| Chain sequence(s) |
A: GMIDLDFRKLTIEECLKLSEEEREKLPQLSLETIKRLDPHVKAFISVRENVSVEKKGKFWGIPVAIKDNILTLGMRTTCASRILENYESVFDATVVKKMKEAGFVVVGKANLDEFAMGSSTERSAFFPTRNPWDLERVPGGSSGGSAAAVSAGMVVAALGSDTGGSVRQPASLCGVVGYKPTYGLVSRYGLVAFASSLDQIGPITKTVRDAAILMEIISGRDENDATTVNRKVDFLSEIEEGVSGMKFAVPEEIYEHDIEEGVSERFEEALKLLERLGAKVERVKIPHIKYSVATYYVIAPAEASSNTRNVGFGEEVRRRIMIGTFTLSAAYYEAYFNKAMKVRRKISDELNEVLSQYDAILTPTSPVTAFKIGEIKDPLTYYLMDIFTIPANLAGLPAISVPFGFSNNLPVGVQVIGRRFADGKVFRIARAIEKNSPYNENGMFPLPEVKA
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] (00:00:01)
[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] FoldX: Starting FoldX energy minimalization (00:00:01)
[INFO] Analysis: Starting Aggrescan3D on folded.pdb (00:11:38)
[INFO] Main: Simulation completed successfully. (00:11:42)
|
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 | |
| 0 | G | A | 0.0041 | |
| 1 | M | A | 0.4424 | |
| 2 | I | A | 1.1421 | |
| 3 | D | A | 0.1548 | |
| 4 | L | A | 1.3699 | |
| 5 | D | A | -0.1804 | |
| 6 | F | A | 0.0000 | |
| 7 | R | A | -1.1620 | |
| 8 | K | A | -1.4282 | |
| 9 | L | A | 0.0000 | |
| 10 | T | A | 0.0000 | |
| 11 | I | A | 0.0000 | |
| 12 | E | A | -1.1634 | |
| 13 | E | A | -1.5145 | |
| 14 | C | A | 0.0000 | |
| 15 | L | A | -1.2580 | |
| 16 | K | A | -1.8317 | |
| 17 | L | A | 0.0000 | |
| 18 | S | A | -1.5274 | |
| 19 | E | A | -3.4332 | |
| 20 | E | A | -3.3270 | |
| 21 | E | A | -2.2803 | |
| 22 | R | A | 0.0000 | |
| 23 | E | A | -3.5105 | |
| 24 | K | A | -3.0277 | |
| 25 | L | A | 0.0000 | |
| 26 | P | A | 0.0000 | |
| 27 | Q | A | -1.3761 | |
| 28 | L | A | -1.0992 | |
| 29 | S | A | 0.0000 | |
| 30 | L | A | -1.3014 | |
| 31 | E | A | -1.9885 | |
| 32 | T | A | 0.0000 | |
| 33 | I | A | 0.0000 | |
| 34 | K | A | -2.8303 | |
| 35 | R | A | -3.2020 | |
| 36 | L | A | 0.0000 | |
| 37 | D | A | -1.7021 | |
| 38 | P | A | -1.4253 | |
| 39 | H | A | -1.3049 | |
| 40 | V | A | 0.0000 | |
| 41 | K | A | -0.7451 | |
| 42 | A | A | 0.0000 | |
| 43 | F | A | 0.0000 | |
| 44 | I | A | 0.2417 | |
| 45 | S | A | 0.2458 | |
| 46 | V | A | 0.1654 | |
| 47 | R | A | -0.8249 | |
| 48 | E | A | -1.8296 | |
| 49 | N | A | -1.0040 | |
| 50 | V | A | 0.1947 | |
| 51 | S | A | -0.7177 | |
| 52 | V | A | -1.6481 | |
| 53 | E | A | -3.0774 | |
| 54 | K | A | -4.0451 | |
| 55 | K | A | -3.8942 | |
| 56 | G | A | -3.0038 | |
| 57 | K | A | -2.5651 | |
| 58 | F | A | 0.0000 | |
| 59 | W | A | 0.0000 | |
| 60 | G | A | 0.0000 | |
| 61 | I | A | 0.0000 | |
| 62 | P | A | 0.0000 | |
| 63 | V | A | 0.0000 | |
| 64 | A | A | 0.0000 | |
| 65 | I | A | 0.0000 | |
| 66 | K | A | 0.0000 | |
| 67 | D | A | 0.0000 | |
| 68 | N | A | 0.0000 | |
| 69 | I | A | 0.0000 | |
| 70 | L | A | 0.5959 | |
| 71 | T | A | 0.0000 | |
| 72 | L | A | 1.1725 | |
| 73 | G | A | -0.0697 | |
| 74 | M | A | -0.3613 | |
| 75 | R | A | -1.0189 | |
| 76 | T | A | 0.0000 | |
| 77 | T | A | 0.0000 | |
| 78 | C | A | 0.0000 | |
| 79 | A | A | 0.0000 | |
| 80 | S | A | 0.0000 | |
| 81 | R | A | -1.2921 | |
| 82 | I | A | 0.7757 | |
| 83 | L | A | -0.4180 | |
| 84 | E | A | -1.7101 | |
| 85 | N | A | -1.9137 | |
| 86 | Y | A | -0.9261 | |
| 87 | E | A | -1.3852 | |
| 88 | S | A | 0.2457 | |
| 89 | V | A | 1.7391 | |
| 90 | F | A | 1.2389 | |
| 91 | D | A | 0.0000 | |
| 92 | A | A | 0.0000 | |
| 93 | T | A | -0.4770 | |
| 94 | V | A | 0.0000 | |
| 95 | V | A | 0.0000 | |
| 96 | K | A | -1.5825 | |
| 97 | K | A | -1.5038 | |
| 98 | M | A | 0.0000 | |
| 99 | K | A | -1.9876 | |
| 100 | E | A | -2.9257 | |
| 101 | A | A | -2.0160 | |
| 102 | G | A | 0.0000 | |
| 103 | F | A | 0.0000 | |
| 104 | V | A | 0.0000 | |
| 105 | V | A | 0.0000 | |
| 106 | V | A | 0.0000 | |
| 107 | G | A | 0.0000 | |
| 108 | K | A | 0.0000 | |
| 109 | A | A | 0.0000 | |
| 110 | N | A | 0.0000 | |
| 111 | L | A | 0.0000 | |
| 112 | D | A | 0.0000 | |
| 113 | E | A | -0.8213 | |
| 114 | F | A | 0.3007 | |
| 115 | A | A | 0.2799 | |
| 116 | M | A | 0.4869 | |
| 117 | G | A | -0.0280 | |
| 118 | S | A | 0.0000 | |
| 119 | S | A | 0.0000 | |
| 120 | T | A | 0.0000 | |
| 121 | E | A | -0.9751 | |
| 122 | R | A | -1.1499 | |
| 123 | S | A | -0.6880 | |
| 124 | A | A | -0.5454 | |
| 125 | F | A | -0.1497 | |
| 126 | F | A | 0.2719 | |
| 127 | P | A | -0.3817 | |
| 128 | T | A | 0.0000 | |
| 129 | R | A | -1.1036 | |
| 130 | N | A | 0.0000 | |
| 131 | P | A | 0.0000 | |
| 132 | W | A | -0.7122 | |
| 133 | D | A | -1.1973 | |
| 134 | L | A | -0.9309 | |
| 135 | E | A | -2.1180 | |
| 136 | R | A | -1.6662 | |
| 137 | V | A | 0.0000 | |
| 138 | P | A | 0.0000 | |
| 139 | G | A | 0.0000 | |
| 140 | G | A | 0.0000 | |
| 141 | S | A | 0.0000 | |
| 142 | S | A | 0.0000 | |
| 143 | G | A | 0.0000 | |
| 144 | G | A | 0.0000 | |
| 145 | S | A | 0.0000 | |
| 146 | A | A | 0.0000 | |
| 147 | A | A | 0.0000 | |
| 148 | A | A | 0.0000 | |
| 149 | V | A | 0.0000 | |
| 150 | S | A | 0.0000 | |
| 151 | A | A | 0.0000 | |
| 152 | G | A | 0.0000 | |
| 153 | M | A | 0.0000 | |
| 154 | V | A | 0.0000 | |
| 155 | V | A | 0.0000 | |
| 156 | A | A | 0.0000 | |
| 157 | A | A | 0.0000 | |
| 158 | L | A | 0.0000 | |
| 159 | G | A | 0.0000 | |
| 160 | S | A | 0.0000 | |
| 161 | D | A | 0.0000 | |
| 162 | T | A | 0.0708 | |
| 163 | G | A | 0.0000 | |
| 164 | G | A | 0.0000 | |
| 165 | S | A | 0.0164 | |
| 166 | V | A | 0.0000 | |
| 167 | R | A | 0.0000 | |
| 168 | Q | A | 0.0000 | |
| 169 | P | A | 0.0000 | |
| 170 | A | A | 0.0000 | |
| 171 | S | A | 0.0000 | |
| 172 | L | A | 0.0000 | |
| 173 | C | A | 0.0000 | |
| 174 | G | A | 0.0000 | |
| 175 | V | A | 0.0000 | |
| 176 | V | A | 0.0000 | |
| 177 | G | A | 0.0000 | |
| 178 | Y | A | 0.0000 | |
| 179 | K | A | 0.0000 | |
| 180 | P | A | 0.0000 | |
| 181 | T | A | 0.0000 | |
| 182 | Y | A | 0.1870 | |
| 183 | G | A | 0.0000 | |
| 184 | L | A | 0.0000 | |
| 185 | V | A | 0.0000 | |
| 186 | S | A | 0.0000 | |
| 187 | R | A | -0.0501 | |
| 188 | Y | A | 0.0146 | |
| 189 | G | A | 0.2928 | |
| 190 | L | A | 0.0000 | |
| 191 | V | A | 0.7191 | |
| 192 | A | A | 0.3957 | |
| 193 | F | A | 0.1505 | |
| 194 | A | A | 0.0000 | |
| 195 | S | A | -0.3486 | |
| 196 | S | A | -0.1072 | |
| 197 | L | A | 0.0000 | |
| 198 | D | A | 0.0000 | |
| 199 | Q | A | 0.0000 | |
| 200 | I | A | 0.0000 | |
| 201 | G | A | 0.0000 | |
| 202 | P | A | 0.0000 | |
| 203 | I | A | 0.0000 | |
| 204 | T | A | 0.0000 | |
| 205 | K | A | 0.0000 | |
| 206 | T | A | -0.3713 | |
| 207 | V | A | 0.0000 | |
| 208 | R | A | -0.6547 | |
| 209 | D | A | 0.0000 | |
| 210 | A | A | 0.0000 | |
| 211 | A | A | 0.0000 | |
| 212 | I | A | 0.0000 | |
| 213 | L | A | 0.0000 | |
| 214 | M | A | 0.0000 | |
| 215 | E | A | -0.9419 | |
| 216 | I | A | -0.3138 | |
| 217 | I | A | 0.0000 | |
| 218 | S | A | -0.6298 | |
| 219 | G | A | -1.7654 | |
| 220 | R | A | -2.5268 | |
| 221 | D | A | 0.0000 | |
| 222 | E | A | -2.5703 | |
| 223 | N | A | -2.1536 | |
| 224 | D | A | 0.0000 | |
| 225 | A | A | -0.8184 | |
| 226 | T | A | -0.6017 | |
| 227 | T | A | 0.0000 | |
| 228 | V | A | -1.6172 | |
| 229 | N | A | -2.7825 | |
| 230 | R | A | -3.3091 | |
| 231 | K | A | -3.4809 | |
| 232 | V | A | 0.0000 | |
| 233 | D | A | -2.5705 | |
| 234 | F | A | 0.0000 | |
| 235 | L | A | -1.2891 | |
| 236 | S | A | -1.9415 | |
| 237 | E | A | -3.2863 | |
| 238 | I | A | 0.0000 | |
| 239 | E | A | -3.4406 | |
| 240 | E | A | -3.4313 | |
| 241 | G | A | -2.2224 | |
| 242 | V | A | 0.0000 | |
| 243 | S | A | -1.4017 | |
| 244 | G | A | -1.1385 | |
| 245 | M | A | 0.0000 | |
| 246 | K | A | -1.6437 | |
| 247 | F | A | 0.0000 | |
| 248 | A | A | 0.0000 | |
| 249 | V | A | 0.0000 | |
| 250 | P | A | 0.0000 | |
| 251 | E | A | -2.7692 | |
| 252 | E | A | -2.2871 | |
| 253 | I | A | 0.0000 | |
| 254 | Y | A | -1.2902 | |
| 255 | E | A | -2.7059 | |
| 256 | H | A | -2.2428 | |
| 257 | D | A | -2.5311 | |
| 258 | I | A | -1.4691 | |
| 259 | E | A | -1.8304 | |
| 260 | E | A | -2.8341 | |
| 261 | G | A | -2.0972 | |
| 262 | V | A | 0.0000 | |
| 263 | S | A | -2.0075 | |
| 264 | E | A | -2.7573 | |
| 265 | R | A | -1.7511 | |
| 266 | F | A | 0.0000 | |
| 267 | E | A | -1.7532 | |
| 268 | E | A | -1.7747 | |
| 269 | A | A | 0.0000 | |
| 270 | L | A | 0.0000 | |
| 271 | K | A | -2.3687 | |
| 272 | L | A | -1.7091 | |
| 273 | L | A | 0.0000 | |
| 274 | E | A | -2.8775 | |
| 275 | R | A | -2.8056 | |
| 276 | L | A | -1.5658 | |
| 277 | G | A | -1.6692 | |
| 278 | A | A | 0.0000 | |
| 279 | K | A | -2.1263 | |
| 280 | V | A | -1.7202 | |
| 281 | E | A | -2.3466 | |
| 282 | R | A | -3.0207 | |
| 283 | V | A | -2.2010 | |
| 284 | K | A | -2.5020 | |
| 285 | I | A | 0.0000 | |
| 286 | P | A | -1.2234 | |
| 287 | H | A | -1.2058 | |
| 288 | I | A | 0.0000 | |
| 289 | K | A | -1.5738 | |
| 290 | Y | A | 0.0678 | |
| 291 | S | A | 0.0000 | |
| 292 | V | A | 0.4774 | |
| 293 | A | A | 0.4598 | |
| 294 | T | A | 0.0000 | |
| 295 | Y | A | 0.0000 | |
| 296 | Y | A | 0.6182 | |
| 297 | V | A | 0.3631 | |
| 298 | I | A | 0.0000 | |
| 299 | A | A | 0.0559 | |
| 300 | P | A | -0.0330 | |
| 301 | A | A | 0.0000 | |
| 302 | E | A | -0.4824 | |
| 303 | A | A | -0.4819 | |
| 304 | S | A | -0.4863 | |
| 305 | S | A | -0.9374 | |
| 306 | N | A | -1.3878 | |
| 331 | T | A | -1.0287 | |
| 332 | R | A | -1.9397 | |
| 333 | N | A | -1.1029 | |
| 334 | V | A | 0.7204 | |
| 335 | G | A | -0.0862 | |
| 336 | F | A | 0.6609 | |
| 337 | G | A | -0.9653 | |
| 338 | E | A | -3.0287 | |
| 339 | E | A | -3.3464 | |
| 340 | V | A | -1.9280 | |
| 341 | R | A | -3.1079 | |
| 342 | R | A | -3.3936 | |
| 343 | R | A | -2.2599 | |
| 344 | I | A | 0.2971 | |
| 345 | M | A | 0.6470 | |
| 346 | I | A | 1.4796 | |
| 347 | G | A | 1.2208 | |
| 348 | T | A | 1.9434 | |
| 349 | F | A | 3.0278 | |
| 350 | T | A | 2.2472 | |
| 351 | L | A | 2.3647 | |
| 352 | S | A | 1.6147 | |
| 353 | A | A | 0.9209 | |
| 354 | A | A | 0.8502 | |
| 355 | Y | A | 1.4572 | |
| 356 | Y | A | 0.1642 | |
| 357 | E | A | -0.9873 | |
| 358 | A | A | -0.4036 | |
| 359 | Y | A | -0.2079 | |
| 360 | F | A | -0.5703 | |
| 361 | N | A | -2.1079 | |
| 362 | K | A | -2.4407 | |
| 363 | A | A | 0.0000 | |
| 364 | M | A | -1.8175 | |
| 365 | K | A | -3.0842 | |
| 366 | V | A | -1.9568 | |
| 367 | R | A | -2.2003 | |
| 368 | R | A | -3.4995 | |
| 369 | K | A | -3.0252 | |
| 370 | I | A | 0.0000 | |
| 371 | S | A | -2.4529 | |
| 372 | D | A | -3.2925 | |
| 373 | E | A | 0.0000 | |
| 374 | L | A | 0.0000 | |
| 375 | N | A | -2.4875 | |
| 376 | E | A | -2.8722 | |
| 377 | V | A | 0.0000 | |
| 378 | L | A | 0.0000 | |
| 379 | S | A | -1.7030 | |
| 380 | Q | A | -1.8407 | |
| 381 | Y | A | -1.5159 | |
| 382 | D | A | -1.1433 | |
| 383 | A | A | 0.0000 | |
| 384 | I | A | 0.0000 | |
| 385 | L | A | 0.0000 | |
| 386 | T | A | 0.0000 | |
| 387 | P | A | 0.0000 | |
| 388 | T | A | 0.0000 | |
| 389 | S | A | 0.0000 | |
| 390 | P | A | -0.3336 | |
| 391 | V | A | -0.1853 | |
| 392 | T | A | 0.0000 | |
| 393 | A | A | 0.0000 | |
| 394 | F | A | 0.0000 | |
| 395 | K | A | -1.8544 | |
| 396 | I | A | -1.2372 | |
| 397 | G | A | -1.7142 | |
| 398 | E | A | -2.3944 | |
| 399 | I | A | -1.6727 | |
| 400 | K | A | -2.5857 | |
| 401 | D | A | -2.0328 | |
| 402 | P | A | -0.4359 | |
| 403 | L | A | 1.0948 | |
| 404 | T | A | 0.2408 | |
| 405 | Y | A | 0.0000 | |
| 406 | Y | A | 1.1338 | |
| 407 | L | A | 1.1193 | |
| 408 | M | A | 0.0000 | |
| 409 | D | A | 0.2001 | |
| 410 | I | A | 0.2011 | |
| 411 | F | A | 0.0000 | |
| 412 | T | A | 0.0000 | |
| 413 | I | A | 0.0000 | |
| 414 | P | A | 0.0000 | |
| 415 | A | A | 0.0000 | |
| 416 | N | A | 0.0000 | |
| 417 | L | A | 0.0000 | |
| 418 | A | A | -1.0434 | |
| 419 | G | A | 0.0000 | |
| 420 | L | A | 0.0000 | |
| 421 | P | A | 0.0000 | |
| 422 | A | A | 0.0000 | |
| 423 | I | A | 0.0000 | |
| 424 | S | A | 0.0000 | |
| 425 | V | A | 0.0000 | |
| 426 | P | A | 0.0000 | |
| 427 | F | A | 0.0000 | |
| 428 | G | A | 0.0000 | |
| 429 | F | A | -0.5081 | |
| 430 | S | A | 0.0000 | |
| 431 | N | A | -2.0082 | |
| 432 | N | A | -1.8241 | |
| 433 | L | A | 0.0000 | |
| 434 | P | A | 0.0000 | |
| 435 | V | A | 0.0000 | |
| 436 | G | A | 0.0000 | |
| 437 | V | A | 0.0000 | |
| 438 | Q | A | 0.0000 | |
| 439 | V | A | 0.0000 | |
| 440 | I | A | 0.0000 | |
| 441 | G | A | 0.0000 | |
| 442 | R | A | -1.8397 | |
| 443 | R | A | -1.0869 | |
| 444 | F | A | -1.0956 | |
| 445 | A | A | -0.9784 | |
| 446 | D | A | 0.0000 | |
| 447 | G | A | -1.2642 | |
| 448 | K | A | -1.7325 | |
| 449 | V | A | 0.0000 | |
| 450 | F | A | 0.0000 | |
| 451 | R | A | -2.0104 | |
| 452 | I | A | 0.0000 | |
| 453 | A | A | 0.0000 | |
| 454 | R | A | -1.6877 | |
| 455 | A | A | 0.0000 | |
| 456 | I | A | 0.0000 | |
| 457 | E | A | 0.0000 | |
| 458 | K | A | -2.6747 | |
| 459 | N | A | -1.7330 | |
| 460 | S | A | 0.0000 | |
| 461 | P | A | -0.8517 | |
| 462 | Y | A | -0.4330 | |
| 463 | N | A | -1.5876 | |
| 464 | E | A | -2.7226 | |
| 465 | N | A | -2.5643 | |
| 466 | G | A | -2.1317 | |
| 467 | M | A | -1.2793 | |
| 468 | F | A | 0.0000 | |
| 469 | P | A | -0.6455 | |
| 470 | L | A | -0.5244 | |
| 471 | P | A | 0.0000 | |
| 472 | E | A | -2.2646 | |
| 473 | V | A | -1.7442 | |
| 474 | K | A | -2.3362 | |
| 475 | A | A | -1.8290 |
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