| Chain sequence(s) |
A: LNFRAPPVIPNVPFLWAWNAPSEFCLGKFDEPLDMSLFSFIGSPRINATGQGVTIFYVDRLGYYPYIDSITGVTVNGGIPQKISLQDHLDKAKKDITFYMPVDNLGMAVIDWEEWRPTWARNWKPKDVYKNRSIELVQQQNVQLSLTEATEKAKQEFEKAGKDFLVETIKLGKLLRPNHLWGYYLFPDCYNHHYKKPGYNGSCFNVEIKRNDDLSWLWNESTALYPSIYLNTQQSPVAATLYVRNRVREAIRVSKIPDAKSPLPVFAYTRIVFTDQVLKFLSQDELVYTFGETVALGASGIVIWGTLSIMRSMKSCLLLDNYMETILNPYIINVTLAAKMCSQVLCQEQGVCIRKNWNSSDYLHLNPDNFAIQLEKGGKFTVRGKPTLEDLEQFSEKFYCSCYSTLSCKEKADVKDTDAVDVCIADGVCIDAFLKPPMETEEPQIFYNASPSTLS
input PDB |
| Selected Chain(s) | A |
| Distance of aggregation | 10 Å |
| FoldX usage | Yes |
| Dynamic mode | No |
| Automated mutations | No |
| Mutated residues | VA142A,LP388A,LS174A,FS29A,LP307A,LS278A,LQ1A,VS237A,FT433A,FT204A,LQ318A |
| Energy difference between WT (input) and mutated protein (by FoldX) | 2.59129 kcal/mol
CAUTION: Your mutation/s can destabilize the protein structure |
| 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] FoldX: Building mutant model (00:05:27)
[INFO] FoldX: Starting FoldX energy minimalization (00:07:00)
[INFO] Analysis: Starting Aggrescan3D on folded.pdb (00:09:00)
[INFO] Main: Simulation completed successfully. (00:09:03)
|
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 | Q | A | -1.5747 | mutated: LQ1A |
| 2 | N | A | -1.1419 | |
| 3 | F | A | -0.7192 | |
| 4 | R | A | 0.0000 | |
| 5 | A | A | -0.2158 | |
| 6 | P | A | -0.0492 | |
| 7 | P | A | -0.1358 | |
| 8 | V | A | 0.3929 | |
| 9 | I | A | 0.2004 | |
| 10 | P | A | -0.5498 | |
| 11 | N | A | -1.2996 | |
| 12 | V | A | -0.2939 | |
| 13 | P | A | -0.4347 | |
| 14 | F | A | 0.0000 | |
| 15 | L | A | 0.0000 | |
| 16 | W | A | 0.0000 | |
| 17 | A | A | 0.0000 | |
| 18 | W | A | 0.0000 | |
| 19 | N | A | 0.0000 | |
| 20 | A | A | 0.0000 | |
| 21 | P | A | 0.0000 | |
| 22 | S | A | -0.1345 | |
| 23 | E | A | -0.3364 | |
| 24 | F | A | 1.1921 | |
| 25 | C | A | 0.0000 | |
| 26 | L | A | -1.0005 | |
| 27 | G | A | 0.0000 | |
| 28 | K | A | -2.8060 | |
| 29 | S | A | -2.3607 | mutated: FS29A |
| 30 | D | A | -3.0681 | |
| 31 | E | A | -3.2742 | |
| 32 | P | A | -1.6858 | |
| 33 | L | A | 0.0000 | |
| 34 | D | A | -1.2544 | |
| 35 | M | A | -0.1382 | |
| 36 | S | A | -0.7708 | |
| 37 | L | A | 0.0000 | |
| 38 | F | A | 0.0000 | |
| 39 | S | A | 0.2086 | |
| 40 | F | A | 0.0000 | |
| 41 | I | A | 0.7840 | |
| 42 | G | A | 0.0000 | |
| 43 | S | A | 0.0000 | |
| 44 | P | A | 0.0000 | |
| 45 | R | A | -0.4588 | |
| 46 | I | A | 0.4503 | |
| 47 | N | A | -0.5338 | |
| 48 | A | A | -0.3504 | |
| 49 | T | A | -0.0085 | |
| 50 | G | A | -0.2892 | |
| 51 | Q | A | -0.1949 | |
| 52 | G | A | -0.0820 | |
| 53 | V | A | 0.0000 | |
| 54 | T | A | 0.0000 | |
| 55 | I | A | 0.0000 | |
| 56 | F | A | 0.0000 | |
| 57 | Y | A | -0.1619 | |
| 58 | V | A | -0.5354 | |
| 59 | D | A | -1.3206 | |
| 60 | R | A | -0.4138 | |
| 61 | L | A | 0.0000 | |
| 62 | G | A | 0.0000 | |
| 63 | Y | A | -0.3734 | |
| 64 | Y | A | 0.0000 | |
| 65 | P | A | 0.0000 | |
| 66 | Y | A | 0.1461 | |
| 67 | I | A | 0.0000 | |
| 68 | D | A | 0.5995 | |
| 69 | S | A | 0.6627 | |
| 70 | I | A | 1.9122 | |
| 71 | T | A | 1.0951 | |
| 72 | G | A | 0.8858 | |
| 73 | V | A | 1.7352 | |
| 74 | T | A | 0.6698 | |
| 75 | V | A | 0.4220 | |
| 76 | N | A | -0.2074 | |
| 77 | G | A | -0.6146 | |
| 78 | G | A | 0.0000 | |
| 79 | I | A | 0.0000 | |
| 80 | P | A | 0.0000 | |
| 81 | Q | A | -1.5369 | |
| 82 | K | A | -1.7411 | |
| 83 | I | A | -1.0551 | |
| 84 | S | A | -1.1605 | |
| 85 | L | A | -1.2047 | |
| 86 | Q | A | -2.2065 | |
| 87 | D | A | -2.6559 | |
| 88 | H | A | 0.0000 | |
| 89 | L | A | -1.9560 | |
| 90 | D | A | -2.7286 | |
| 91 | K | A | -2.3328 | |
| 92 | A | A | 0.0000 | |
| 93 | K | A | -2.2949 | |
| 94 | K | A | -2.2176 | |
| 95 | D | A | -1.2323 | |
| 96 | I | A | 0.0000 | |
| 97 | T | A | -0.0858 | |
| 98 | F | A | 0.9047 | |
| 99 | Y | A | 0.0000 | |
| 100 | M | A | 0.0000 | |
| 101 | P | A | 0.6367 | |
| 102 | V | A | 0.9769 | |
| 103 | D | A | -0.7622 | |
| 104 | N | A | -1.3297 | |
| 105 | L | A | -0.4372 | |
| 106 | G | A | 0.0000 | |
| 107 | M | A | 0.0000 | |
| 108 | A | A | 0.0000 | |
| 109 | V | A | 0.0000 | |
| 110 | I | A | 0.0000 | |
| 111 | D | A | -0.4499 | |
| 112 | W | A | 0.0000 | |
| 113 | E | A | -0.9548 | |
| 114 | E | A | -0.8323 | |
| 115 | W | A | 0.0000 | |
| 116 | R | A | 0.0000 | |
| 117 | P | A | 0.0000 | |
| 118 | T | A | -0.7700 | |
| 119 | W | A | 0.0000 | |
| 120 | A | A | -0.0671 | |
| 121 | R | A | 0.0000 | |
| 122 | N | A | 0.0000 | |
| 123 | W | A | -0.3446 | |
| 124 | K | A | -1.6957 | |
| 125 | P | A | -1.2810 | |
| 126 | K | A | -1.1751 | |
| 127 | D | A | -1.2499 | |
| 128 | V | A | -0.7553 | |
| 129 | Y | A | 0.0000 | |
| 130 | K | A | -1.4983 | |
| 131 | N | A | -1.8585 | |
| 132 | R | A | -2.0088 | |
| 133 | S | A | 0.0000 | |
| 134 | I | A | -2.1780 | |
| 135 | E | A | -2.7279 | |
| 136 | L | A | -2.1517 | |
| 137 | V | A | 0.0000 | |
| 138 | Q | A | -2.3239 | |
| 139 | Q | A | -2.6006 | |
| 140 | Q | A | -2.5027 | |
| 141 | N | A | -2.2061 | |
| 142 | A | A | -1.5456 | mutated: VA142A |
| 143 | Q | A | -1.6204 | |
| 144 | L | A | -1.1307 | |
| 145 | S | A | -0.1635 | |
| 146 | L | A | 0.3267 | |
| 147 | T | A | -0.6519 | |
| 148 | E | A | -2.1542 | |
| 149 | A | A | 0.0000 | |
| 150 | T | A | -2.2751 | |
| 151 | E | A | -3.5228 | |
| 152 | K | A | -3.5762 | |
| 153 | A | A | 0.0000 | |
| 154 | K | A | -3.3998 | |
| 155 | Q | A | -3.8577 | |
| 156 | E | A | -3.8424 | |
| 157 | F | A | 0.0000 | |
| 158 | E | A | -2.5414 | |
| 159 | K | A | -3.1415 | |
| 160 | A | A | -2.1167 | |
| 161 | G | A | 0.0000 | |
| 162 | K | A | -1.7403 | |
| 163 | D | A | -1.3084 | |
| 164 | F | A | 0.0000 | |
| 165 | L | A | 0.0000 | |
| 166 | V | A | -0.9593 | |
| 167 | E | A | -1.4289 | |
| 168 | T | A | 0.0000 | |
| 169 | I | A | 0.0000 | |
| 170 | K | A | -1.4039 | |
| 171 | L | A | -0.9983 | |
| 172 | G | A | 0.0000 | |
| 173 | K | A | -1.2048 | |
| 174 | S | A | -0.8581 | mutated: LS174A |
| 175 | L | A | -0.4858 | |
| 176 | R | A | -0.9079 | |
| 177 | P | A | -1.3783 | |
| 178 | N | A | -1.5747 | |
| 179 | H | A | 0.0000 | |
| 180 | L | A | -0.1054 | |
| 181 | W | A | 0.0000 | |
| 182 | G | A | 0.0000 | |
| 183 | Y | A | 0.0000 | |
| 184 | Y | A | 0.0303 | |
| 185 | L | A | 0.0583 | |
| 186 | F | A | 0.0000 | |
| 187 | P | A | 0.0000 | |
| 188 | D | A | 0.0000 | |
| 189 | C | A | 0.0000 | |
| 190 | Y | A | -0.1731 | |
| 191 | N | A | 0.0000 | |
| 192 | H | A | -1.6336 | |
| 193 | H | A | -2.5213 | |
| 194 | Y | A | -2.3479 | |
| 195 | K | A | -3.1918 | |
| 196 | K | A | -3.1752 | |
| 197 | P | A | -1.8883 | |
| 198 | G | A | -1.5575 | |
| 199 | Y | A | -1.8217 | |
| 200 | N | A | -1.6053 | |
| 201 | G | A | 0.0000 | |
| 202 | S | A | -0.8556 | |
| 203 | C | A | -0.4310 | |
| 204 | T | A | -0.5139 | mutated: FT204A |
| 205 | N | A | -1.2321 | |
| 206 | V | A | -0.3588 | |
| 207 | E | A | 0.0000 | |
| 208 | I | A | -1.1012 | |
| 209 | K | A | -2.3213 | |
| 210 | R | A | -1.7560 | |
| 211 | N | A | 0.0000 | |
| 212 | D | A | -1.7846 | |
| 213 | D | A | -2.4800 | |
| 214 | L | A | 0.0000 | |
| 215 | S | A | -0.9538 | |
| 216 | W | A | -0.6844 | |
| 217 | L | A | 0.0000 | |
| 218 | W | A | 0.0000 | |
| 219 | N | A | -1.4607 | |
| 220 | E | A | -1.1808 | |
| 221 | S | A | 0.0000 | |
| 222 | T | A | -0.4076 | |
| 223 | A | A | 0.0000 | |
| 224 | L | A | 0.0000 | |
| 225 | Y | A | 0.0000 | |
| 226 | P | A | 0.0000 | |
| 227 | S | A | 0.0000 | |
| 228 | I | A | 0.0000 | |
| 229 | Y | A | 0.1481 | |
| 230 | L | A | 0.0000 | |
| 231 | N | A | -1.1188 | |
| 232 | T | A | -1.4454 | |
| 233 | Q | A | -1.8547 | |
| 234 | Q | A | -1.3475 | |
| 235 | S | A | -0.9109 | |
| 236 | P | A | -0.8464 | |
| 237 | S | A | -0.4313 | mutated: VS237A |
| 238 | A | A | 0.0000 | |
| 239 | A | A | 0.0000 | |
| 240 | T | A | -0.2784 | |
| 241 | L | A | -0.2990 | |
| 242 | Y | A | 0.0000 | |
| 243 | V | A | 0.0000 | |
| 244 | R | A | 0.0000 | |
| 245 | N | A | 0.0000 | |
| 246 | R | A | 0.0000 | |
| 247 | V | A | 0.0000 | |
| 248 | R | A | -1.1337 | |
| 249 | E | A | 0.0000 | |
| 250 | A | A | 0.0000 | |
| 251 | I | A | 0.0000 | |
| 252 | R | A | -0.8861 | |
| 253 | V | A | 0.0000 | |
| 254 | S | A | 0.0000 | |
| 255 | K | A | -1.2787 | |
| 256 | I | A | -0.7016 | |
| 257 | P | A | -1.2784 | |
| 258 | D | A | -2.1064 | |
| 259 | A | A | -1.7163 | |
| 260 | K | A | -2.3715 | |
| 261 | S | A | -1.3855 | |
| 262 | P | A | 0.0000 | |
| 263 | L | A | -0.5065 | |
| 264 | P | A | 0.0401 | |
| 265 | V | A | 0.0000 | |
| 266 | F | A | 0.0000 | |
| 267 | A | A | 0.0000 | |
| 268 | Y | A | 0.0000 | |
| 269 | T | A | 0.0000 | |
| 270 | R | A | 0.0000 | |
| 271 | I | A | 0.0000 | |
| 272 | V | A | 0.0000 | |
| 273 | F | A | 0.0000 | |
| 274 | T | A | -1.0397 | |
| 275 | D | A | -2.1920 | |
| 276 | Q | A | -1.7148 | |
| 277 | V | A | -0.6245 | |
| 278 | S | A | -0.9988 | mutated: LS278A |
| 279 | K | A | -1.4821 | |
| 280 | F | A | -0.6610 | |
| 281 | L | A | 0.0000 | |
| 282 | S | A | -1.2891 | |
| 283 | Q | A | -1.8728 | |
| 284 | D | A | -2.3931 | |
| 285 | E | A | -1.4427 | |
| 286 | L | A | 0.0000 | |
| 287 | V | A | -0.7409 | |
| 288 | Y | A | -0.4753 | |
| 289 | T | A | 0.0000 | |
| 290 | F | A | 0.0000 | |
| 291 | G | A | 0.0000 | |
| 292 | E | A | 0.0000 | |
| 293 | T | A | 0.0000 | |
| 294 | V | A | 0.0000 | |
| 295 | A | A | 0.0000 | |
| 296 | L | A | 0.0000 | |
| 297 | G | A | 0.0000 | |
| 298 | A | A | 0.0000 | |
| 299 | S | A | 0.0499 | |
| 300 | G | A | 0.0000 | |
| 301 | I | A | 0.0000 | |
| 302 | V | A | 0.0000 | |
| 303 | I | A | 0.0000 | |
| 304 | W | A | 0.2153 | |
| 305 | G | A | 0.0000 | |
| 306 | T | A | -0.3311 | |
| 307 | P | A | -0.9588 | mutated: LP307A |
| 308 | S | A | -0.6637 | |
| 309 | I | A | 0.0000 | |
| 310 | M | A | -0.9866 | |
| 311 | R | A | -1.8455 | |
| 312 | S | A | -1.0668 | |
| 313 | M | A | -0.7055 | |
| 314 | K | A | -1.8621 | |
| 315 | S | A | -1.5107 | |
| 316 | C | A | 0.0000 | |
| 317 | L | A | -1.3306 | |
| 318 | Q | A | -1.7806 | mutated: LQ318A |
| 319 | L | A | 0.0000 | |
| 320 | D | A | 0.0000 | |
| 321 | N | A | -1.2040 | |
| 322 | Y | A | 0.0000 | |
| 323 | M | A | 0.0000 | |
| 324 | E | A | -1.1566 | |
| 325 | T | A | -0.4800 | |
| 326 | I | A | -0.2397 | |
| 327 | L | A | 0.0000 | |
| 328 | N | A | 0.0000 | |
| 329 | P | A | -0.2280 | |
| 330 | Y | A | 0.0000 | |
| 331 | I | A | 0.0000 | |
| 332 | I | A | 0.0000 | |
| 333 | N | A | -0.2891 | |
| 334 | V | A | 0.0000 | |
| 335 | T | A | 0.0000 | |
| 336 | L | A | 0.0000 | |
| 337 | A | A | 0.0000 | |
| 338 | A | A | 0.0000 | |
| 339 | K | A | -0.7388 | |
| 340 | M | A | 0.0000 | |
| 341 | C | A | 0.0000 | |
| 342 | S | A | 0.0000 | |
| 343 | Q | A | -1.3555 | |
| 344 | V | A | 0.0000 | |
| 345 | L | A | 0.0000 | |
| 346 | C | A | 0.0000 | |
| 347 | Q | A | -2.1629 | |
| 348 | E | A | -1.9001 | |
| 349 | Q | A | -1.6172 | |
| 350 | G | A | 0.0000 | |
| 351 | V | A | 0.0000 | |
| 352 | C | A | 0.0000 | |
| 353 | I | A | 0.0000 | |
| 354 | R | A | 0.0000 | |
| 355 | K | A | -2.7202 | |
| 356 | N | A | -2.3622 | |
| 357 | W | A | -1.4234 | |
| 358 | N | A | -1.5792 | |
| 359 | S | A | -1.3093 | |
| 360 | S | A | -0.6648 | |
| 361 | D | A | -1.0561 | |
| 362 | Y | A | -0.0753 | |
| 363 | L | A | 0.0000 | |
| 364 | H | A | -0.4647 | |
| 365 | L | A | 0.0000 | |
| 366 | N | A | -1.5637 | |
| 367 | P | A | -1.5208 | |
| 368 | D | A | -2.4037 | |
| 369 | N | A | -2.2126 | |
| 370 | F | A | 0.0000 | |
| 371 | A | A | -1.3174 | |
| 372 | I | A | -0.6497 | |
| 373 | Q | A | -1.7698 | |
| 374 | L | A | -1.7882 | |
| 375 | E | A | -3.3238 | |
| 376 | K | A | -3.2163 | |
| 377 | G | A | -2.3503 | |
| 378 | G | A | -2.8600 | |
| 379 | K | A | -3.3484 | |
| 380 | F | A | 0.0000 | |
| 381 | T | A | -1.5399 | |
| 382 | V | A | -1.1912 | |
| 383 | R | A | -2.5086 | |
| 384 | G | A | -2.4430 | |
| 385 | K | A | -2.3103 | |
| 386 | P | A | 0.0000 | |
| 387 | T | A | -1.3914 | |
| 388 | P | A | -2.1746 | mutated: LP388A |
| 389 | E | A | -2.8692 | |
| 390 | D | A | -2.1796 | |
| 391 | L | A | 0.0000 | |
| 392 | E | A | -3.4771 | |
| 393 | Q | A | -3.1252 | |
| 394 | F | A | 0.0000 | |
| 395 | S | A | -2.5654 | |
| 396 | E | A | -3.0026 | |
| 397 | K | A | -2.4963 | |
| 398 | F | A | 0.0000 | |
| 399 | Y | A | -0.9125 | |
| 400 | C | A | 0.0000 | |
| 401 | S | A | 0.0000 | |
| 402 | C | A | 0.0000 | |
| 403 | Y | A | 0.0000 | |
| 404 | S | A | 0.0000 | |
| 405 | T | A | -0.0659 | |
| 406 | L | A | 0.3093 | |
| 407 | S | A | -0.4621 | |
| 408 | C | A | 0.0000 | |
| 409 | K | A | -2.4583 | |
| 410 | E | A | -2.3613 | |
| 411 | K | A | -2.2283 | |
| 412 | A | A | -1.7679 | |
| 413 | D | A | -2.8190 | |
| 414 | V | A | 0.0000 | |
| 415 | K | A | -3.2953 | |
| 416 | D | A | -3.3670 | |
| 417 | T | A | 0.0000 | |
| 418 | D | A | -2.7297 | |
| 419 | A | A | -2.1145 | |
| 420 | V | A | 0.0000 | |
| 421 | D | A | -2.4684 | |
| 422 | V | A | 0.0000 | |
| 423 | C | A | -0.6903 | |
| 424 | I | A | -0.1294 | |
| 425 | A | A | -0.7706 | |
| 426 | D | A | -2.0895 | |
| 427 | G | A | -1.4304 | |
| 428 | V | A | 0.0000 | |
| 429 | C | A | -1.1500 | |
| 430 | I | A | 0.0000 | |
| 431 | D | A | -2.8526 | |
| 432 | A | A | -1.9919 | |
| 433 | T | A | -1.5821 | mutated: FT433A |
| 434 | L | A | -1.6143 | |
| 435 | K | A | -1.7635 | |
| 436 | P | A | -1.0296 | |
| 437 | P | A | -0.8275 | |
| 438 | M | A | -0.4502 | |
| 439 | E | A | -2.2566 | |
| 440 | T | A | -2.1350 | |
| 441 | E | A | -3.3782 | |
| 442 | E | A | -3.1662 | |
| 443 | P | A | -1.3937 | |
| 444 | Q | A | -0.4110 | |
| 445 | I | A | 2.2369 | |
| 446 | F | A | 2.8323 | |
| 447 | Y | A | 2.0333 | |
| 448 | N | A | 0.1087 | |
| 449 | A | A | -0.1310 | |
| 450 | S | A | -0.5496 | |
| 451 | P | A | -0.4434 | |
| 452 | S | A | -0.0465 | |
| 453 | T | A | 0.4379 | |
| 454 | L | A | 1.3259 | |
| 455 | S | A | 0.5187 |
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