| Chain sequence(s) |
A: MMRARFPLLLLGLVFLASVSVSFGIAYWEKENPKHNKCLQSCNSERDSYRNQACHARCNLLKVEKEECEEGEIPRPRPRPQHPEREPQQPGEKEEDEDEQPRPIPFPRPQPRQEEEHEQREEQEWPRKEEKRGEKGSEEEDEDEDEEQDERQFPFPRPPHQKEERKQEEDEDEEQQRESEESEDSELRRHKNKNPFLFGSNRFETLFKNQYGRIRVLQRFNQRSPQLQNLRDYRILEFNSKPNTLLLPNHADADYLIVILNGTAILSLVNNDDRDSYRLQSGDALRVPSGTTYYVVNPDNNENLRLITLAIPVNKPGRFESFFLSSTEAQQSYLQGFSRNILEASYDTKFEEINKVLFSREEGQQQGEQRLQESVIVEISKEQIRALSKRAKSSSRKTISSEDKPFNLRSRDPIYSNKLGKFFEITPEKNPQLRDLDIFLSIVDMNEGALLLPHFNSKAIVILVINEGDANIELVGLKEQQQEQQQEEQPLEVRKYRAELSEQDIFVIPAGYPVVVNATSNLNFFAIGINAENNQRNFLAGSQDNVISQIPSQVQELAFPGSAQAVEKLLKNQRESYFVDAQPKKKEEGNKGRKGPLSSILRAFY
input PDB |
| Selected Chain(s) | A |
| Distance of aggregation | 10 Å |
| FoldX usage | Yes |
| pH calculations | Yes |
| alphaCutter usage |
A: MMRARFPLLLLGLVFLASVSVSFGIAYW EKENPKHNKCLQSCNSERDSYRNQACHARCNLLKVEKEECEEGEIPRPRPRPQHPEREPQQPGEKEEDEDEQPRPIPFPRPQPRQEEEHEQREEQEWPRKEEKRGEKGSEEEDEDEDEEQDERQFPFPRPPHQKEERKQEEDEDEEQQRESEESEDS ELRRHKNKNPFLFGSNRFETLFKNQYGRIRVLQRFNQRSPQLQNLRDYRILEFNSKPNTLLLPNHADADYLIVILNGTAILSLVNNDDRDSYRLQSGDALRVPSGTTYYVVNPDNNENLRLITLAIPVNKPGRFESFFLSSTEAQQSYLQGFSRNILEASYDTKFEEINKVLFSREEGQQQGEQRLQESVIVEISKEQIRALSKRAKSSSRKTISSEDKPFNLRSRDPIYSNKLGKFFEITPEKNPQLRDLDIFLSIVDMNEGALLLPHFNSKAIVILVINEGDANIELVGLKEQQQEQQQEEQPLEVRKYRAELSEQDIFVIPAGYPVVVNATSNLNFFAIGINAENNQRNFLAGSQDNVISQIPSQVQELAFPGSAQAVEKLLKNQRESYFVDAQPKKKEEGNKGRKGPLSSILRAFY(Red indicates removed residues) |
| Dynamic mode | No |
| Automated mutations | No |
| Downloads | Download all the data |
| Simulation log |
[INFO] Logger: Verbosity set to: 2 - [INFO] (00:00:01)
[WARNING] runJob: Working directory already exists (possibly overwriting previous results -ow
to prevent this behavior) (00:00:01)
[INFO] runJob: Starting aggrescan3d job on: input.pdb with A chain(s) selected (00:00:01)
[INFO] runJob: Creating pdb object from: input.pdb (00:00:01)
[INFO] PDB: Running AlphaCutter (00:00:01)
[INFO] PDB-Info: The input structure is globular. Max score is recommended for pH analysis. (00:00:13)
[INFO] FoldX: Starting FoldX energy minimization (00:00:13)
[INFO] Analysis: Starting Aggrescan4D on folded.pdb (00:10:34)
[INFO] agg3D: Running pKa-ANI on
/STORAGE/DATA/lcbio/aggreskan/a3bf2db547da905/tmp/folded.pdb (00:10:34)
[INFO] Main: Simulation completed successfully. (00:17:01)
|
The table below lists A4D score for protein residues. Residues with A4D score > 0.0000 are marked by yellow rows.
| residue index | residue name | chain | Aggrescan4D score | mutation |
|---|---|---|---|---|
| 29 | E | A | -3.2114 | |
| 30 | K | A | -3.6460 | |
| 31 | E | A | -3.8456 | |
| 32 | N | A | -3.1227 | |
| 33 | P | A | -2.5209 | |
| 34 | K | A | -2.7439 | |
| 35 | H | A | 0.0000 | |
| 36 | N | A | -2.9367 | |
| 37 | K | A | -2.8875 | |
| 38 | C | A | -2.1708 | |
| 39 | L | A | -1.7279 | |
| 40 | Q | A | -2.4964 | |
| 41 | S | A | -1.9677 | |
| 42 | C | A | 0.0000 | |
| 43 | N | A | -2.2738 | |
| 44 | S | A | -1.8959 | |
| 45 | E | A | -2.4863 | |
| 46 | R | A | -2.6704 | |
| 47 | D | A | -1.6804 | |
| 48 | S | A | -0.9357 | |
| 49 | Y | A | 0.0083 | |
| 50 | R | A | -1.0172 | |
| 51 | N | A | -1.8204 | |
| 52 | Q | A | -1.3522 | |
| 53 | A | A | -0.8331 | |
| 54 | C | A | -0.8590 | |
| 55 | H | A | -0.9827 | |
| 56 | A | A | -0.6177 | |
| 57 | R | A | -0.5841 | |
| 58 | C | A | 0.0000 | |
| 59 | N | A | -0.4600 | |
| 60 | L | A | 0.3534 | |
| 61 | L | A | -1.0956 | |
| 62 | K | A | -2.5179 | |
| 63 | V | A | -1.8190 | |
| 64 | E | A | -3.4352 | |
| 65 | K | A | -4.3332 | |
| 66 | E | A | -4.8883 | |
| 67 | E | A | -4.6400 | |
| 68 | C | A | -3.3866 | |
| 69 | E | A | -4.6307 | |
| 70 | E | A | -4.4672 | |
| 71 | G | A | -3.1417 | |
| 72 | E | A | -2.8780 | |
| 187 | L | A | -1.3487 | |
| 188 | R | A | -3.0858 | |
| 189 | R | A | -3.5419 | |
| 190 | H | A | 0.0000 | |
| 191 | K | A | -3.9039 | |
| 192 | N | A | -3.5742 | |
| 193 | K | A | -3.4185 | |
| 194 | N | A | 0.0000 | |
| 195 | P | A | -1.2809 | |
| 196 | F | A | 0.0000 | |
| 197 | L | A | 0.0000 | |
| 198 | F | A | 0.0000 | |
| 199 | G | A | -1.5637 | |
| 200 | S | A | -1.4914 | |
| 201 | N | A | -2.0878 | |
| 202 | R | A | -2.0588 | |
| 203 | F | A | -1.6343 | |
| 204 | E | A | -2.0324 | |
| 205 | T | A | -0.9893 | |
| 206 | L | A | -0.0235 | |
| 207 | F | A | -0.5571 | |
| 208 | K | A | -1.9350 | |
| 209 | N | A | -1.8565 | |
| 210 | Q | A | -2.1532 | |
| 211 | Y | A | -1.6220 | |
| 212 | G | A | -1.6047 | |
| 213 | R | A | -1.4143 | |
| 214 | I | A | 0.0000 | |
| 215 | R | A | 0.0000 | |
| 216 | V | A | 0.0000 | |
| 217 | L | A | 0.0000 | |
| 218 | Q | A | -1.6872 | |
| 219 | R | A | -1.9805 | |
| 220 | F | A | 0.0000 | |
| 221 | N | A | -2.4009 | |
| 222 | Q | A | -2.1692 | |
| 223 | R | A | -1.4836 | |
| 224 | S | A | 0.0000 | |
| 225 | P | A | -1.6567 | |
| 226 | Q | A | -1.8437 | |
| 227 | L | A | 0.0000 | |
| 228 | Q | A | -2.7872 | |
| 229 | N | A | -2.3946 | |
| 230 | L | A | 0.0000 | |
| 231 | R | A | -2.9368 | |
| 232 | D | A | -2.1274 | |
| 233 | Y | A | -1.0776 | |
| 234 | R | A | -0.8581 | |
| 235 | I | A | 0.0000 | |
| 236 | L | A | 0.0000 | |
| 237 | E | A | 0.0000 | |
| 238 | F | A | 0.0000 | |
| 239 | N | A | -0.9665 | |
| 240 | S | A | 0.0000 | |
| 241 | K | A | -2.4792 | |
| 242 | P | A | -2.3490 | |
| 243 | N | A | -2.1968 | |
| 244 | T | A | 0.0000 | |
| 245 | L | A | -0.4058 | |
| 246 | L | A | 0.0000 | |
| 247 | L | A | 0.0000 | |
| 248 | P | A | 0.2063 | |
| 249 | N | A | 0.0000 | |
| 250 | H | A | -0.2733 | |
| 251 | A | A | 0.0000 | |
| 252 | D | A | -1.2320 | |
| 253 | A | A | 0.0000 | |
| 254 | D | A | 0.0000 | |
| 255 | Y | A | 0.0000 | |
| 256 | L | A | 0.0000 | |
| 257 | I | A | 0.0000 | |
| 258 | V | A | 0.0000 | |
| 259 | I | A | 0.0000 | |
| 260 | L | A | 0.0000 | |
| 261 | N | A | -0.9875 | |
| 262 | G | A | -1.2842 | |
| 263 | T | A | -0.9775 | |
| 264 | A | A | 0.0000 | |
| 265 | I | A | 0.0000 | |
| 266 | L | A | 0.0000 | |
| 267 | S | A | 0.0000 | |
| 268 | L | A | 0.0000 | |
| 269 | V | A | -1.3440 | |
| 270 | N | A | -2.6099 | |
| 271 | N | A | -3.0052 | |
| 272 | D | A | -3.5542 | |
| 273 | D | A | -3.6234 | |
| 274 | R | A | -2.6854 | |
| 275 | D | A | -2.3340 | |
| 276 | S | A | 0.0000 | |
| 277 | Y | A | 0.0000 | |
| 278 | R | A | -1.8046 | |
| 279 | L | A | 0.0000 | |
| 280 | Q | A | -1.0832 | |
| 281 | S | A | -0.7247 | |
| 282 | G | A | 0.0000 | |
| 283 | D | A | 0.0000 | |
| 284 | A | A | 0.0000 | |
| 285 | L | A | 0.0000 | |
| 286 | R | A | -1.2392 | |
| 287 | V | A | 0.0000 | |
| 288 | P | A | -0.4566 | |
| 289 | S | A | -0.1927 | |
| 290 | G | A | -0.2002 | |
| 291 | T | A | 0.0000 | |
| 292 | T | A | -0.2358 | |
| 293 | Y | A | 0.0000 | |
| 294 | Y | A | 0.0000 | |
| 295 | V | A | 0.0000 | |
| 296 | V | A | 0.0000 | |
| 297 | N | A | 0.0000 | |
| 298 | P | A | -1.7573 | |
| 299 | D | A | -2.2166 | |
| 300 | N | A | -2.8464 | |
| 301 | N | A | -2.8236 | |
| 302 | E | A | -2.6599 | |
| 303 | N | A | -2.2072 | |
| 304 | L | A | 0.0000 | |
| 305 | R | A | -0.8582 | |
| 306 | L | A | 0.0000 | |
| 307 | I | A | 0.0000 | |
| 308 | T | A | 0.0000 | |
| 309 | L | A | 0.0000 | |
| 310 | A | A | 0.0000 | |
| 311 | I | A | -0.5828 | |
| 312 | P | A | 0.0000 | |
| 313 | V | A | -1.0090 | |
| 314 | N | A | -2.4517 | |
| 315 | K | A | -3.0136 | |
| 316 | P | A | -2.2022 | |
| 317 | G | A | 0.0000 | |
| 318 | R | A | -3.1634 | |
| 319 | F | A | -2.0668 | |
| 320 | E | A | -2.2192 | |
| 321 | S | A | -0.5866 | |
| 322 | F | A | -0.0007 | |
| 323 | F | A | 0.0000 | |
| 324 | L | A | 0.6564 | |
| 325 | S | A | 0.1747 | |
| 326 | S | A | -0.9092 | |
| 327 | T | A | 0.0000 | |
| 328 | E | A | -3.0838 | |
| 329 | A | A | -1.8276 | |
| 330 | Q | A | -1.2936 | |
| 331 | Q | A | -1.4177 | |
| 332 | S | A | 0.0000 | |
| 333 | Y | A | 0.5678 | |
| 334 | L | A | 0.5276 | |
| 335 | Q | A | -0.3374 | |
| 336 | G | A | -0.1622 | |
| 337 | F | A | 0.9068 | |
| 338 | S | A | -0.2840 | |
| 339 | R | A | -2.1514 | |
| 340 | N | A | -1.4208 | |
| 341 | I | A | 0.8075 | |
| 342 | L | A | 0.0000 | |
| 343 | E | A | -2.0675 | |
| 344 | A | A | -0.9233 | |
| 345 | S | A | -0.4404 | |
| 346 | Y | A | -0.5771 | |
| 347 | D | A | -1.8607 | |
| 348 | T | A | -2.1868 | |
| 349 | K | A | -3.3472 | |
| 350 | F | A | -2.6843 | |
| 351 | E | A | -3.8551 | |
| 352 | E | A | -2.5570 | |
| 353 | I | A | 0.0000 | |
| 354 | N | A | -2.3798 | |
| 355 | K | A | -2.6041 | |
| 356 | V | A | 0.3856 | |
| 357 | L | A | 0.6880 | |
| 358 | F | A | 0.0000 | |
| 359 | S | A | -1.9616 | |
| 360 | R | A | -3.0627 | |
| 361 | E | A | -4.4931 | |
| 362 | E | A | -3.9725 | |
| 363 | G | A | -2.9361 | |
| 364 | Q | A | -3.6809 | |
| 365 | Q | A | -3.2640 | |
| 366 | Q | A | -3.1704 | |
| 367 | G | A | -3.0893 | |
| 368 | E | A | -3.6139 | |
| 369 | Q | A | -3.7578 | |
| 370 | R | A | -3.8305 | |
| 371 | L | A | -2.6283 | |
| 372 | Q | A | -2.7212 | |
| 373 | E | A | -3.1523 | |
| 374 | S | A | 0.0000 | |
| 375 | V | A | 0.0000 | |
| 376 | I | A | 0.0000 | |
| 377 | V | A | -1.3748 | |
| 378 | E | A | -2.2362 | |
| 379 | I | A | 0.0000 | |
| 380 | S | A | -2.4691 | |
| 381 | K | A | -3.6767 | |
| 382 | E | A | -3.7006 | |
| 383 | Q | A | -3.0170 | |
| 384 | I | A | 0.0000 | |
| 385 | R | A | -3.7906 | |
| 386 | A | A | -2.6125 | |
| 387 | L | A | -1.9119 | |
| 388 | S | A | -2.6324 | |
| 389 | K | A | -3.1949 | |
| 390 | R | A | -3.5363 | |
| 391 | A | A | -2.5955 | |
| 392 | K | A | -2.9704 | |
| 393 | S | A | -1.7844 | |
| 394 | S | A | -1.6806 | |
| 395 | S | A | -1.9362 | |
| 396 | R | A | -3.1923 | |
| 397 | K | A | -2.7634 | |
| 398 | T | A | 0.0000 | |
| 399 | I | A | 0.0000 | |
| 400 | S | A | -2.1328 | |
| 401 | S | A | -2.2840 | |
| 402 | E | A | -3.4091 | |
| 403 | D | A | -3.2589 | |
| 404 | K | A | -2.7973 | |
| 405 | P | A | 0.0000 | |
| 406 | F | A | 0.0000 | |
| 407 | N | A | -1.2161 | |
| 408 | L | A | 0.0000 | |
| 409 | R | A | -2.1297 | |
| 410 | S | A | -2.5300 | |
| 411 | R | A | -3.1604 | |
| 412 | D | A | -2.7151 | |
| 413 | P | A | -1.2851 | |
| 414 | I | A | 0.2857 | |
| 415 | Y | A | 0.0281 | |
| 416 | S | A | -0.9551 | |
| 417 | N | A | -1.4102 | |
| 418 | K | A | -2.2120 | |
| 419 | L | A | -1.8085 | |
| 420 | G | A | -1.7134 | |
| 421 | K | A | -1.5616 | |
| 422 | F | A | 0.0000 | |
| 423 | F | A | 0.0000 | |
| 424 | E | A | -0.7431 | |
| 425 | I | A | 0.0000 | |
| 426 | T | A | -1.6836 | |
| 427 | P | A | 0.0000 | |
| 428 | E | A | -2.9753 | |
| 429 | K | A | -2.3684 | |
| 430 | N | A | 0.0000 | |
| 431 | P | A | -2.6912 | |
| 432 | Q | A | 0.0000 | |
| 433 | L | A | 0.0000 | |
| 434 | R | A | -3.6689 | |
| 435 | D | A | -2.9432 | |
| 436 | L | A | 0.0000 | |
| 437 | D | A | -2.2020 | |
| 438 | I | A | 0.0000 | |
| 439 | F | A | 0.0000 | |
| 440 | L | A | 0.0000 | |
| 441 | S | A | 0.0000 | |
| 442 | I | A | 0.0000 | |
| 443 | V | A | 0.0000 | |
| 444 | D | A | -1.6107 | |
| 445 | M | A | 0.0000 | |
| 446 | N | A | -2.9411 | |
| 447 | E | A | -3.1425 | |
| 448 | G | A | -1.7868 | |
| 449 | A | A | 0.0000 | |
| 450 | L | A | -0.4291 | |
| 451 | L | A | 0.0000 | |
| 452 | L | A | 0.0000 | |
| 453 | P | A | 0.1341 | |
| 454 | H | A | 0.0000 | |
| 455 | F | A | 0.0734 | |
| 456 | N | A | 0.0000 | |
| 457 | S | A | -1.0310 | |
| 458 | K | A | -1.2686 | |
| 459 | A | A | 0.0000 | |
| 460 | I | A | -0.2509 | |
| 461 | V | A | 0.0000 | |
| 462 | I | A | 0.0000 | |
| 463 | L | A | 0.0000 | |
| 464 | V | A | 0.0000 | |
| 465 | I | A | 0.0000 | |
| 466 | N | A | 0.0000 | |
| 467 | E | A | -2.1719 | |
| 468 | G | A | -2.2133 | |
| 469 | D | A | -2.2876 | |
| 470 | A | A | 0.0000 | |
| 471 | N | A | -1.4595 | |
| 472 | I | A | 0.0000 | |
| 473 | E | A | -1.8059 | |
| 474 | L | A | 0.0000 | |
| 475 | V | A | -0.0115 | |
| 476 | G | A | 0.0000 | |
| 477 | L | A | -0.1411 | |
| 478 | K | A | -2.0808 | |
| 479 | E | A | -3.1602 | |
| 480 | Q | A | -3.6041 | |
| 481 | Q | A | -3.6764 | |
| 482 | Q | A | -3.8415 | |
| 483 | E | A | -3.9696 | |
| 484 | Q | A | -3.6445 | |
| 485 | Q | A | -3.9480 | |
| 486 | Q | A | -3.8446 | |
| 487 | E | A | -4.1777 | |
| 488 | E | A | -3.5956 | |
| 489 | Q | A | -3.1127 | |
| 490 | P | A | -1.2913 | |
| 491 | L | A | -0.1593 | |
| 492 | E | A | -1.2256 | |
| 493 | V | A | 0.5954 | |
| 494 | R | A | -0.8238 | |
| 495 | K | A | -1.5724 | |
| 496 | Y | A | 0.0000 | |
| 497 | R | A | -2.3690 | |
| 498 | A | A | 0.0000 | |
| 499 | E | A | -1.9789 | |
| 500 | L | A | 0.0000 | |
| 501 | S | A | -1.6810 | |
| 502 | E | A | -1.9918 | |
| 503 | Q | A | -1.2667 | |
| 504 | D | A | -1.3722 | |
| 505 | I | A | 0.0000 | |
| 506 | F | A | 0.0000 | |
| 507 | V | A | 0.0000 | |
| 508 | I | A | 0.0000 | |
| 509 | P | A | -0.2353 | |
| 510 | A | A | -0.2138 | |
| 511 | G | A | -0.1985 | |
| 512 | Y | A | 0.3741 | |
| 513 | P | A | 0.0694 | |
| 514 | V | A | 0.0000 | |
| 515 | V | A | -0.2285 | |
| 516 | V | A | 0.0000 | |
| 517 | N | A | -1.0914 | |
| 518 | A | A | 0.0000 | |
| 519 | T | A | -1.6409 | |
| 520 | S | A | -2.2608 | |
| 521 | N | A | -2.9831 | |
| 522 | L | A | 0.0000 | |
| 523 | N | A | -1.5112 | |
| 524 | F | A | 0.0000 | |
| 525 | F | A | 0.0000 | |
| 526 | A | A | 0.0000 | |
| 527 | I | A | 0.0000 | |
| 528 | G | A | 0.0000 | |
| 529 | I | A | 0.0000 | |
| 530 | N | A | -1.3484 | |
| 531 | A | A | 0.0000 | |
| 532 | E | A | -2.6296 | |
| 533 | N | A | -2.5478 | |
| 534 | N | A | -1.9746 | |
| 535 | Q | A | -1.9320 | |
| 536 | R | A | -1.2205 | |
| 537 | N | A | -0.8419 | |
| 538 | F | A | 0.0000 | |
| 539 | L | A | 0.1695 | |
| 540 | A | A | -0.8559 | |
| 541 | G | A | 0.0000 | |
| 542 | S | A | -2.4724 | |
| 543 | Q | A | -2.3427 | |
| 544 | D | A | -2.2425 | |
| 545 | N | A | 0.0000 | |
| 546 | V | A | -0.1578 | |
| 547 | I | A | 0.1511 | |
| 548 | S | A | -0.9512 | |
| 549 | Q | A | -0.9608 | |
| 550 | I | A | -0.0826 | |
| 551 | P | A | -0.5373 | |
| 552 | S | A | -1.0863 | |
| 553 | Q | A | -0.9527 | |
| 554 | V | A | 0.5885 | |
| 555 | Q | A | 0.0000 | |
| 556 | E | A | -1.2243 | |
| 557 | L | A | 0.8654 | |
| 558 | A | A | 0.6526 | |
| 559 | F | A | 0.4884 | |
| 560 | P | A | -0.1628 | |
| 561 | G | A | -0.6828 | |
| 562 | S | A | -1.3929 | |
| 563 | A | A | 0.0000 | |
| 564 | Q | A | -2.0390 | |
| 565 | A | A | -1.3995 | |
| 566 | V | A | 0.0000 | |
| 567 | E | A | -2.0786 | |
| 568 | K | A | -2.5552 | |
| 569 | L | A | -0.6304 | |
| 570 | L | A | -1.5035 | |
| 571 | K | A | -3.2593 | |
| 572 | N | A | -2.8592 | |
| 573 | Q | A | -2.6160 | |
| 574 | R | A | -3.4075 | |
| 575 | E | A | -2.6835 | |
| 576 | S | A | 0.0000 | |
| 577 | Y | A | -0.4516 | |
| 578 | F | A | 0.0000 | |
| 579 | V | A | 0.0000 | |
| 580 | D | A | -1.7153 | |
| 581 | A | A | -1.2499 | |
| 582 | Q | A | -2.2658 | |
| 583 | P | A | -3.0296 | |
| 584 | K | A | -4.4606 | |
| 585 | K | A | -4.9690 | |
| 586 | K | A | -5.4048 | |
| 587 | E | A | -5.6501 | |
| 588 | E | A | -5.5990 | |
| 589 | G | A | -4.6129 | |
| 590 | N | A | -4.9670 | |
| 591 | K | A | -4.8000 | |
| 592 | G | A | -3.8788 | |
| 593 | R | A | -4.2018 | |
| 594 | K | A | -3.3216 | |
| 595 | G | A | -1.6944 | |
| 596 | P | A | -0.4946 | |
| 597 | L | A | 1.1940 | |
| 598 | S | A | 0.9937 | |
| 599 | S | A | 1.1349 | |
| 600 | I | A | 2.3740 | |
| 601 | L | A | 1.8412 | |
| 602 | R | A | 0.1853 | |
| 603 | A | A | 1.1378 | |
| 604 | F | A | 2.3312 | |
| 605 | Y | A | 1.9627 |
Calculations for various pH values
This page contains details and comparisons for all models calculated at different pH points.
Please find suggestions on interpreting the results below. More details can be found in the Tutorial.
The input structure is globular. Max score is recommended for pH analysis.
pH |
Average A4D Score |
Max A4D Score |
|||
| 4.0 | -1.306 | 4.3351 | View | CSV | PDB |
| 4.5 | -1.3913 | 4.3351 | View | CSV | PDB |
| 5.0 | -1.5003 | 4.3351 | View | CSV | PDB |
| 5.5 | -1.6102 | 4.3351 | View | CSV | PDB |
| 6.0 | -1.6956 | 4.3351 | View | CSV | PDB |
| 6.5 | -1.7368 | 4.3351 | View | CSV | PDB |
| 7.0 | -1.7297 | 4.3351 | View | CSV | PDB |
| 7.5 | -1.6876 | 4.335 | View | CSV | PDB |
| 8.0 | -1.6268 | 4.3348 | View | CSV | PDB |
| 8.5 | -1.5562 | 4.3342 | View | CSV | PDB |
| 9.0 | -1.4795 | 4.3322 | View | CSV | PDB |
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