| Chain sequence(s) |
A: MNHKVHHHHHHIEGRHMQAKLTKKEFIEWLKTSEGKQFNVDLWYGFQCFDYANAGWKVLFGLLLKGLGAKDIPFANNFDGLATVYQNTPDFLAQPGDMVVFGSNYGAGYGHVAWVIEATLDYIIVYEQNWLGGGWTDRIEQPGWGWEKVTRRQHAYDFPMWFIRPNFKSETAPRSIQSPTQASKKETAKPQPKAVELKIIKDVVKGYDLPKRGGNPKGIVIHNDAGSKGATAEAYRNGLVNAPLSRLEAGIAHSYVSGNTVWQALDESQVGWHTANQLGNKYYYGIEVCQSMGADNATFLKNEQATFQECARLLKKWGLPANRNTIRLHNEFTSTSCPHRSSVLHTGFDPVTRGLLPEDKQLQLKDYFIKQIRVYMDGKIPVATVSNESSASSNTVKPVASAWKRNKYGTYYMEENARFTNGNQPITVRKIGPFLSCPVAYQFQPGGYCDYTEVMLQDGHVWVGYTWEGQRYYLPIRTWNGSAPPNQILGDLWGEIS
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 (00:06:09)
[INFO] Main: Simulation completed successfully. (00:06:13)
|
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 | 0.0252 | |
| 2 | N | A | -1.4880 | |
| 3 | H | A | -1.8428 | |
| 4 | K | A | -1.9165 | |
| 5 | V | A | -0.2984 | |
| 6 | H | A | -1.5609 | |
| 7 | H | A | -2.0837 | |
| 8 | H | A | -2.4201 | |
| 9 | H | A | -2.3648 | |
| 10 | H | A | -2.0207 | |
| 11 | H | A | -1.4970 | |
| 12 | I | A | -0.1765 | |
| 13 | E | A | -2.1246 | |
| 14 | G | A | -2.3251 | |
| 15 | R | A | -3.0078 | |
| 16 | H | A | -2.8597 | |
| 17 | M | A | -1.9958 | |
| 18 | Q | A | -2.4391 | |
| 19 | A | A | 0.0000 | |
| 20 | K | A | -2.3111 | |
| 21 | L | A | -1.9512 | |
| 22 | T | A | -2.7907 | |
| 23 | K | A | -2.7746 | |
| 24 | K | A | -3.1910 | |
| 25 | E | A | -2.9451 | |
| 26 | F | A | 0.0000 | |
| 27 | I | A | -1.8801 | |
| 28 | E | A | -2.9197 | |
| 29 | W | A | -1.7035 | |
| 30 | L | A | 0.0000 | |
| 31 | K | A | -2.6061 | |
| 32 | T | A | -1.8270 | |
| 33 | S | A | 0.0000 | |
| 34 | E | A | -3.1927 | |
| 35 | G | A | -2.6549 | |
| 36 | K | A | -2.6434 | |
| 37 | Q | A | -1.4421 | |
| 38 | F | A | -0.4288 | |
| 39 | N | A | 0.3095 | |
| 40 | V | A | -0.0426 | |
| 41 | D | A | -0.7787 | |
| 42 | L | A | 0.3991 | |
| 43 | W | A | 0.4546 | |
| 44 | Y | A | 0.1883 | |
| 45 | G | A | 0.0000 | |
| 46 | F | A | 0.2856 | |
| 47 | Q | A | 0.0242 | |
| 48 | C | A | 0.0278 | |
| 49 | F | A | 0.0485 | |
| 50 | D | A | 0.0000 | |
| 51 | Y | A | 0.0000 | |
| 52 | A | A | 0.0000 | |
| 53 | N | A | 0.0000 | |
| 54 | A | A | 0.0000 | |
| 55 | G | A | 0.0000 | |
| 56 | W | A | 0.0000 | |
| 57 | K | A | -0.8448 | |
| 58 | V | A | -0.3713 | |
| 59 | L | A | 0.0000 | |
| 60 | F | A | 0.0000 | |
| 61 | G | A | -0.6564 | |
| 62 | L | A | 0.2008 | |
| 63 | L | A | 0.1744 | |
| 64 | L | A | 0.0000 | |
| 65 | K | A | -1.2276 | |
| 66 | G | A | -0.0927 | |
| 67 | L | A | 1.1643 | |
| 68 | G | A | 0.0000 | |
| 69 | A | A | 0.0000 | |
| 70 | K | A | -0.0380 | |
| 71 | D | A | 0.1482 | |
| 72 | I | A | 0.0000 | |
| 73 | P | A | 0.0000 | |
| 74 | F | A | 1.3007 | |
| 75 | A | A | 0.0590 | |
| 76 | N | A | -0.8896 | |
| 77 | N | A | -1.6679 | |
| 78 | F | A | 0.0000 | |
| 79 | D | A | -2.6905 | |
| 80 | G | A | -2.3477 | |
| 81 | L | A | -1.7239 | |
| 82 | A | A | -1.0769 | |
| 83 | T | A | -0.3570 | |
| 84 | V | A | 0.3381 | |
| 85 | Y | A | 0.1504 | |
| 86 | Q | A | -0.6175 | |
| 87 | N | A | 0.0000 | |
| 88 | T | A | -0.5274 | |
| 89 | P | A | -0.7587 | |
| 90 | D | A | -1.5981 | |
| 91 | F | A | -0.4456 | |
| 92 | L | A | 0.3573 | |
| 93 | A | A | 0.0000 | |
| 94 | Q | A | -0.5528 | |
| 95 | P | A | -0.7554 | |
| 96 | G | A | 0.0000 | |
| 97 | D | A | 0.0000 | |
| 98 | M | A | 0.0000 | |
| 99 | V | A | 0.0000 | |
| 100 | V | A | 0.0000 | |
| 101 | F | A | 0.0000 | |
| 102 | G | A | 0.0000 | |
| 103 | S | A | -0.4769 | |
| 104 | N | A | -1.0676 | |
| 105 | Y | A | -0.4115 | |
| 106 | G | A | -0.1860 | |
| 107 | A | A | -0.1616 | |
| 108 | G | A | -0.1322 | |
| 109 | Y | A | 0.7995 | |
| 110 | G | A | 0.0000 | |
| 111 | H | A | 0.0000 | |
| 112 | V | A | 0.0000 | |
| 113 | A | A | 0.0000 | |
| 114 | W | A | 0.0000 | |
| 115 | V | A | 0.0000 | |
| 116 | I | A | -0.9272 | |
| 117 | E | A | -0.9134 | |
| 118 | A | A | -0.3703 | |
| 119 | T | A | -0.0571 | |
| 120 | L | A | -0.0115 | |
| 121 | D | A | -0.6054 | |
| 122 | Y | A | 0.0000 | |
| 123 | I | A | 0.0000 | |
| 124 | I | A | -1.0294 | |
| 125 | V | A | 0.0000 | |
| 126 | Y | A | 0.0000 | |
| 127 | E | A | 0.0000 | |
| 128 | Q | A | 0.0000 | |
| 129 | N | A | 0.1733 | |
| 130 | W | A | 0.6055 | |
| 131 | L | A | 1.3521 | |
| 132 | G | A | 0.4325 | |
| 133 | G | A | 0.0000 | |
| 134 | G | A | 0.0000 | |
| 135 | W | A | 0.4860 | |
| 136 | T | A | -0.0630 | |
| 137 | D | A | -0.5161 | |
| 138 | R | A | -1.4153 | |
| 139 | I | A | 0.1861 | |
| 140 | E | A | -1.0321 | |
| 141 | Q | A | -1.0316 | |
| 142 | P | A | -0.0252 | |
| 143 | G | A | 0.0000 | |
| 144 | W | A | 1.0449 | |
| 145 | G | A | 0.0000 | |
| 146 | W | A | 0.9511 | |
| 147 | E | A | 0.0000 | |
| 148 | K | A | -2.0359 | |
| 149 | V | A | 0.0000 | |
| 150 | T | A | -2.2805 | |
| 151 | R | A | -2.8451 | |
| 152 | R | A | -1.6719 | |
| 153 | Q | A | -1.7298 | |
| 154 | H | A | -0.7569 | |
| 155 | A | A | -0.3187 | |
| 156 | Y | A | 0.2114 | |
| 157 | D | A | 0.2013 | |
| 158 | F | A | 1.2069 | |
| 159 | P | A | 0.3346 | |
| 160 | M | A | 0.0000 | |
| 161 | W | A | 0.0000 | |
| 162 | F | A | 0.0000 | |
| 163 | I | A | 0.0000 | |
| 164 | R | A | -0.5550 | |
| 165 | P | A | 0.0000 | |
| 166 | N | A | -2.3127 | |
| 167 | F | A | -2.2385 | |
| 168 | K | A | -2.8392 | |
| 169 | S | A | -2.1167 | |
| 170 | E | A | -2.6216 | |
| 171 | T | A | -1.4598 | |
| 172 | A | A | -1.0911 | |
| 173 | P | A | -1.1760 | |
| 174 | R | A | -1.7233 | |
| 175 | S | A | -0.5437 | |
| 176 | I | A | 0.7988 | |
| 177 | Q | A | -0.6869 | |
| 178 | S | A | -0.6262 | |
| 179 | P | A | -0.9415 | |
| 180 | T | A | -1.0023 | |
| 181 | Q | A | -1.5072 | |
| 182 | A | A | -1.2773 | |
| 183 | S | A | -1.9487 | |
| 184 | K | A | -3.2051 | |
| 185 | K | A | -3.4579 | |
| 186 | E | A | -3.3619 | |
| 187 | T | A | -2.0643 | |
| 188 | A | A | -1.7080 | |
| 189 | K | A | -2.3870 | |
| 190 | P | A | -1.9599 | |
| 191 | Q | A | -2.1847 | |
| 192 | P | A | -1.8822 | |
| 193 | K | A | -2.3603 | |
| 194 | A | A | -1.3581 | |
| 195 | V | A | -1.2920 | |
| 196 | E | A | -2.2874 | |
| 197 | L | A | -1.4944 | |
| 198 | K | A | -2.0615 | |
| 199 | I | A | -0.8497 | |
| 200 | I | A | -0.8551 | |
| 201 | K | A | -1.6823 | |
| 202 | D | A | -0.8731 | |
| 203 | V | A | -0.6056 | |
| 204 | V | A | 0.0000 | |
| 205 | K | A | -2.1688 | |
| 206 | G | A | -1.5664 | |
| 207 | Y | A | -1.1772 | |
| 208 | D | A | -2.1501 | |
| 209 | L | A | 0.0000 | |
| 210 | P | A | -1.5094 | |
| 211 | K | A | -2.4926 | |
| 212 | R | A | 0.0000 | |
| 213 | G | A | -1.5323 | |
| 214 | G | A | -1.8653 | |
| 215 | N | A | -2.1477 | |
| 216 | P | A | 0.0000 | |
| 217 | K | A | -1.9823 | |
| 218 | G | A | 0.0000 | |
| 219 | I | A | 0.0000 | |
| 220 | V | A | 0.0000 | |
| 221 | I | A | 0.0000 | |
| 222 | H | A | 0.0000 | |
| 223 | N | A | 0.0000 | |
| 224 | D | A | -0.1558 | |
| 225 | A | A | -0.0337 | |
| 226 | G | A | 0.0000 | |
| 227 | S | A | -0.9100 | |
| 228 | K | A | -2.1329 | |
| 229 | G | A | -1.4800 | |
| 230 | A | A | -0.9501 | |
| 231 | T | A | -1.1051 | |
| 232 | A | A | 0.0000 | |
| 233 | E | A | -1.7036 | |
| 234 | A | A | -1.1955 | |
| 235 | Y | A | -0.8676 | |
| 236 | R | A | -1.6174 | |
| 237 | N | A | -1.9925 | |
| 238 | G | A | -1.3536 | |
| 239 | L | A | -1.2534 | |
| 240 | V | A | -1.1887 | |
| 241 | N | A | -2.0430 | |
| 242 | A | A | 0.0000 | |
| 243 | P | A | -1.1550 | |
| 244 | L | A | -0.9892 | |
| 245 | S | A | -1.1933 | |
| 246 | R | A | -2.0289 | |
| 247 | L | A | 0.0000 | |
| 248 | E | A | -2.1044 | |
| 249 | A | A | -1.2458 | |
| 250 | G | A | -0.9694 | |
| 251 | I | A | 0.0000 | |
| 252 | A | A | 0.0000 | |
| 253 | H | A | 0.0000 | |
| 254 | S | A | 0.0000 | |
| 255 | Y | A | 0.0000 | |
| 256 | V | A | 0.0000 | |
| 257 | S | A | 0.0000 | |
| 258 | G | A | -0.9768 | |
| 259 | N | A | -1.7198 | |
| 260 | T | A | -1.2437 | |
| 261 | V | A | 0.0000 | |
| 262 | W | A | 0.0000 | |
| 263 | Q | A | 0.0000 | |
| 264 | A | A | 0.0000 | |
| 265 | L | A | 0.0000 | |
| 266 | D | A | -1.6460 | |
| 267 | E | A | -1.2828 | |
| 268 | S | A | -1.6299 | |
| 269 | Q | A | 0.0000 | |
| 270 | V | A | -0.9396 | |
| 271 | G | A | 0.0000 | |
| 272 | W | A | -0.5248 | |
| 273 | H | A | 0.0000 | |
| 274 | T | A | 0.0000 | |
| 275 | A | A | -0.1588 | |
| 276 | N | A | -0.4616 | |
| 277 | Q | A | -0.6692 | |
| 278 | L | A | 0.8089 | |
| 279 | G | A | 0.0000 | |
| 280 | N | A | -0.1784 | |
| 281 | K | A | -0.8590 | |
| 282 | Y | A | -0.4394 | |
| 283 | Y | A | -0.3212 | |
| 284 | Y | A | 0.0000 | |
| 285 | G | A | 0.0000 | |
| 286 | I | A | 0.0000 | |
| 287 | E | A | -0.2939 | |
| 288 | V | A | 0.0000 | |
| 289 | C | A | 0.0000 | |
| 290 | Q | A | 0.0000 | |
| 291 | S | A | 0.0000 | |
| 292 | M | A | 0.1854 | |
| 293 | G | A | -1.0327 | |
| 294 | A | A | 0.0000 | |
| 295 | D | A | -2.2535 | |
| 296 | N | A | -1.2556 | |
| 297 | A | A | -0.6265 | |
| 298 | T | A | -1.2419 | |
| 299 | F | A | 0.0000 | |
| 300 | L | A | -0.6840 | |
| 301 | K | A | -1.2094 | |
| 302 | N | A | 0.0000 | |
| 303 | E | A | 0.0000 | |
| 304 | Q | A | -0.1850 | |
| 305 | A | A | 0.0000 | |
| 306 | T | A | 0.0000 | |
| 307 | F | A | 0.0000 | |
| 308 | Q | A | -0.5632 | |
| 309 | E | A | 0.0000 | |
| 310 | C | A | 0.0000 | |
| 311 | A | A | 0.0000 | |
| 312 | R | A | -1.6348 | |
| 313 | L | A | 0.0000 | |
| 314 | L | A | 0.0000 | |
| 315 | K | A | -2.7983 | |
| 316 | K | A | -2.8563 | |
| 317 | W | A | -1.9868 | |
| 318 | G | A | -1.5777 | |
| 319 | L | A | -1.0827 | |
| 320 | P | A | -0.9481 | |
| 321 | A | A | 0.0000 | |
| 322 | N | A | -1.2571 | |
| 323 | R | A | -1.5035 | |
| 324 | N | A | -2.0190 | |
| 325 | T | A | 0.0000 | |
| 326 | I | A | 0.0000 | |
| 327 | R | A | -0.8416 | |
| 328 | L | A | 0.0000 | |
| 329 | H | A | -0.4136 | |
| 330 | N | A | -0.4374 | |
| 331 | E | A | -0.8768 | |
| 332 | F | A | -0.1473 | |
| 333 | T | A | -0.2727 | |
| 334 | S | A | -0.0390 | |
| 335 | T | A | 0.3171 | |
| 336 | S | A | 0.4435 | |
| 337 | C | A | 0.0000 | |
| 338 | P | A | 0.0000 | |
| 339 | H | A | 0.0000 | |
| 340 | R | A | 0.1718 | |
| 341 | S | A | 0.0000 | |
| 342 | S | A | 0.0000 | |
| 343 | V | A | 0.1039 | |
| 344 | L | A | 0.0000 | |
| 345 | H | A | 0.0000 | |
| 346 | T | A | 0.0000 | |
| 347 | G | A | -1.0133 | |
| 348 | F | A | -0.2462 | |
| 349 | D | A | -0.0373 | |
| 350 | P | A | 0.0000 | |
| 351 | V | A | 1.3324 | |
| 352 | T | A | -0.0643 | |
| 353 | R | A | -1.2508 | |
| 354 | G | A | -0.0126 | |
| 355 | L | A | 0.9284 | |
| 356 | L | A | 0.0000 | |
| 357 | P | A | -1.3664 | |
| 358 | E | A | -2.6180 | |
| 359 | D | A | -2.7380 | |
| 360 | K | A | -1.5436 | |
| 361 | Q | A | -1.3073 | |
| 362 | L | A | -0.9436 | |
| 363 | Q | A | -1.0744 | |
| 364 | L | A | 0.0000 | |
| 365 | K | A | 0.0000 | |
| 366 | D | A | -0.6810 | |
| 367 | Y | A | -0.2977 | |
| 368 | F | A | 0.0000 | |
| 369 | I | A | 0.0000 | |
| 370 | K | A | -0.9558 | |
| 371 | Q | A | 0.0000 | |
| 372 | I | A | 0.0000 | |
| 373 | R | A | -0.9998 | |
| 374 | V | A | -0.6448 | |
| 375 | Y | A | -1.0227 | |
| 376 | M | A | -1.6057 | |
| 377 | D | A | -2.2052 | |
| 378 | G | A | -1.7812 | |
| 379 | K | A | -1.9142 | |
| 380 | I | A | -0.1263 | |
| 381 | P | A | 0.7835 | |
| 382 | V | A | 1.6723 | |
| 383 | A | A | 0.9145 | |
| 384 | T | A | 0.2644 | |
| 385 | V | A | -0.1859 | |
| 386 | S | A | 0.0000 | |
| 387 | N | A | -2.4214 | |
| 388 | E | A | -2.4356 | |
| 389 | S | A | 0.0000 | |
| 390 | S | A | -1.2978 | |
| 391 | A | A | -1.1459 | |
| 392 | S | A | -1.4099 | |
| 393 | S | A | -1.3437 | |
| 394 | N | A | -1.6501 | |
| 395 | T | A | 0.0000 | |
| 396 | V | A | -0.6511 | |
| 397 | K | A | -1.7225 | |
| 398 | P | A | -0.8653 | |
| 399 | V | A | 0.0674 | |
| 400 | A | A | -0.4255 | |
| 401 | S | A | -0.2715 | |
| 402 | A | A | -0.7602 | |
| 403 | W | A | 0.0000 | |
| 404 | K | A | -2.6252 | |
| 405 | R | A | -2.8428 | |
| 406 | N | A | -2.0507 | |
| 407 | K | A | -1.7026 | |
| 408 | Y | A | -0.0003 | |
| 409 | G | A | -0.8967 | |
| 410 | T | A | 0.0000 | |
| 411 | Y | A | -1.1089 | |
| 412 | Y | A | -1.2854 | |
| 413 | M | A | 0.0000 | |
| 414 | E | A | -2.5460 | |
| 415 | E | A | -2.0795 | |
| 416 | N | A | -2.3911 | |
| 417 | A | A | -1.6934 | |
| 418 | R | A | -1.7143 | |
| 419 | F | A | 0.0000 | |
| 420 | T | A | -0.7913 | |
| 421 | N | A | 0.0000 | |
| 422 | G | A | -1.5859 | |
| 423 | N | A | -2.1729 | |
| 424 | Q | A | -2.1946 | |
| 425 | P | A | -1.7984 | |
| 426 | I | A | 0.0000 | |
| 427 | T | A | -0.2609 | |
| 428 | V | A | 0.0000 | |
| 429 | R | A | 0.6164 | |
| 430 | K | A | 0.6646 | |
| 431 | I | A | 1.7817 | |
| 432 | G | A | 0.0000 | |
| 433 | P | A | 0.0000 | |
| 434 | F | A | 0.5708 | |
| 435 | L | A | 0.7332 | |
| 436 | S | A | 0.3073 | |
| 437 | C | A | 0.9648 | |
| 438 | P | A | 0.9470 | |
| 439 | V | A | 1.3906 | |
| 440 | A | A | 0.6631 | |
| 441 | Y | A | 0.0159 | |
| 442 | Q | A | -1.2994 | |
| 443 | F | A | 0.0000 | |
| 444 | Q | A | -1.9950 | |
| 445 | P | A | -1.7735 | |
| 446 | G | A | -1.2567 | |
| 447 | G | A | -0.2977 | |
| 448 | Y | A | 0.2290 | |
| 449 | C | A | 0.0000 | |
| 450 | D | A | -1.7056 | |
| 451 | Y | A | 0.0000 | |
| 452 | T | A | -1.8177 | |
| 453 | E | A | -1.6630 | |
| 454 | V | A | 0.0000 | |
| 455 | M | A | 0.0000 | |
| 456 | L | A | 0.0000 | |
| 457 | Q | A | -0.5604 | |
| 458 | D | A | -1.2175 | |
| 459 | G | A | -1.1553 | |
| 460 | H | A | -0.7438 | |
| 461 | V | A | 0.0000 | |
| 462 | W | A | 0.0000 | |
| 463 | V | A | 0.0000 | |
| 464 | G | A | 0.0000 | |
| 465 | Y | A | 0.0000 | |
| 466 | T | A | -0.6773 | |
| 467 | W | A | -0.4051 | |
| 468 | E | A | -1.7803 | |
| 469 | G | A | -1.4278 | |
| 470 | Q | A | -1.2053 | |
| 471 | R | A | -0.6063 | |
| 472 | Y | A | 0.0000 | |
| 473 | Y | A | 0.4504 | |
| 474 | L | A | 0.0000 | |
| 475 | P | A | 0.0000 | |
| 476 | I | A | 0.0000 | |
| 477 | R | A | 0.0000 | |
| 478 | T | A | -0.7138 | |
| 479 | W | A | 0.0000 | |
| 480 | N | A | -1.4889 | |
| 481 | G | A | -1.3371 | |
| 482 | S | A | -0.8201 | |
| 483 | A | A | -0.7700 | |
| 484 | P | A | -0.7722 | |
| 485 | P | A | -0.6703 | |
| 486 | N | A | -1.1441 | |
| 487 | Q | A | 0.0000 | |
| 488 | I | A | 0.3918 | |
| 489 | L | A | -0.1603 | |
| 490 | G | A | -1.0385 | |
| 491 | D | A | -1.8438 | |
| 492 | L | A | -0.9509 | |
| 493 | W | A | -0.8138 | |
| 494 | G | A | -1.3242 | |
| 495 | E | A | -1.9348 | |
| 496 | I | A | 0.0000 | |
| 497 | S | A | -1.2980 |
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