| Chain sequence(s) |
A: EQIKEIKKEQLSGSPWILLRENEVSTLYKGEYHRAPVAIKVFKKLQAGSIAIVRQTFNKEIKTMKKFESPNILRIFGICIDETVTPPQFSIVMEYCELGTLRELLDREKDLTLGKRMVLVLGAARGLYRLHHSEAPELHGKIRSSNFLVTQGYQVKLAGFELRKTQTSMSLGTTREKTDRVKSTAYLSPQELEDVFYQYDVKSEIYSFGIVLWEIATGDIPFQGCNSEKIRKLVAVKRQQEPLGEDCPSELREIIDECRAHDPSVRPSVDEILKKLSTFSK
C: VPTKLEVVAATPTSLLISWDAPAVTVDLYIITYGETGGNSPVQTFEVPGSKSTATISGLSPGVDYTITVYAYSFMYHDYYYPEWSPISINYRT B: EQIKEIKKEQLSGSPWILLRENEVSTLYKGEYHRAPVAIKVFKKLQAGSIAIVRQTFNKEIKTMKKFESPNILRIFGICIDETVTPPQFSIVMEYCELGTLRELLDREKDLTLGKRMVLVLGAARGLYRLHHSEAPELHGKIRSSNFLVTQGYQVKLAGFELRKTQTSMSLGTTREKTDRVKSTAYLSPQELEDVFYQYDVKSEIYSFGIVLWEIATGDIPFQGCNSEKIRKLVAVKRQQEPLGEDCPSELREIIDECRAHDPSVRPSVDEILKKLSTFSK D: VPTKLEVVAATPTSLLISWDAPAVTVDLYIITYGETGGNSPVQTFEVPGSKSTATISGLSPGVDYTITVYAYSFMYHDYYYPEWSPISINYRT input PDB |
| Selected Chain(s) | A,C,B,D |
| 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] (00:00:01)
[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 all chain(s) selected (00:00:01)
[INFO] runJob: Creating pdb object from: input.pdb (00:00:01)
[INFO] FoldX: Starting FoldX energy minimalization (00:00:01)
[INFO] Analysis: Starting Aggrescan3D on folded.pdb (00:27:02)
[INFO] Main: Simulation completed successfully. (00:27:18)
|
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 | |
| 191 | E | A | -2.4870 | |
| 192 | Q | A | -2.4581 | |
| 193 | I | A | -1.7761 | |
| 194 | K | A | -2.2676 | |
| 195 | E | A | -1.5597 | |
| 196 | I | A | 0.0000 | |
| 197 | K | A | -2.8307 | |
| 198 | K | A | -2.6026 | |
| 199 | E | A | -2.9232 | |
| 200 | Q | A | -2.7466 | |
| 201 | L | A | 0.0000 | |
| 202 | S | A | -1.6332 | |
| 203 | G | A | -1.7696 | |
| 204 | S | A | -0.7831 | |
| 205 | P | A | -0.0934 | |
| 206 | W | A | 0.7014 | |
| 207 | I | A | 1.4207 | |
| 208 | L | A | 1.4559 | |
| 209 | L | A | 0.2790 | |
| 210 | R | A | -1.6561 | |
| 211 | E | A | -2.8351 | |
| 212 | N | A | -3.3609 | |
| 213 | E | A | -2.9925 | |
| 214 | V | A | -2.0987 | |
| 215 | S | A | 0.0000 | |
| 216 | T | A | 0.0000 | |
| 217 | L | A | -0.2368 | |
| 218 | Y | A | 0.6269 | |
| 219 | K | A | 0.0383 | |
| 220 | G | A | 0.0000 | |
| 221 | E | A | -1.8221 | |
| 222 | Y | A | -1.8501 | |
| 223 | H | A | -2.1974 | |
| 224 | R | A | -2.6966 | |
| 225 | A | A | -1.5382 | |
| 226 | P | A | -1.1082 | |
| 227 | V | A | 0.0000 | |
| 228 | A | A | 0.0000 | |
| 229 | I | A | 0.0000 | |
| 230 | K | A | -0.5276 | |
| 231 | V | A | -0.2523 | |
| 232 | F | A | 0.0000 | |
| 233 | K | A | -1.7458 | |
| 234 | K | A | -2.2680 | |
| 235 | L | A | 0.0000 | |
| 236 | Q | A | -1.9013 | |
| 237 | A | A | -1.2158 | |
| 238 | G | A | -0.3249 | |
| 239 | S | A | 0.0000 | |
| 240 | I | A | 0.0399 | |
| 241 | A | A | 0.5650 | |
| 242 | I | A | 1.4823 | |
| 243 | V | A | 0.0000 | |
| 244 | R | A | -0.7936 | |
| 245 | Q | A | -1.3495 | |
| 246 | T | A | -1.3761 | |
| 247 | F | A | 0.0000 | |
| 248 | N | A | -2.5239 | |
| 249 | K | A | -3.0282 | |
| 250 | E | A | -2.3752 | |
| 251 | I | A | -2.0074 | |
| 252 | K | A | -2.4914 | |
| 253 | T | A | -1.5999 | |
| 254 | M | A | -1.4681 | |
| 255 | K | A | -1.8927 | |
| 256 | K | A | -2.6642 | |
| 257 | F | A | -1.8268 | |
| 258 | E | A | -2.2680 | |
| 259 | S | A | -1.3346 | |
| 260 | P | A | -0.7510 | |
| 261 | N | A | 0.0000 | |
| 262 | I | A | 0.0000 | |
| 263 | L | A | 0.0000 | |
| 264 | R | A | -0.9032 | |
| 265 | I | A | -0.3169 | |
| 266 | F | A | -0.3906 | |
| 267 | G | A | 0.0000 | |
| 268 | I | A | 0.0000 | |
| 269 | C | A | 0.0000 | |
| 270 | I | A | 0.0000 | |
| 271 | D | A | 0.0000 | |
| 272 | E | A | -1.5967 | |
| 273 | T | A | -0.5220 | |
| 274 | V | A | 0.6363 | |
| 275 | T | A | -0.1428 | |
| 276 | P | A | -0.9271 | |
| 277 | P | A | 0.0000 | |
| 278 | Q | A | -0.7964 | |
| 279 | F | A | 0.0000 | |
| 280 | S | A | 0.0000 | |
| 281 | I | A | 0.0000 | |
| 282 | V | A | 0.0000 | |
| 283 | M | A | -0.0364 | |
| 284 | E | A | -0.3533 | |
| 285 | Y | A | -0.3110 | |
| 286 | C | A | 0.0000 | |
| 287 | E | A | -0.6136 | |
| 288 | L | A | -0.3065 | |
| 289 | G | A | -0.3846 | |
| 290 | T | A | -0.1819 | |
| 291 | L | A | 0.0000 | |
| 292 | R | A | 0.0000 | |
| 293 | E | A | -1.0853 | |
| 294 | L | A | 0.0000 | |
| 295 | L | A | 0.0000 | |
| 296 | D | A | -2.0689 | |
| 297 | R | A | -2.5493 | |
| 298 | E | A | -2.7758 | |
| 299 | K | A | -3.4185 | |
| 300 | D | A | -2.7715 | |
| 301 | L | A | -1.3135 | |
| 302 | T | A | -0.2708 | |
| 303 | L | A | 0.6865 | |
| 304 | G | A | 0.3249 | |
| 305 | K | A | 0.0000 | |
| 306 | R | A | 0.0000 | |
| 307 | M | A | 0.0000 | |
| 308 | V | A | 0.0000 | |
| 309 | L | A | 0.0000 | |
| 310 | V | A | 0.0000 | |
| 311 | L | A | 0.0000 | |
| 312 | G | A | 0.0000 | |
| 313 | A | A | 0.0000 | |
| 314 | A | A | 0.0000 | |
| 315 | R | A | 0.0000 | |
| 316 | G | A | 0.0000 | |
| 317 | L | A | 0.0000 | |
| 318 | Y | A | 0.0000 | |
| 319 | R | A | -1.1378 | |
| 320 | L | A | 0.0000 | |
| 321 | H | A | 0.0000 | |
| 322 | H | A | -0.9544 | |
| 323 | S | A | -1.4802 | |
| 324 | E | A | -2.1574 | |
| 325 | A | A | -1.4463 | |
| 326 | P | A | -1.3109 | |
| 327 | E | A | -1.5075 | |
| 328 | L | A | -0.3749 | |
| 329 | H | A | 0.0000 | |
| 330 | G | A | -0.8907 | |
| 331 | K | A | -1.7851 | |
| 332 | I | A | 0.0000 | |
| 333 | R | A | -0.9573 | |
| 334 | S | A | 0.0000 | |
| 335 | S | A | -0.9067 | |
| 336 | N | A | -0.6317 | |
| 337 | F | A | 0.0000 | |
| 338 | L | A | -0.0102 | |
| 339 | V | A | 0.0000 | |
| 340 | T | A | -0.2645 | |
| 341 | Q | A | -0.4342 | |
| 342 | G | A | 0.0000 | |
| 343 | Y | A | 0.0000 | |
| 344 | Q | A | -0.1314 | |
| 345 | V | A | 0.0000 | |
| 346 | K | A | 0.0000 | |
| 347 | L | A | 0.0000 | |
| 348 | A | A | -0.4464 | |
| 349 | G | A | -0.8540 | |
| 350 | F | A | -0.6374 | |
| 351 | E | A | -1.1911 | |
| 352 | L | A | 0.0000 | |
| 353 | R | A | -2.0364 | |
| 354 | K | A | -2.5709 | |
| 355 | T | A | 0.0000 | |
| 356 | Q | A | -1.0253 | |
| 357 | T | A | -0.7377 | |
| 358 | S | A | 0.0402 | |
| 359 | M | A | 0.0000 | |
| 360 | S | A | -0.2599 | |
| 361 | L | A | 0.8398 | |
| 362 | G | A | -0.5527 | |
| 363 | T | A | -1.0094 | |
| 364 | T | A | -1.4599 | |
| 365 | R | A | -3.1596 | |
| 366 | E | A | -3.4965 | |
| 367 | K | A | -3.4984 | |
| 368 | T | A | -2.6985 | |
| 369 | D | A | -3.1327 | |
| 370 | R | A | -3.0377 | |
| 371 | V | A | 0.0000 | |
| 372 | K | A | -2.5445 | |
| 373 | S | A | -1.4923 | |
| 374 | T | A | -0.9698 | |
| 375 | A | A | 0.0000 | |
| 376 | Y | A | 0.0000 | |
| 377 | L | A | -0.2029 | |
| 378 | S | A | 0.0000 | |
| 379 | P | A | 0.0000 | |
| 380 | Q | A | -0.9762 | |
| 381 | E | A | -0.3075 | |
| 382 | L | A | 0.0000 | |
| 383 | E | A | -1.5896 | |
| 384 | D | A | -0.4956 | |
| 385 | V | A | 1.6669 | |
| 386 | F | A | 2.0861 | |
| 387 | Y | A | 0.4783 | |
| 388 | Q | A | -0.3730 | |
| 389 | Y | A | -0.0332 | |
| 390 | D | A | -0.5975 | |
| 391 | V | A | 0.1988 | |
| 392 | K | A | -0.1513 | |
| 393 | S | A | 0.0000 | |
| 394 | E | A | 0.0000 | |
| 395 | I | A | 0.0000 | |
| 396 | Y | A | 0.0000 | |
| 397 | S | A | 0.0000 | |
| 398 | F | A | 0.0000 | |
| 399 | G | A | 0.0000 | |
| 400 | I | A | 0.0000 | |
| 401 | V | A | 0.0000 | |
| 402 | L | A | 0.0000 | |
| 403 | W | A | 0.0000 | |
| 404 | E | A | 0.0000 | |
| 405 | I | A | 0.0000 | |
| 406 | A | A | -0.0712 | |
| 407 | T | A | -0.6522 | |
| 408 | G | A | 0.0000 | |
| 409 | D | A | -1.5065 | |
| 410 | I | A | -1.3470 | |
| 411 | P | A | 0.0000 | |
| 412 | F | A | 0.0000 | |
| 413 | Q | A | -2.1040 | |
| 414 | G | A | -1.4491 | |
| 415 | C | A | -2.1034 | |
| 416 | N | A | -2.9158 | |
| 417 | S | A | -2.7047 | |
| 418 | E | A | -3.5379 | |
| 419 | K | A | -3.4767 | |
| 420 | I | A | 0.0000 | |
| 421 | R | A | -2.8974 | |
| 422 | K | A | -2.4989 | |
| 423 | L | A | -2.0376 | |
| 424 | V | A | 0.0000 | |
| 425 | A | A | -1.4867 | |
| 426 | V | A | -0.2437 | |
| 427 | K | A | -1.7330 | |
| 428 | R | A | -2.9191 | |
| 429 | Q | A | -2.6074 | |
| 430 | Q | A | -1.9882 | |
| 431 | E | A | -1.2584 | |
| 432 | P | A | -1.1806 | |
| 433 | L | A | 0.0000 | |
| 434 | G | A | -1.8298 | |
| 435 | E | A | -2.8856 | |
| 436 | D | A | -2.6785 | |
| 437 | C | A | -1.7457 | |
| 438 | P | A | -1.2126 | |
| 439 | S | A | -1.5362 | |
| 440 | E | A | -1.6569 | |
| 441 | L | A | 0.0000 | |
| 442 | R | A | -2.3399 | |
| 443 | E | A | -2.8226 | |
| 444 | I | A | 0.0000 | |
| 445 | I | A | 0.0000 | |
| 446 | D | A | -2.2669 | |
| 447 | E | A | -1.9461 | |
| 448 | C | A | 0.0000 | |
| 449 | R | A | 0.0000 | |
| 450 | A | A | -1.6641 | |
| 451 | H | A | -2.1723 | |
| 452 | D | A | -1.3189 | |
| 453 | P | A | -0.7654 | |
| 454 | S | A | -0.6884 | |
| 455 | V | A | -0.3835 | |
| 456 | R | A | 0.0000 | |
| 457 | P | A | 0.0000 | |
| 458 | S | A | -0.2710 | |
| 459 | V | A | 0.0000 | |
| 460 | D | A | -0.8542 | |
| 461 | E | A | -1.4543 | |
| 462 | I | A | 0.0000 | |
| 463 | L | A | 0.0000 | |
| 464 | K | A | -1.9846 | |
| 465 | K | A | -1.8837 | |
| 466 | L | A | 0.0000 | |
| 467 | S | A | -1.0119 | |
| 468 | T | A | -0.7754 | |
| 469 | F | A | -0.5003 | |
| 470 | S | A | -0.7336 | |
| 471 | K | A | -1.7349 | |
| 191 | E | B | -2.9251 | |
| 192 | Q | B | -2.6199 | |
| 193 | I | B | 0.0000 | |
| 194 | K | B | -2.6755 | |
| 195 | E | B | -2.0776 | |
| 196 | I | B | 0.0000 | |
| 197 | K | B | -3.0845 | |
| 198 | K | B | -2.9551 | |
| 199 | E | B | -2.9877 | |
| 200 | Q | B | -2.6164 | |
| 201 | L | B | 0.0000 | |
| 202 | S | B | -1.5229 | |
| 203 | G | B | -1.2250 | |
| 204 | S | B | -0.4770 | |
| 205 | P | B | 0.0555 | |
| 206 | W | B | 0.9047 | |
| 207 | I | B | 1.6010 | |
| 208 | L | B | 1.6934 | |
| 209 | L | B | 0.4676 | |
| 210 | R | B | -1.2392 | |
| 211 | E | B | -2.5647 | |
| 212 | N | B | -2.9711 | |
| 213 | E | B | -2.9938 | |
| 214 | V | B | 0.0000 | |
| 215 | S | B | 0.0000 | |
| 216 | T | B | 0.0000 | |
| 217 | L | B | -0.0668 | |
| 218 | Y | B | 0.8236 | |
| 219 | K | B | 0.1878 | |
| 220 | G | B | 0.0000 | |
| 221 | E | B | -1.4718 | |
| 222 | Y | B | -1.5569 | |
| 223 | H | B | -1.9451 | |
| 224 | R | B | -2.1001 | |
| 225 | A | B | -1.2907 | |
| 226 | P | B | -1.0671 | |
| 227 | V | B | 0.0000 | |
| 228 | A | B | 0.0000 | |
| 229 | I | B | 0.0000 | |
| 230 | K | B | -0.5852 | |
| 231 | V | B | -0.5729 | |
| 232 | F | B | 0.0000 | |
| 233 | K | B | -1.7670 | |
| 234 | K | B | -2.2339 | |
| 235 | L | B | -1.3901 | |
| 236 | Q | B | -1.8287 | |
| 237 | A | B | -0.7776 | |
| 238 | G | B | -0.2713 | |
| 239 | S | B | 0.2619 | |
| 240 | I | B | -0.1469 | |
| 241 | A | B | 0.4581 | |
| 242 | I | B | 1.2957 | |
| 243 | V | B | 0.0000 | |
| 244 | R | B | -0.9162 | |
| 245 | Q | B | -1.4278 | |
| 246 | T | B | -1.4528 | |
| 247 | F | B | 0.0000 | |
| 248 | N | B | -2.4180 | |
| 249 | K | B | -3.0223 | |
| 250 | E | B | 0.0000 | |
| 251 | I | B | -2.0323 | |
| 252 | K | B | -2.4682 | |
| 253 | T | B | -1.6547 | |
| 254 | M | B | -1.6061 | |
| 255 | K | B | -2.5877 | |
| 256 | K | B | -2.3260 | |
| 257 | F | B | -1.7975 | |
| 258 | E | B | -2.3940 | |
| 259 | S | B | -1.3244 | |
| 260 | P | B | -0.8116 | |
| 261 | N | B | 0.0000 | |
| 262 | I | B | 0.0000 | |
| 263 | L | B | 0.0000 | |
| 264 | R | B | -1.5776 | |
| 265 | I | B | -0.6927 | |
| 266 | F | B | -0.9019 | |
| 267 | G | B | 0.0000 | |
| 268 | I | B | 0.0000 | |
| 269 | C | B | 0.0000 | |
| 270 | I | B | 0.0000 | |
| 271 | D | B | 0.0000 | |
| 272 | E | B | -1.7897 | |
| 273 | T | B | -0.7325 | |
| 274 | V | B | 0.0638 | |
| 275 | T | B | -0.4145 | |
| 276 | P | B | -1.1142 | |
| 277 | P | B | 0.0000 | |
| 278 | Q | B | -1.3259 | |
| 279 | F | B | 0.0000 | |
| 280 | S | B | 0.0000 | |
| 281 | I | B | 0.0000 | |
| 282 | V | B | 0.0000 | |
| 283 | M | B | -0.2945 | |
| 284 | E | B | -0.6129 | |
| 285 | Y | B | -0.4724 | |
| 286 | C | B | 0.0000 | |
| 287 | E | B | -0.7750 | |
| 288 | L | B | -0.4738 | |
| 289 | G | B | -0.4631 | |
| 290 | T | B | -0.2627 | |
| 291 | L | B | 0.0000 | |
| 292 | R | B | 0.0000 | |
| 293 | E | B | -1.2624 | |
| 294 | L | B | 0.0000 | |
| 295 | L | B | 0.0000 | |
| 296 | D | B | -2.2091 | |
| 297 | R | B | -2.7157 | |
| 298 | E | B | -3.1336 | |
| 299 | K | B | -3.5623 | |
| 300 | D | B | -2.8256 | |
| 301 | L | B | -1.3744 | |
| 302 | T | B | -0.1894 | |
| 303 | L | B | 0.9825 | |
| 304 | G | B | 0.3996 | |
| 305 | K | B | 0.1088 | |
| 306 | R | B | 0.2353 | |
| 307 | M | B | 0.0000 | |
| 308 | V | B | 0.0000 | |
| 309 | L | B | 0.0000 | |
| 310 | V | B | 0.0000 | |
| 311 | L | B | 0.0000 | |
| 312 | G | B | 0.0000 | |
| 313 | A | B | 0.0000 | |
| 314 | A | B | 0.0000 | |
| 315 | R | B | 0.0000 | |
| 316 | G | B | 0.0000 | |
| 317 | L | B | 0.0000 | |
| 318 | Y | B | 0.0000 | |
| 319 | R | B | -1.2793 | |
| 320 | L | B | 0.0000 | |
| 321 | H | B | -1.1023 | |
| 322 | H | B | -1.3348 | |
| 323 | S | B | -1.6772 | |
| 324 | E | B | -2.2518 | |
| 325 | A | B | -1.7250 | |
| 326 | P | B | -1.6679 | |
| 327 | E | B | -1.9950 | |
| 328 | L | B | -0.4987 | |
| 329 | H | B | 0.0000 | |
| 330 | G | B | -0.9113 | |
| 331 | K | B | -1.7826 | |
| 332 | I | B | 0.0000 | |
| 333 | R | B | -0.9610 | |
| 334 | S | B | 0.0000 | |
| 335 | S | B | -1.0432 | |
| 336 | N | B | -0.6539 | |
| 337 | F | B | 0.0000 | |
| 338 | L | B | -0.0921 | |
| 339 | V | B | 0.0000 | |
| 340 | T | B | 0.0000 | |
| 341 | Q | B | -0.4561 | |
| 342 | G | B | 0.0000 | |
| 343 | Y | B | 0.0000 | |
| 344 | Q | B | -0.1450 | |
| 345 | V | B | 0.0000 | |
| 346 | K | B | 0.0000 | |
| 347 | L | B | 0.0000 | |
| 348 | A | B | -0.5596 | |
| 349 | G | B | -0.9270 | |
| 350 | F | B | -0.6525 | |
| 351 | E | B | -1.1626 | |
| 352 | L | B | 0.0000 | |
| 353 | R | B | -2.0431 | |
| 354 | K | B | -2.5513 | |
| 355 | T | B | 0.0000 | |
| 356 | Q | B | -1.0470 | |
| 357 | T | B | -0.7684 | |
| 358 | S | B | -0.0923 | |
| 359 | M | B | 0.0000 | |
| 360 | S | B | -0.2874 | |
| 361 | L | B | 1.0084 | |
| 362 | G | B | -0.5040 | |
| 363 | T | B | -1.0370 | |
| 364 | T | B | -1.4382 | |
| 365 | R | B | -3.2223 | |
| 366 | E | B | -3.3193 | |
| 367 | K | B | -3.5821 | |
| 368 | T | B | -3.0004 | |
| 369 | D | B | -3.9919 | |
| 370 | R | B | -3.5887 | |
| 371 | V | B | 0.0000 | |
| 372 | K | B | -2.9378 | |
| 373 | S | B | -1.5149 | |
| 374 | T | B | -0.9949 | |
| 375 | A | B | 0.0000 | |
| 376 | Y | B | 0.0000 | |
| 377 | L | B | -0.2522 | |
| 378 | S | B | 0.0000 | |
| 379 | P | B | 0.0000 | |
| 380 | Q | B | -1.0301 | |
| 381 | E | B | -0.3654 | |
| 382 | L | B | 0.0000 | |
| 383 | E | B | -1.6505 | |
| 384 | D | B | -0.6370 | |
| 385 | V | B | 1.6066 | |
| 386 | F | B | 2.0767 | |
| 387 | Y | B | 0.5539 | |
| 388 | Q | B | -0.3293 | |
| 389 | Y | B | -0.0110 | |
| 390 | D | B | -0.4662 | |
| 391 | V | B | 0.1560 | |
| 392 | K | B | -0.2324 | |
| 393 | S | B | 0.0000 | |
| 394 | E | B | 0.0000 | |
| 395 | I | B | 0.0000 | |
| 396 | Y | B | 0.0000 | |
| 397 | S | B | 0.0000 | |
| 398 | F | B | 0.0000 | |
| 399 | G | B | 0.0000 | |
| 400 | I | B | 0.0000 | |
| 401 | V | B | 0.0000 | |
| 402 | L | B | 0.0000 | |
| 403 | W | B | 0.0000 | |
| 404 | E | B | 0.0000 | |
| 405 | I | B | 0.0000 | |
| 406 | A | B | -0.1866 | |
| 407 | T | B | -0.7200 | |
| 408 | G | B | 0.0000 | |
| 409 | D | B | -1.5842 | |
| 410 | I | B | 0.0000 | |
| 411 | P | B | 0.0000 | |
| 412 | F | B | 0.0000 | |
| 413 | Q | B | -2.2047 | |
| 414 | G | B | -1.3821 | |
| 415 | C | B | -1.8843 | |
| 416 | N | B | -2.6793 | |
| 417 | S | B | -2.5543 | |
| 418 | E | B | -3.2948 | |
| 419 | K | B | -2.8551 | |
| 420 | I | B | 0.0000 | |
| 421 | R | B | -2.8900 | |
| 422 | K | B | -2.6609 | |
| 423 | L | B | -2.0954 | |
| 424 | V | B | 0.0000 | |
| 425 | A | B | 0.0000 | |
| 426 | V | B | -0.4322 | |
| 427 | K | B | -2.0784 | |
| 428 | R | B | -2.4898 | |
| 429 | Q | B | -2.5236 | |
| 430 | Q | B | -1.8238 | |
| 431 | E | B | -1.0477 | |
| 432 | P | B | -1.2384 | |
| 433 | L | B | -1.4828 | |
| 434 | G | B | -2.0900 | |
| 435 | E | B | -3.0428 | |
| 436 | D | B | -2.7654 | |
| 437 | C | B | -1.8827 | |
| 438 | P | B | -1.3722 | |
| 439 | S | B | -1.8127 | |
| 440 | E | B | -1.8464 | |
| 441 | L | B | 0.0000 | |
| 442 | R | B | -3.0875 | |
| 443 | E | B | -3.1946 | |
| 444 | I | B | 0.0000 | |
| 445 | I | B | 0.0000 | |
| 446 | D | B | -1.9921 | |
| 447 | E | B | -1.8679 | |
| 448 | C | B | 0.0000 | |
| 449 | R | B | 0.0000 | |
| 450 | A | B | -1.3373 | |
| 451 | H | B | -1.7672 | |
| 452 | D | B | -1.4882 | |
| 453 | P | B | -0.7965 | |
| 454 | S | B | -0.3622 | |
| 455 | V | B | 0.1536 | |
| 456 | R | B | 0.0000 | |
| 457 | P | B | 0.0000 | |
| 458 | S | B | -0.8099 | |
| 459 | V | B | 0.0000 | |
| 460 | D | B | -1.7103 | |
| 461 | E | B | -2.6572 | |
| 462 | I | B | 0.0000 | |
| 463 | L | B | 0.0000 | |
| 464 | K | B | -2.6878 | |
| 465 | K | B | -2.3713 | |
| 466 | L | B | 0.0000 | |
| 467 | S | B | -1.2399 | |
| 468 | T | B | -0.8072 | |
| 469 | F | B | -0.5528 | |
| 470 | S | B | -0.7106 | |
| 471 | K | B | -1.7127 | |
| 9 | V | D | 1.5675 | |
| 10 | P | D | 0.0000 | |
| 11 | T | D | -0.8145 | |
| 12 | K | D | -2.1159 | |
| 13 | L | D | -1.4463 | |
| 14 | E | D | -1.8065 | |
| 15 | V | D | 0.0005 | |
| 16 | V | D | 1.3143 | |
| 17 | A | D | 0.7761 | |
| 18 | A | D | 0.2559 | |
| 19 | T | D | -0.1891 | |
| 20 | P | D | -0.7845 | |
| 21 | T | D | -0.5590 | |
| 22 | S | D | -0.3136 | |
| 23 | L | D | 0.0000 | |
| 24 | L | D | 0.6890 | |
| 25 | I | D | 0.0000 | |
| 26 | S | D | 0.0000 | |
| 27 | W | D | 0.0000 | |
| 28 | D | D | -1.5078 | |
| 29 | A | D | -0.5215 | |
| 30 | P | D | 0.6452 | |
| 31 | A | D | 0.7105 | |
| 32 | V | D | 1.1160 | |
| 33 | T | D | 0.0478 | |
| 34 | V | D | -0.0754 | |
| 35 | D | D | -0.6721 | |
| 36 | L | D | -0.3780 | |
| 37 | Y | D | 0.0000 | |
| 38 | I | D | 0.0000 | |
| 39 | I | D | 0.0000 | |
| 40 | T | D | 0.0000 | |
| 41 | Y | D | -0.5360 | |
| 42 | G | D | -1.4170 | |
| 43 | E | D | -2.6380 | |
| 44 | T | D | -1.7525 | |
| 45 | G | D | -1.4724 | |
| 46 | G | D | -1.7558 | |
| 47 | N | D | -1.7700 | |
| 48 | S | D | -1.3979 | |
| 49 | P | D | -1.0473 | |
| 50 | V | D | -0.7729 | |
| 51 | Q | D | -1.0648 | |
| 52 | T | D | -0.3755 | |
| 53 | F | D | -0.0667 | |
| 54 | E | D | -0.4164 | |
| 55 | V | D | 0.0000 | |
| 56 | P | D | -0.8591 | |
| 57 | G | D | -0.9983 | |
| 58 | S | D | -1.2236 | |
| 59 | K | D | -1.8190 | |
| 60 | S | D | -1.1094 | |
| 61 | T | D | -0.5595 | |
| 62 | A | D | 0.0000 | |
| 63 | T | D | 0.0872 | |
| 64 | I | D | 0.0000 | |
| 65 | S | D | -0.4768 | |
| 66 | G | D | -0.6966 | |
| 67 | L | D | 0.0000 | |
| 68 | S | D | -0.9496 | |
| 69 | P | D | -0.9981 | |
| 70 | G | D | -1.0656 | |
| 71 | V | D | -1.1186 | |
| 72 | D | D | -1.8948 | |
| 73 | Y | D | -1.4977 | |
| 74 | T | D | -1.0592 | |
| 75 | I | D | 0.0000 | |
| 76 | T | D | -0.0135 | |
| 77 | V | D | 0.0000 | |
| 78 | Y | D | 0.0000 | |
| 79 | A | D | 0.0000 | |
| 80 | Y | D | 0.0228 | |
| 81 | S | D | 0.0000 | |
| 82 | F | D | 0.0000 | |
| 83 | M | D | -0.3448 | |
| 84 | Y | D | 0.0000 | |
| 85 | H | D | -1.3436 | |
| 86 | D | D | -1.3691 | |
| 87 | Y | D | 0.2341 | |
| 88 | Y | D | 0.8274 | |
| 89 | Y | D | 0.0000 | |
| 90 | P | D | 0.0000 | |
| 91 | E | D | -0.1379 | |
| 92 | W | D | 0.2420 | |
| 93 | S | D | 0.0343 | |
| 94 | P | D | 0.0298 | |
| 95 | I | D | 0.1625 | |
| 96 | S | D | -0.5858 | |
| 97 | I | D | -0.7265 | |
| 98 | N | D | -1.8082 | |
| 99 | Y | D | -1.4447 | |
| 100 | R | D | -2.3314 | |
| 101 | T | D | -1.2817 | |
| 9 | V | C | 1.5955 | |
| 10 | P | C | 0.0000 | |
| 11 | T | C | -0.9884 | |
| 12 | K | C | -2.4642 | |
| 13 | L | C | 0.0000 | |
| 14 | E | C | -1.8665 | |
| 15 | V | C | 0.1156 | |
| 16 | V | C | 1.5617 | |
| 17 | A | C | 0.9105 | |
| 18 | A | C | 0.3579 | |
| 19 | T | C | -0.2393 | |
| 20 | P | C | -0.7566 | |
| 21 | T | C | -0.5114 | |
| 22 | S | C | -0.3194 | |
| 23 | L | C | 0.0000 | |
| 24 | L | C | 0.7411 | |
| 25 | I | C | 0.0000 | |
| 26 | S | C | -0.7493 | |
| 27 | W | C | 0.0000 | |
| 28 | D | C | -1.7375 | |
| 29 | A | C | -0.6483 | |
| 30 | P | C | 0.5213 | |
| 31 | A | C | 0.5103 | |
| 32 | V | C | 0.7357 | |
| 33 | T | C | -0.1907 | |
| 34 | V | C | 0.0000 | |
| 35 | D | C | -0.7122 | |
| 36 | L | C | -0.3173 | |
| 37 | Y | C | 0.0000 | |
| 38 | I | C | 0.0000 | |
| 39 | I | C | 0.0000 | |
| 40 | T | C | 0.0000 | |
| 41 | Y | C | -0.6466 | |
| 42 | G | C | -1.6613 | |
| 43 | E | C | -2.9713 | |
| 44 | T | C | -2.0797 | |
| 45 | G | C | -1.6548 | |
| 46 | G | C | -1.8850 | |
| 47 | N | C | -1.8489 | |
| 48 | S | C | -1.4283 | |
| 49 | P | C | -1.0505 | |
| 50 | V | C | -0.9041 | |
| 51 | Q | C | -1.1185 | |
| 52 | T | C | -0.4350 | |
| 53 | F | C | -0.1101 | |
| 54 | E | C | -0.4611 | |
| 55 | V | C | 0.0000 | |
| 56 | P | C | -0.8116 | |
| 57 | G | C | -0.9774 | |
| 58 | S | C | -1.1467 | |
| 59 | K | C | -1.6131 | |
| 60 | S | C | -1.0734 | |
| 61 | T | C | -0.5320 | |
| 62 | A | C | 0.0000 | |
| 63 | T | C | 0.0749 | |
| 64 | I | C | 0.0000 | |
| 65 | S | C | -0.4804 | |
| 66 | G | C | -0.7020 | |
| 67 | L | C | 0.0000 | |
| 68 | S | C | -1.0219 | |
| 69 | P | C | -0.9899 | |
| 70 | G | C | -1.0214 | |
| 71 | V | C | -1.3907 | |
| 72 | D | C | -2.7981 | |
| 73 | Y | C | 0.0000 | |
| 74 | T | C | -1.3674 | |
| 75 | I | C | 0.0000 | |
| 76 | T | C | -0.0971 | |
| 77 | V | C | 0.0000 | |
| 78 | Y | C | 0.0456 | |
| 79 | A | C | 0.0000 | |
| 80 | Y | C | -0.0183 | |
| 81 | S | C | 0.0000 | |
| 82 | F | C | 0.0000 | |
| 83 | M | C | -0.3998 | |
| 84 | Y | C | 0.0000 | |
| 85 | H | C | -1.1248 | |
| 86 | D | C | -1.6963 | |
| 87 | Y | C | 0.3910 | |
| 88 | Y | C | 0.6885 | |
| 89 | Y | C | 0.0000 | |
| 90 | P | C | 0.0000 | |
| 91 | E | C | -0.3136 | |
| 92 | W | C | 0.1712 | |
| 93 | S | C | 0.0032 | |
| 94 | P | C | 0.0760 | |
| 95 | I | C | 0.1483 | |
| 96 | S | C | -0.6109 | |
| 97 | I | C | -0.7597 | |
| 98 | N | C | -2.0486 | |
| 99 | Y | C | -1.7549 | |
| 100 | R | C | -2.6954 | |
| 101 | T | C | -1.2938 |
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