | |
| 393 | H | B | 0.0000 | |
| 394 | I | B | 0.0000 | |
| 395 | G | B | 0.0000 | |
| 396 | N | B | -1.0719 | |
| 397 | E | B | -1.6488 | |
| 398 | K | B | -2.2589 | |
| 399 | Q | B | 0.0000 | |
| 400 | N | B | -1.1774 | |
| 401 | Y | B | 0.0000 | |
| 402 | R | B | 0.0000 | |
| 403 | L | B | 0.0000 | |
| 404 | Y | B | 0.0000 | |
| 405 | L | B | 0.0000 | |
| 406 | K | B | -1.4946 | |
| 407 | G | B | -1.5877 | |
| 408 | H | B | -1.8182 | |
| 409 | T | B | -1.3590 | |
| 410 | G | B | -0.8015 | |
| 411 | T | B | -0.6801 | |
| 412 | A | B | 0.0000 | |
| 413 | G | B | -1.0870 | |
| 414 | K | B | -2.2044 | |
| 415 | Q | B | -1.8188 | |
| 416 | S | B | -0.9652 | |
| 417 | S | B | 0.0000 | |
| 418 | L | B | 0.0000 | |
| 419 | I | B | -0.1051 | |
| 420 | L | B | -0.2808 | |
| 421 | H | B | -0.7572 | |
| 422 | G | B | 0.0000 | |
| 423 | A | B | 0.0000 | |
| 424 | D | B | 0.0000 | |
| 425 | F | B | 0.0000 | |
| 426 | S | B | 0.0000 | |
| 427 | T | B | 0.0000 | |
| 428 | K | B | -2.6972 | |
| 429 | D | B | -3.1637 | |
| 430 | A | B | -2.6099 | |
| 431 | D | B | -2.7592 | |
| 432 | N | B | -1.9788 | |
| 433 | D | B | -1.2960 | |
| 434 | N | B | -0.9832 | |
| 435 | C | B | -0.2603 | |
| 436 | M | B | 0.5990 | |
| 437 | C | B | 0.1863 | |
| 438 | K | B | -1.0476 | |
| 439 | C | B | 0.0000 | |
| 440 | A | B | 0.0000 | |
| 441 | L | B | 0.5024 | |
| 442 | M | B | 1.2540 | |
| 443 | L | B | 0.0000 | |
| 444 | T | B | 0.0003 | |
| 445 | G | B | 0.0000 | |
| 446 | G | B | 0.0000 | |
| 447 | W | B | 0.0000 | |
| 448 | W | B | 0.0000 | |
| 449 | F | B | 0.0000 | |
| 450 | D | B | -0.7532 | |
| 451 | A | B | -0.2944 | |
| 452 | C | B | -0.1648 | |
| 453 | G | B | -0.3389 | |
| 454 | P | B | -0.1555 | |
| 455 | S | B | 0.0000 | |
| 456 | N | B | 0.0000 | |
| 457 | L | B | 0.0000 | |
| 458 | N | B | 0.0000 | |
| 459 | G | B | 0.0000 | |
| 460 | M | B | -0.0206 | |
| 461 | F | B | -0.6013 | |
| 462 | Y | B | -0.4681 | |
| 463 | T | B | -0.6072 | |
| 464 | A | B | -0.8572 | |
| 465 | G | B | 0.0000 | |
| 466 | Q | B | -1.9307 | |
| 467 | N | B | -2.1900 | |
| 468 | H | B | -2.1046 | |
| 469 | G | B | -1.8120 | |
| 470 | K | B | -1.5569 | |
| 471 | L | B | 0.4813 | |
| 472 | N | B | 0.4163 | |
| 473 | G | B | 0.0000 | |
| 474 | I | B | 0.0000 | |
| 475 | K | B | 0.0000 | |
| 476 | W | B | 0.0000 | |
| 477 | H | B | -0.2139 | |
| 478 | Y | B | -0.1098 | |
| 479 | F | B | -0.0799 | |
| 480 | K | B | -0.4291 | |
| 481 | G | B | -0.1237 | |
| 482 | P | B | -0.2334 | |
| 483 | S | B | -0.8566 | |
| 484 | Y | B | -0.9080 | |
| 485 | S | B | 0.0000 | |
| 486 | L | B | 0.0000 | |
| 487 | R | B | -1.8025 | |
| 488 | S | B | -1.4321 | |
| 489 | T | B | 0.0000 | |
| 490 | T | B | -0.2195 | |
| 491 | M | B | 0.0000 | |
| 492 | M | B | 0.0000 | |
| 493 | I | B | 0.0000 | |
| 494 | R | B | -0.5282 | |
| 495 | P | B | 0.0000 | |
| 496 | L | B | -0.8800 | |
| 497 | D | B | -1.6385 |
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