| Chain sequence(s) |
A: MGVLKFKHIFFRSFVKSSGVSQIVFTFLLIPCCLTLNFRAPPVIPNVPFLWAWNAPSEFCLGKFDEPLDMSLFSFIGSPRINATGQGVTIFYVDRLGYYPYIDSITGVTVNGGIPQKISLQDHLDKAKKDITFYMPVDNLGMAVIDWEEWRPTWARNWKPKDVYKNRSIELVQQQNVQLSLTEATEKAKQEFEKAGKDFLVETIKLGKLLRPNHLWGYYLFPDCYNHHYKKPGYNGSCFNVEIKRNDDLSWLWNESTALYPSIYLNTQQSPVAATLYVRNRVREAIRVSKIPDAKSPLPVFAYTRIVFTDQVLKFLSQDELVYTFGETVALGASGIVIWGTLSIMRSMKSCLLLDNYMETILNPYIINVTLAAKMCSQVLCQEQGVCIRKNWNSSDYLHLNPDNFAIQLEKGGKFTVRGKPTLEDLEQFSEKFYCSCYSTLSCKEKADVKDTDAVDVCIADGVCIDAFLKPPMETEEPQIFYNASPSTLSATMFIWRLEVWDQGISRIGFF
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 (00:00:01)
[INFO] Analysis: Starting Aggrescan3D on folded.pdb (00:09:05)
[INFO] Main: Simulation completed successfully. (00:09:10)
|
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 | 1.4792 | |
| 2 | G | A | 1.1042 | |
| 3 | V | A | 2.3445 | |
| 4 | L | A | 1.8754 | |
| 5 | K | A | -0.1749 | |
| 6 | F | A | 0.9315 | |
| 7 | K | A | -0.7001 | |
| 8 | H | A | 0.3191 | |
| 9 | I | A | 2.5714 | |
| 10 | F | A | 2.7228 | |
| 11 | F | A | 2.7012 | |
| 12 | R | A | 0.6482 | |
| 13 | S | A | 1.0528 | |
| 14 | F | A | 2.0420 | |
| 15 | V | A | 1.4805 | |
| 16 | K | A | -0.5646 | |
| 17 | S | A | -0.2048 | |
| 18 | S | A | -0.2922 | |
| 19 | G | A | 0.2144 | |
| 20 | V | A | 2.2989 | |
| 21 | S | A | 1.5327 | |
| 22 | Q | A | 1.4635 | |
| 23 | I | A | 3.7068 | |
| 24 | V | A | 4.6516 | |
| 25 | F | A | 4.5583 | |
| 26 | T | A | 3.8108 | |
| 27 | F | A | 4.7562 | |
| 28 | L | A | 4.5817 | |
| 29 | L | A | 4.1497 | |
| 30 | I | A | 3.4429 | |
| 31 | P | A | 2.4766 | |
| 32 | C | A | 2.7194 | |
| 33 | C | A | 2.6072 | |
| 34 | L | A | 2.6525 | |
| 35 | T | A | 1.6276 | |
| 36 | L | A | 1.3541 | |
| 37 | N | A | 0.3044 | |
| 38 | F | A | 0.1388 | |
| 39 | R | A | 0.0000 | |
| 40 | A | A | -0.1239 | |
| 41 | P | A | 0.0995 | |
| 42 | P | A | -0.0672 | |
| 43 | V | A | 0.4371 | |
| 44 | I | A | 0.2605 | |
| 45 | P | A | -0.5058 | |
| 46 | N | A | -1.2594 | |
| 47 | V | A | -0.0167 | |
| 48 | P | A | -0.4070 | |
| 49 | F | A | 0.0000 | |
| 50 | L | A | 0.0000 | |
| 51 | W | A | 0.0000 | |
| 52 | A | A | 0.0000 | |
| 53 | W | A | 0.0000 | |
| 54 | N | A | 0.0000 | |
| 55 | A | A | 0.0000 | |
| 56 | P | A | 0.0000 | |
| 57 | S | A | 0.0000 | |
| 58 | E | A | -1.1054 | |
| 59 | F | A | 0.2218 | |
| 60 | C | A | 0.0000 | |
| 61 | L | A | -0.7424 | |
| 62 | G | A | 0.0000 | |
| 63 | K | A | -1.4853 | |
| 64 | F | A | -0.1886 | |
| 65 | D | A | -2.0052 | |
| 66 | E | A | -2.3815 | |
| 67 | P | A | -1.5095 | |
| 68 | L | A | 0.0000 | |
| 69 | D | A | -1.0755 | |
| 70 | M | A | -0.3573 | |
| 71 | S | A | -0.6983 | |
| 72 | L | A | 0.0000 | |
| 73 | F | A | 0.0000 | |
| 74 | S | A | 0.2836 | |
| 75 | F | A | 0.0000 | |
| 76 | I | A | 0.8453 | |
| 77 | G | A | 0.0000 | |
| 78 | S | A | 0.0000 | |
| 79 | P | A | -0.0358 | |
| 80 | R | A | -0.3308 | |
| 81 | I | A | 0.6641 | |
| 82 | N | A | -0.4954 | |
| 83 | A | A | -0.3791 | |
| 84 | T | A | -0.0815 | |
| 85 | G | A | -0.3554 | |
| 86 | Q | A | -0.1270 | |
| 87 | G | A | 0.0189 | |
| 88 | V | A | 0.0000 | |
| 89 | T | A | 0.0000 | |
| 90 | I | A | 0.0000 | |
| 91 | F | A | 0.0000 | |
| 92 | Y | A | -0.1135 | |
| 93 | V | A | -0.4759 | |
| 94 | D | A | -1.1751 | |
| 95 | R | A | 0.0000 | |
| 96 | L | A | 0.0000 | |
| 97 | G | A | 0.0000 | |
| 98 | Y | A | -0.4906 | |
| 99 | Y | A | 0.0000 | |
| 100 | P | A | 0.0000 | |
| 101 | Y | A | 0.1280 | |
| 102 | I | A | 0.0000 | |
| 103 | D | A | 0.5188 | |
| 104 | S | A | 0.6176 | |
| 105 | I | A | 1.8811 | |
| 106 | T | A | 1.0466 | |
| 107 | G | A | 0.8357 | |
| 108 | V | A | 1.7037 | |
| 109 | T | A | 0.6651 | |
| 110 | V | A | 0.4872 | |
| 111 | N | A | -0.1210 | |
| 112 | G | A | -0.4157 | |
| 113 | G | A | 0.0000 | |
| 114 | I | A | 0.0000 | |
| 115 | P | A | 0.0000 | |
| 116 | Q | A | -1.5546 | |
| 117 | K | A | -1.6360 | |
| 118 | I | A | -0.9157 | |
| 119 | S | A | -1.1396 | |
| 120 | L | A | -1.2090 | |
| 121 | Q | A | -2.2310 | |
| 122 | D | A | -2.6849 | |
| 123 | H | A | 0.0000 | |
| 124 | L | A | -2.0207 | |
| 125 | D | A | -2.8574 | |
| 126 | K | A | -2.4575 | |
| 127 | A | A | 0.0000 | |
| 128 | K | A | -2.1531 | |
| 129 | K | A | -2.3304 | |
| 130 | D | A | -1.3141 | |
| 131 | I | A | 0.0000 | |
| 132 | T | A | -0.2790 | |
| 133 | F | A | 0.5753 | |
| 134 | Y | A | 0.0000 | |
| 135 | M | A | 0.0000 | |
| 136 | P | A | 0.4650 | |
| 137 | V | A | 0.8956 | |
| 138 | D | A | -0.8550 | |
| 139 | N | A | -1.3230 | |
| 140 | L | A | -0.3315 | |
| 141 | G | A | 0.0000 | |
| 142 | M | A | 0.0000 | |
| 143 | A | A | 0.0000 | |
| 144 | V | A | 0.0000 | |
| 145 | I | A | 0.0000 | |
| 146 | D | A | -0.2153 | |
| 147 | W | A | 0.0000 | |
| 148 | E | A | -0.9123 | |
| 149 | E | A | -0.8535 | |
| 150 | W | A | 0.0000 | |
| 151 | R | A | 0.0000 | |
| 152 | P | A | 0.0000 | |
| 153 | T | A | -0.7757 | |
| 154 | W | A | 0.0000 | |
| 155 | A | A | -0.0850 | |
| 156 | R | A | 0.0000 | |
| 157 | N | A | 0.0000 | |
| 158 | W | A | -0.4278 | |
| 159 | K | A | -1.6970 | |
| 160 | P | A | -1.2765 | |
| 161 | K | A | -1.1815 | |
| 162 | D | A | -1.4258 | |
| 163 | V | A | -0.9530 | |
| 164 | Y | A | 0.0000 | |
| 165 | K | A | -1.4933 | |
| 166 | N | A | -2.1098 | |
| 167 | R | A | -2.0587 | |
| 168 | S | A | 0.0000 | |
| 169 | I | A | -1.7322 | |
| 170 | E | A | -1.6894 | |
| 171 | L | A | -1.6223 | |
| 172 | V | A | 0.0000 | |
| 173 | Q | A | -1.2950 | |
| 174 | Q | A | -1.7590 | |
| 175 | Q | A | -1.8375 | |
| 176 | N | A | -1.0906 | |
| 177 | V | A | 0.3273 | |
| 178 | Q | A | -0.7655 | |
| 179 | L | A | -0.5619 | |
| 180 | S | A | 0.0210 | |
| 181 | L | A | 0.5703 | |
| 182 | T | A | -0.7426 | |
| 183 | E | A | -2.3426 | |
| 184 | A | A | 0.0000 | |
| 185 | T | A | -2.0752 | |
| 186 | E | A | -3.2411 | |
| 187 | K | A | -2.9109 | |
| 188 | A | A | 0.0000 | |
| 189 | K | A | -2.9410 | |
| 190 | Q | A | -3.3064 | |
| 191 | E | A | -3.0415 | |
| 192 | F | A | 0.0000 | |
| 193 | E | A | -2.3951 | |
| 194 | K | A | -2.8626 | |
| 195 | A | A | -1.9140 | |
| 196 | G | A | 0.0000 | |
| 197 | K | A | -1.6726 | |
| 198 | D | A | -1.3142 | |
| 199 | F | A | 0.0000 | |
| 200 | L | A | 0.0000 | |
| 201 | V | A | -0.9368 | |
| 202 | E | A | -1.3681 | |
| 203 | T | A | 0.0000 | |
| 204 | I | A | 0.0000 | |
| 205 | K | A | -0.8639 | |
| 206 | L | A | -0.3395 | |
| 207 | G | A | 0.0000 | |
| 208 | K | A | -0.3246 | |
| 209 | L | A | 0.9169 | |
| 210 | L | A | 0.3585 | |
| 211 | R | A | -0.4333 | |
| 212 | P | A | -0.8887 | |
| 213 | N | A | -1.4002 | |
| 214 | H | A | 0.0000 | |
| 215 | L | A | -0.0961 | |
| 216 | W | A | 0.0000 | |
| 217 | G | A | 0.0000 | |
| 218 | Y | A | 0.0000 | |
| 219 | Y | A | 0.0096 | |
| 220 | L | A | 0.0540 | |
| 221 | F | A | 0.0000 | |
| 222 | P | A | 0.0000 | |
| 223 | D | A | 0.0000 | |
| 224 | C | A | 0.0000 | |
| 225 | Y | A | 0.1456 | |
| 226 | N | A | 0.0000 | |
| 227 | H | A | -1.4461 | |
| 228 | H | A | -2.3429 | |
| 229 | Y | A | -2.0566 | |
| 230 | K | A | -3.1189 | |
| 231 | K | A | -3.1412 | |
| 232 | P | A | -1.8874 | |
| 233 | G | A | -1.4617 | |
| 234 | Y | A | -1.5367 | |
| 235 | N | A | -1.3437 | |
| 236 | G | A | 0.0000 | |
| 237 | S | A | -0.3967 | |
| 238 | C | A | 0.1003 | |
| 239 | F | A | 0.5535 | |
| 240 | N | A | -0.6604 | |
| 241 | V | A | 0.1503 | |
| 242 | E | A | 0.0000 | |
| 243 | I | A | -0.8373 | |
| 244 | K | A | -2.1643 | |
| 245 | R | A | -1.6572 | |
| 246 | N | A | 0.0000 | |
| 247 | D | A | -1.8118 | |
| 248 | D | A | -2.5190 | |
| 249 | L | A | 0.0000 | |
| 250 | S | A | -0.9586 | |
| 251 | W | A | -0.7411 | |
| 252 | L | A | 0.0000 | |
| 253 | W | A | 0.0000 | |
| 254 | N | A | -1.4429 | |
| 255 | E | A | -1.1690 | |
| 256 | S | A | 0.0000 | |
| 257 | T | A | -0.4208 | |
| 258 | A | A | 0.0000 | |
| 259 | L | A | 0.0000 | |
| 260 | Y | A | 0.0000 | |
| 261 | P | A | 0.0000 | |
| 262 | S | A | 0.0000 | |
| 263 | I | A | 0.0000 | |
| 264 | Y | A | 0.1238 | |
| 265 | L | A | 0.0000 | |
| 266 | N | A | -0.9379 | |
| 267 | T | A | -1.2202 | |
| 268 | Q | A | -1.5420 | |
| 269 | Q | A | -0.9098 | |
| 270 | S | A | -0.2252 | |
| 271 | P | A | 0.1132 | |
| 272 | V | A | 1.5195 | |
| 273 | A | A | 0.0000 | |
| 274 | A | A | 0.0000 | |
| 275 | T | A | 0.1198 | |
| 276 | L | A | 0.0828 | |
| 277 | Y | A | 0.0000 | |
| 278 | V | A | 0.0000 | |
| 279 | R | A | 0.0000 | |
| 280 | N | A | -0.7179 | |
| 281 | R | A | 0.0000 | |
| 282 | V | A | 0.0000 | |
| 283 | R | A | -1.0461 | |
| 284 | E | A | 0.0000 | |
| 285 | A | A | 0.0000 | |
| 286 | I | A | 0.0000 | |
| 287 | R | A | -0.8339 | |
| 288 | V | A | 0.0000 | |
| 289 | S | A | 0.0000 | |
| 290 | K | A | -0.8907 | |
| 291 | I | A | -0.5615 | |
| 292 | P | A | -1.1438 | |
| 293 | D | A | -1.8461 | |
| 294 | A | A | -1.0617 | |
| 295 | K | A | -1.5341 | |
| 296 | S | A | -1.1838 | |
| 297 | P | A | 0.0000 | |
| 298 | L | A | -0.4292 | |
| 299 | P | A | 0.0498 | |
| 300 | V | A | 0.0000 | |
| 301 | F | A | 0.0000 | |
| 302 | A | A | 0.0000 | |
| 303 | Y | A | 0.0000 | |
| 304 | T | A | 0.0000 | |
| 305 | R | A | 0.0000 | |
| 306 | I | A | 0.0000 | |
| 307 | V | A | 0.0000 | |
| 308 | F | A | 0.0000 | |
| 309 | T | A | -0.6549 | |
| 310 | D | A | -1.4231 | |
| 311 | Q | A | -1.1701 | |
| 312 | V | A | -0.0198 | |
| 313 | L | A | 0.5349 | |
| 314 | K | A | -0.9845 | |
| 315 | F | A | -0.1187 | |
| 316 | L | A | 0.0000 | |
| 317 | S | A | -1.2431 | |
| 318 | Q | A | -1.7164 | |
| 319 | D | A | -2.3383 | |
| 320 | E | A | -1.4204 | |
| 321 | L | A | 0.0000 | |
| 322 | V | A | -0.7228 | |
| 323 | Y | A | -0.1689 | |
| 324 | T | A | 0.0000 | |
| 325 | F | A | 0.0000 | |
| 326 | G | A | 0.0000 | |
| 327 | E | A | 0.0000 | |
| 328 | T | A | 0.0000 | |
| 329 | V | A | 0.0000 | |
| 330 | A | A | 0.0000 | |
| 331 | L | A | 0.0000 | |
| 332 | G | A | 0.0000 | |
| 333 | A | A | 0.0000 | |
| 334 | S | A | 0.0937 | |
| 335 | G | A | 0.0000 | |
| 336 | I | A | 0.0000 | |
| 337 | V | A | 0.0000 | |
| 338 | I | A | 0.0000 | |
| 339 | W | A | 0.1781 | |
| 340 | G | A | 0.0000 | |
| 341 | T | A | 0.3749 | |
| 342 | L | A | 0.6259 | |
| 343 | S | A | 0.2652 | |
| 344 | I | A | 0.0000 | |
| 345 | M | A | 0.0000 | |
| 346 | R | A | -1.4981 | |
| 347 | S | A | -0.7557 | |
| 348 | M | A | -0.0703 | |
| 349 | K | A | -1.3383 | |
| 350 | S | A | -0.4273 | |
| 351 | C | A | 0.0000 | |
| 352 | L | A | -0.0623 | |
| 353 | L | A | 0.4848 | |
| 354 | L | A | 0.0000 | |
| 355 | D | A | -0.9205 | |
| 356 | N | A | -0.7399 | |
| 357 | Y | A | 0.0000 | |
| 358 | M | A | 0.0000 | |
| 359 | E | A | -0.9941 | |
| 360 | T | A | -0.4849 | |
| 361 | I | A | -0.1659 | |
| 362 | L | A | 0.0000 | |
| 363 | N | A | 0.0000 | |
| 364 | P | A | -0.2165 | |
| 365 | Y | A | 0.0000 | |
| 366 | I | A | 0.0000 | |
| 367 | I | A | 0.0000 | |
| 368 | N | A | -0.3344 | |
| 369 | V | A | 0.0000 | |
| 370 | T | A | 0.0000 | |
| 371 | L | A | 0.0000 | |
| 372 | A | A | 0.0000 | |
| 373 | A | A | -0.1264 | |
| 374 | K | A | -0.8479 | |
| 375 | M | A | 0.0000 | |
| 376 | C | A | 0.0000 | |
| 377 | S | A | 0.0000 | |
| 378 | Q | A | -1.7608 | |
| 379 | V | A | 0.0000 | |
| 380 | L | A | 0.0000 | |
| 381 | C | A | 0.0000 | |
| 382 | Q | A | -2.7091 | |
| 383 | E | A | -2.6995 | |
| 384 | Q | A | -1.8932 | |
| 385 | G | A | 0.0000 | |
| 386 | V | A | -0.2944 | |
| 387 | C | A | 0.0000 | |
| 388 | I | A | 0.0000 | |
| 389 | R | A | 0.0000 | |
| 390 | K | A | -2.3263 | |
| 391 | N | A | -2.2789 | |
| 392 | W | A | -1.4607 | |
| 393 | N | A | -1.7940 | |
| 394 | S | A | -1.3945 | |
| 395 | S | A | -0.7648 | |
| 396 | D | A | -1.2526 | |
| 397 | Y | A | -0.1008 | |
| 398 | L | A | 0.0000 | |
| 399 | H | A | -0.4080 | |
| 400 | L | A | 0.0000 | |
| 401 | N | A | -1.4354 | |
| 402 | P | A | -1.4333 | |
| 403 | D | A | -2.2203 | |
| 404 | N | A | -2.2293 | |
| 405 | F | A | 0.0000 | |
| 406 | A | A | -1.5041 | |
| 407 | I | A | -0.7751 | |
| 408 | Q | A | -1.7782 | |
| 409 | L | A | -1.5539 | |
| 410 | E | A | -2.9837 | |
| 411 | K | A | -3.0339 | |
| 412 | G | A | -2.1717 | |
| 413 | G | A | -2.1927 | |
| 414 | K | A | -2.8490 | |
| 415 | F | A | 0.0000 | |
| 416 | T | A | -1.4268 | |
| 417 | V | A | 0.0000 | |
| 418 | R | A | -2.7045 | |
| 419 | G | A | -2.7280 | |
| 420 | K | A | -2.3825 | |
| 421 | P | A | 0.0000 | |
| 422 | T | A | -1.2087 | |
| 423 | L | A | -1.4597 | |
| 424 | E | A | -2.5800 | |
| 425 | D | A | 0.0000 | |
| 426 | L | A | 0.0000 | |
| 427 | E | A | -3.5582 | |
| 428 | Q | A | -2.8234 | |
| 429 | F | A | 0.0000 | |
| 430 | S | A | -2.5245 | |
| 431 | E | A | -3.0000 | |
| 432 | K | A | -2.4567 | |
| 433 | F | A | 0.0000 | |
| 434 | Y | A | -0.8700 | |
| 435 | C | A | -1.0187 | |
| 436 | S | A | 0.0000 | |
| 437 | C | A | -0.5196 | |
| 438 | Y | A | 0.0000 | |
| 439 | S | A | -0.3511 | |
| 440 | T | A | -0.1072 | |
| 441 | L | A | -0.0263 | |
| 442 | S | A | -0.3733 | |
| 443 | C | A | -1.6464 | |
| 444 | K | A | -2.6152 | |
| 445 | E | A | -2.6004 | |
| 446 | K | A | -2.3194 | |
| 447 | A | A | -1.6129 | |
| 448 | D | A | -2.3631 | |
| 449 | V | A | 0.0000 | |
| 450 | K | A | -3.1671 | |
| 451 | D | A | -3.2451 | |
| 452 | T | A | 0.0000 | |
| 453 | D | A | -2.1777 | |
| 454 | A | A | -1.1240 | |
| 455 | V | A | 0.0000 | |
| 456 | D | A | -2.1633 | |
| 457 | V | A | 0.0000 | |
| 458 | C | A | -0.6374 | |
| 459 | I | A | -0.1732 | |
| 460 | A | A | -0.7744 | |
| 461 | D | A | -1.9184 | |
| 462 | G | A | -1.1788 | |
| 463 | V | A | 0.0000 | |
| 464 | C | A | -0.9954 | |
| 465 | I | A | 0.0000 | |
| 466 | D | A | -2.5678 | |
| 467 | A | A | -1.1615 | |
| 468 | F | A | 0.3878 | |
| 469 | L | A | -0.5593 | |
| 470 | K | A | -1.0602 | |
| 471 | P | A | -0.6001 | |
| 472 | P | A | -0.4585 | |
| 473 | M | A | -0.4747 | |
| 474 | E | A | -2.2716 | |
| 475 | T | A | -2.1245 | |
| 476 | E | A | -3.3842 | |
| 477 | E | A | -3.1781 | |
| 478 | P | A | -1.4207 | |
| 479 | Q | A | -0.3889 | |
| 480 | I | A | 2.2447 | |
| 481 | F | A | 2.8227 | |
| 482 | Y | A | 2.0209 | |
| 483 | N | A | 0.1276 | |
| 484 | A | A | -0.1028 | |
| 485 | S | A | -0.5065 | |
| 486 | P | A | -0.6097 | |
| 487 | S | A | -0.0451 | |
| 488 | T | A | 0.4772 | |
| 489 | L | A | 1.3615 | |
| 490 | S | A | 0.6455 | |
| 491 | A | A | 0.8133 | |
| 492 | T | A | 1.3383 | |
| 493 | M | A | 2.6493 | |
| 494 | F | A | 3.5098 | |
| 495 | I | A | 3.4811 | |
| 496 | W | A | 2.0945 | |
| 497 | R | A | 0.0185 | |
| 498 | L | A | 0.9210 | |
| 499 | E | A | -0.4333 | |
| 500 | V | A | 1.0543 | |
| 501 | W | A | 0.5384 | |
| 502 | D | A | -1.4124 | |
| 503 | Q | A | -1.2662 | |
| 504 | G | A | -0.3582 | |
| 505 | I | A | 0.7587 | |
| 506 | S | A | -0.0391 | |
| 507 | R | A | -0.4499 | |
| 508 | I | A | 1.3900 | |
| 509 | G | A | 1.5556 | |
| 510 | F | A | 2.9086 | |
| 511 | F | A | 3.0044 |