| Chain sequence(s) |
A: MSQAYSSSQRVSSYRRTFGGAPGFPLGSPLSSPVFPRAGFGSKGSSSSVTSRVYQVSRTSGGAGGLGSLRASRLGTTRTPSSYGAGELLDFSLADAVNQEFLTTRTNEKVELQELNDRFANYIEKVRFLEQQNAALAAEVNRLKGREPTRVAELYEEELRELRRQVEVLTNQRARVDVERDNLLDDLQRLKAKLQEEIQLKEEAENNLAAFRADVDAATLARIDLERRIESLNEEIAFLKKVHEEEIRELQAQLQEQQVQVEMDMSKPDLTAALRDIRAQYETIAAKNISEAEEWYKSKVSDLTQAANKNNDALRQAKQEMMEYRHQIQSYTCEIDALKGTNDSLMRQMRELEDRFASEASGYQDNIARLEEEIRHLKDEMARHLREYQDLLNVKMALDVEIATYRKLLEGEESRINLPIQTYSALNFRETSPEQRGSEVHTKKTVMIKTIETRDGEVVSEATQQQHEVL
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 (00:13:50)
[INFO] Main: Simulation completed successfully. (00:13:55)
|
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 | 0.6984 | |
| 2 | S | A | -0.1628 | |
| 3 | Q | A | -0.7406 | |
| 4 | A | A | -0.0426 | |
| 5 | Y | A | 0.8148 | |
| 6 | S | A | -0.0432 | |
| 7 | S | A | -0.5786 | |
| 8 | S | A | -1.0292 | |
| 9 | Q | A | -1.7210 | |
| 10 | R | A | -1.7220 | |
| 11 | V | A | -0.0767 | |
| 12 | S | A | -0.4508 | |
| 13 | S | A | -0.4049 | |
| 14 | Y | A | 0.3515 | |
| 15 | R | A | -1.5314 | |
| 16 | R | A | -1.8628 | |
| 17 | T | A | -0.4265 | |
| 18 | F | A | 0.7804 | |
| 19 | G | A | -0.7760 | |
| 20 | G | A | -0.9598 | |
| 21 | A | A | -0.2460 | |
| 22 | P | A | -0.2615 | |
| 23 | G | A | 0.4526 | |
| 24 | F | A | 1.8978 | |
| 25 | P | A | 1.1586 | |
| 26 | L | A | 1.6075 | |
| 27 | G | A | 0.4810 | |
| 28 | S | A | 0.0291 | |
| 29 | P | A | 0.2082 | |
| 30 | L | A | 1.1306 | |
| 31 | S | A | 0.4883 | |
| 32 | S | A | 0.4980 | |
| 33 | P | A | 1.0990 | |
| 34 | V | A | 2.2377 | |
| 35 | F | A | 2.2084 | |
| 36 | P | A | 0.1338 | |
| 37 | R | A | -1.2466 | |
| 38 | A | A | -0.4917 | |
| 39 | G | A | -0.0778 | |
| 40 | F | A | 1.2431 | |
| 41 | G | A | -0.0345 | |
| 42 | S | A | -0.9362 | |
| 43 | K | A | -2.1807 | |
| 44 | G | A | -1.5468 | |
| 45 | S | A | -0.9727 | |
| 46 | S | A | -0.3662 | |
| 47 | S | A | -0.0717 | |
| 48 | S | A | 0.4129 | |
| 49 | V | A | 1.3048 | |
| 50 | T | A | 0.3112 | |
| 51 | S | A | -0.0851 | |
| 52 | R | A | -0.7388 | |
| 53 | V | A | 1.3593 | |
| 54 | Y | A | 1.5160 | |
| 55 | Q | A | 0.2522 | |
| 56 | V | A | 1.1374 | |
| 57 | S | A | -0.4506 | |
| 58 | R | A | -1.7803 | |
| 59 | T | A | -1.0974 | |
| 60 | S | A | -1.1225 | |
| 61 | G | A | -1.0963 | |
| 62 | G | A | -0.8361 | |
| 63 | A | A | -0.8133 | |
| 64 | G | A | -0.6491 | |
| 65 | G | A | 0.0003 | |
| 66 | L | A | 0.9182 | |
| 67 | G | A | 0.4951 | |
| 68 | S | A | 0.2453 | |
| 69 | L | A | 0.4117 | |
| 70 | R | A | -1.1217 | |
| 71 | A | A | -1.0486 | |
| 72 | S | A | -1.1043 | |
| 73 | R | A | -1.2763 | |
| 74 | L | A | 0.3469 | |
| 75 | G | A | -0.1198 | |
| 76 | T | A | -0.4424 | |
| 77 | T | A | -1.1035 | |
| 78 | R | A | -1.9837 | |
| 79 | T | A | -1.1468 | |
| 80 | P | A | -0.8431 | |
| 81 | S | A | -0.1762 | |
| 82 | S | A | 0.1737 | |
| 83 | Y | A | 0.9349 | |
| 84 | G | A | 0.1074 | |
| 85 | A | A | -0.5147 | |
| 86 | G | A | -0.9479 | |
| 87 | E | A | -0.9309 | |
| 88 | L | A | 1.1597 | |
| 89 | L | A | 1.3474 | |
| 90 | D | A | 0.0065 | |
| 91 | F | A | 1.1273 | |
| 92 | S | A | 0.4456 | |
| 93 | L | A | 1.0250 | |
| 94 | A | A | 0.1261 | |
| 95 | D | A | -1.4088 | |
| 96 | A | A | -0.5840 | |
| 97 | V | A | -0.1174 | |
| 98 | N | A | -1.1218 | |
| 99 | Q | A | -1.8500 | |
| 100 | E | A | -1.8517 | |
| 101 | F | A | -0.2619 | |
| 102 | L | A | -0.4703 | |
| 103 | T | A | -1.3544 | |
| 104 | T | A | -1.7745 | |
| 105 | R | A | -2.8935 | |
| 106 | T | A | -1.9995 | |
| 107 | N | A | -2.7247 | |
| 108 | E | A | -3.7100 | |
| 109 | K | A | -3.2097 | |
| 110 | V | A | -1.7694 | |
| 111 | E | A | -3.3637 | |
| 112 | L | A | -2.2842 | |
| 113 | Q | A | -2.6616 | |
| 114 | E | A | -3.3332 | |
| 115 | L | A | -2.1243 | |
| 116 | N | A | -2.2942 | |
| 117 | D | A | -2.9857 | |
| 118 | R | A | -2.4477 | |
| 119 | F | A | -0.1513 | |
| 120 | A | A | -1.0110 | |
| 121 | N | A | -1.9361 | |
| 122 | Y | A | 0.1424 | |
| 123 | I | A | 0.3353 | |
| 124 | E | A | -1.8488 | |
| 125 | K | A | -1.3434 | |
| 126 | V | A | -1.0366 | |
| 127 | R | A | -2.3043 | |
| 128 | F | A | -0.4823 | |
| 129 | L | A | -0.9554 | |
| 130 | E | A | -2.5412 | |
| 131 | Q | A | -2.1938 | |
| 132 | Q | A | -1.5814 | |
| 133 | N | A | -1.8243 | |
| 134 | A | A | -0.9811 | |
| 135 | A | A | -0.7938 | |
| 136 | L | A | -0.1498 | |
| 137 | A | A | -0.5614 | |
| 138 | A | A | -1.1688 | |
| 139 | E | A | -1.6653 | |
| 140 | V | A | -1.3940 | |
| 141 | N | A | -3.0885 | |
| 142 | R | A | -3.7289 | |
| 143 | L | A | -3.1283 | |
| 144 | K | A | -3.9734 | |
| 145 | G | A | -3.8195 | |
| 146 | R | A | -4.1235 | |
| 147 | E | A | -3.7851 | |
| 148 | P | A | -2.0073 | |
| 149 | T | A | -2.2466 | |
| 150 | R | A | -2.5220 | |
| 151 | V | A | -0.7279 | |
| 152 | A | A | -1.4695 | |
| 153 | E | A | -2.7604 | |
| 154 | L | A | -1.4448 | |
| 155 | Y | A | -1.3514 | |
| 156 | E | A | -3.5334 | |
| 157 | E | A | -4.2424 | |
| 158 | E | A | -3.8995 | |
| 159 | L | A | -3.0852 | |
| 160 | R | A | -4.5644 | |
| 161 | E | A | -4.5268 | |
| 162 | L | A | -2.2092 | |
| 163 | R | A | -3.5207 | |
| 164 | R | A | -3.6148 | |
| 165 | Q | A | -1.7330 | |
| 166 | V | A | -0.7991 | |
| 167 | E | A | -2.2698 | |
| 168 | V | A | -0.5158 | |
| 169 | L | A | -0.8822 | |
| 170 | T | A | -1.5557 | |
| 171 | N | A | -2.3876 | |
| 172 | Q | A | -2.5352 | |
| 173 | R | A | -3.3005 | |
| 174 | A | A | -2.6266 | |
| 175 | R | A | -3.5181 | |
| 176 | V | A | -3.1143 | |
| 177 | D | A | -3.6372 | |
| 178 | V | A | -1.8245 | |
| 179 | E | A | -3.2222 | |
| 180 | R | A | -3.3766 | |
| 181 | D | A | -3.2154 | |
| 182 | N | A | -2.7218 | |
| 183 | L | A | -1.1770 | |
| 184 | L | A | -0.6272 | |
| 185 | D | A | -2.9476 | |
| 186 | D | A | -2.2360 | |
| 187 | L | A | -0.9265 | |
| 188 | Q | A | -2.3110 | |
| 189 | R | A | -2.7285 | |
| 190 | L | A | -1.1621 | |
| 191 | K | A | -2.7165 | |
| 192 | A | A | -2.5020 | |
| 193 | K | A | -2.8612 | |
| 194 | L | A | -1.2539 | |
| 195 | Q | A | -2.4765 | |
| 196 | E | A | -3.3995 | |
| 197 | E | A | -3.2674 | |
| 198 | I | A | -2.0532 | |
| 199 | Q | A | -3.2466 | |
| 200 | L | A | -2.2590 | |
| 201 | K | A | -4.0392 | |
| 202 | E | A | -4.6298 | |
| 203 | E | A | -4.1307 | |
| 204 | A | A | -2.9919 | |
| 205 | E | A | -3.7400 | |
| 206 | N | A | -3.2963 | |
| 207 | N | A | -2.0098 | |
| 208 | L | A | -1.0184 | |
| 209 | A | A | -0.9634 | |
| 210 | A | A | -0.5310 | |
| 211 | F | A | 0.4054 | |
| 212 | R | A | -1.2683 | |
| 213 | A | A | -1.0625 | |
| 214 | D | A | -1.0945 | |
| 215 | V | A | 0.1705 | |
| 216 | D | A | -1.4581 | |
| 217 | A | A | -0.5612 | |
| 218 | A | A | -0.6569 | |
| 219 | T | A | -0.2244 | |
| 220 | L | A | 0.3805 | |
| 221 | A | A | -0.6479 | |
| 222 | R | A | -2.2159 | |
| 223 | I | A | -1.2358 | |
| 224 | D | A | -2.7056 | |
| 225 | L | A | -2.0103 | |
| 226 | E | A | -3.3913 | |
| 227 | R | A | -4.2528 | |
| 228 | R | A | -3.6711 | |
| 229 | I | A | -2.3704 | |
| 230 | E | A | -3.9491 | |
| 231 | S | A | -2.9580 | |
| 232 | L | A | -1.7928 | |
| 233 | N | A | -2.5151 | |
| 234 | E | A | -2.9535 | |
| 235 | E | A | -2.1733 | |
| 236 | I | A | -0.6357 | |
| 237 | A | A | -1.0344 | |
| 238 | F | A | -0.4081 | |
| 239 | L | A | -0.9232 | |
| 240 | K | A | -2.8040 | |
| 241 | K | A | -2.7886 | |
| 242 | V | A | -1.7676 | |
| 243 | H | A | -3.1538 | |
| 244 | E | A | -3.7746 | |
| 245 | E | A | -4.4462 | |
| 246 | E | A | -3.6485 | |
| 247 | I | A | -1.7215 | |
| 248 | R | A | -3.4391 | |
| 249 | E | A | -3.5119 | |
| 250 | L | A | -1.4900 | |
| 251 | Q | A | -2.1534 | |
| 252 | A | A | -2.3820 | |
| 253 | Q | A | -2.0346 | |
| 254 | L | A | -1.2015 | |
| 255 | Q | A | -2.4019 | |
| 256 | E | A | -2.5157 | |
| 257 | Q | A | -2.2098 | |
| 258 | Q | A | -1.7134 | |
| 259 | V | A | -0.2157 | |
| 260 | Q | A | -1.2636 | |
| 261 | V | A | 0.0980 | |
| 262 | E | A | -1.0239 | |
| 263 | M | A | -0.1675 | |
| 264 | D | A | -1.3021 | |
| 265 | M | A | -0.1554 | |
| 266 | S | A | -1.1455 | |
| 267 | K | A | -2.0492 | |
| 268 | P | A | -1.4280 | |
| 269 | D | A | -1.5647 | |
| 270 | L | A | -0.0243 | |
| 271 | T | A | -0.2259 | |
| 272 | A | A | -0.9384 | |
| 273 | A | A | -0.5790 | |
| 274 | L | A | -0.4210 | |
| 275 | R | A | -2.2234 | |
| 276 | D | A | -2.3740 | |
| 277 | I | A | -1.1202 | |
| 278 | R | A | -2.4101 | |
| 279 | A | A | -1.9585 | |
| 280 | Q | A | -1.3234 | |
| 281 | Y | A | -0.4757 | |
| 282 | E | A | -1.8890 | |
| 283 | T | A | -0.6453 | |
| 284 | I | A | 0.3897 | |
| 285 | A | A | -0.1446 | |
| 286 | A | A | -0.5202 | |
| 287 | K | A | -1.6285 | |
| 288 | N | A | -1.6441 | |
| 289 | I | A | 0.1201 | |
| 290 | S | A | -1.2747 | |
| 291 | E | A | -2.2320 | |
| 292 | A | A | -1.3768 | |
| 293 | E | A | -2.7368 | |
| 294 | E | A | -2.6803 | |
| 295 | W | A | -0.5736 | |
| 296 | Y | A | -0.6739 | |
| 297 | K | A | -2.1147 | |
| 298 | S | A | -1.5447 | |
| 299 | K | A | -1.4386 | |
| 300 | V | A | 0.4049 | |
| 301 | S | A | -0.7386 | |
| 302 | D | A | -1.7848 | |
| 303 | L | A | -0.1094 | |
| 304 | T | A | -0.8795 | |
| 305 | Q | A | -2.1991 | |
| 306 | A | A | -1.8404 | |
| 307 | A | A | -2.1645 | |
| 308 | N | A | -3.3921 | |
| 309 | K | A | -3.8781 | |
| 310 | N | A | -3.5897 | |
| 311 | N | A | -3.5077 | |
| 312 | D | A | -4.1297 | |
| 313 | A | A | -2.7386 | |
| 314 | L | A | -2.0651 | |
| 315 | R | A | -3.5804 | |
| 316 | Q | A | -3.1005 | |
| 317 | A | A | -2.0450 | |
| 318 | K | A | -2.3308 | |
| 319 | Q | A | -2.6246 | |
| 320 | E | A | -2.4691 | |
| 321 | M | A | -1.5234 | |
| 322 | M | A | -1.5867 | |
| 323 | E | A | -2.6337 | |
| 324 | Y | A | -1.0897 | |
| 325 | R | A | -2.1535 | |
| 326 | H | A | -2.3133 | |
| 327 | Q | A | -1.3216 | |
| 328 | I | A | 0.0824 | |
| 329 | Q | A | -1.2449 | |
| 330 | S | A | -0.7295 | |
| 331 | Y | A | 0.2706 | |
| 332 | T | A | -0.0095 | |
| 333 | C | A | -0.3794 | |
| 334 | E | A | -1.1344 | |
| 335 | I | A | -0.7178 | |
| 336 | D | A | -2.0129 | |
| 337 | A | A | -1.2259 | |
| 338 | L | A | -0.7651 | |
| 339 | K | A | -2.5894 | |
| 340 | G | A | -2.0880 | |
| 341 | T | A | -1.4434 | |
| 342 | N | A | -2.4479 | |
| 343 | D | A | -2.6731 | |
| 344 | S | A | -1.8391 | |
| 345 | L | A | -1.2080 | |
| 346 | M | A | -1.6877 | |
| 347 | R | A | -3.3495 | |
| 348 | Q | A | -2.7735 | |
| 349 | M | A | -2.5142 | |
| 350 | R | A | -4.1119 | |
| 351 | E | A | -4.2034 | |
| 352 | L | A | -2.8416 | |
| 353 | E | A | -3.9517 | |
| 354 | D | A | -4.2007 | |
| 355 | R | A | -3.4272 | |
| 356 | F | A | -1.2023 | |
| 357 | A | A | -1.4558 | |
| 358 | S | A | -1.8323 | |
| 359 | E | A | -2.2700 | |
| 360 | A | A | -1.1614 | |
| 361 | S | A | -1.3728 | |
| 362 | G | A | -1.3102 | |
| 363 | Y | A | -0.8720 | |
| 364 | Q | A | -2.0371 | |
| 365 | D | A | -2.9228 | |
| 366 | N | A | -2.1452 | |
| 367 | I | A | -1.3671 | |
| 368 | A | A | -2.2471 | |
| 369 | R | A | -3.2927 | |
| 370 | L | A | -1.7050 | |
| 371 | E | A | -2.7037 | |
| 372 | E | A | -3.9891 | |
| 373 | E | A | -3.4644 | |
| 374 | I | A | -2.3395 | |
| 375 | R | A | -4.0421 | |
| 376 | H | A | -3.3600 | |
| 377 | L | A | -1.8527 | |
| 378 | K | A | -3.3862 | |
| 379 | D | A | -3.7624 | |
| 380 | E | A | -2.9278 | |
| 381 | M | A | -1.7300 | |
| 382 | A | A | -2.2120 | |
| 383 | R | A | -3.5943 | |
| 384 | H | A | -2.8866 | |
| 385 | L | A | -1.2856 | |
| 386 | R | A | -3.1986 | |
| 387 | E | A | -3.0201 | |
| 388 | Y | A | -0.6474 | |
| 389 | Q | A | -2.0418 | |
| 390 | D | A | -2.2298 | |
| 391 | L | A | 0.3293 | |
| 392 | L | A | -0.0555 | |
| 393 | N | A | -0.8103 | |
| 394 | V | A | 1.0001 | |
| 395 | K | A | -0.4355 | |
| 396 | M | A | 0.6649 | |
| 397 | A | A | 0.9581 | |
| 398 | L | A | 1.0232 | |
| 399 | D | A | -0.1786 | |
| 400 | V | A | 1.0434 | |
| 401 | E | A | -0.1626 | |
| 402 | I | A | 0.6675 | |
| 403 | A | A | 0.0608 | |
| 404 | T | A | -0.0404 | |
| 405 | Y | A | 0.3027 | |
| 406 | R | A | -1.6024 | |
| 407 | K | A | -2.1618 | |
| 408 | L | A | -0.0201 | |
| 409 | L | A | -0.9694 | |
| 410 | E | A | -2.9713 | |
| 411 | G | A | -2.3676 | |
| 412 | E | A | -2.8833 | |
| 413 | E | A | -2.9481 | |
| 414 | S | A | -2.1768 | |
| 415 | R | A | -2.2588 | |
| 416 | I | A | -0.1354 | |
| 417 | N | A | -0.6299 | |
| 418 | L | A | 1.0969 | |
| 419 | P | A | 1.0383 | |
| 420 | I | A | 1.9022 | |
| 421 | Q | A | 0.1084 | |
| 422 | T | A | 0.3767 | |
| 423 | Y | A | 1.3677 | |
| 424 | S | A | 0.7435 | |
| 425 | A | A | 0.6774 | |
| 426 | L | A | 1.2314 | |
| 427 | N | A | -0.1617 | |
| 428 | F | A | 0.2208 | |
| 429 | R | A | -1.9257 | |
| 430 | E | A | -2.4055 | |
| 431 | T | A | -1.5651 | |
| 432 | S | A | -1.5195 | |
| 433 | P | A | -1.7965 | |
| 434 | E | A | -3.1159 | |
| 435 | Q | A | -3.2301 | |
| 436 | R | A | -3.4733 | |
| 437 | G | A | -2.3060 | |
| 438 | S | A | -1.6097 | |
| 439 | E | A | -1.7196 | |
| 440 | V | A | 0.2030 | |
| 441 | H | A | -0.5044 | |
| 442 | T | A | -1.0009 | |
| 443 | K | A | -2.2174 | |
| 444 | K | A | -2.5596 | |
| 445 | T | A | -1.6559 | |
| 446 | V | A | -0.6588 | |
| 447 | M | A | -0.0272 | |
| 448 | I | A | 0.0372 | |
| 449 | K | A | -1.5809 | |
| 450 | T | A | -0.9617 | |
| 451 | I | A | -0.3563 | |
| 452 | E | A | -1.3862 | |
| 453 | T | A | -1.7208 | |
| 454 | R | A | -2.9944 | |
| 455 | D | A | -3.1207 | |
| 456 | G | A | -2.4213 | |
| 457 | E | A | -2.1792 | |
| 458 | V | A | -0.0497 | |
| 459 | V | A | -0.3121 | |
| 460 | S | A | -0.7411 | |
| 461 | E | A | -1.6133 | |
| 462 | A | A | -1.3417 | |
| 463 | T | A | -1.2588 | |
| 464 | Q | A | -1.3651 | |
| 465 | Q | A | -1.9347 | |
| 466 | Q | A | -2.1125 | |
| 467 | H | A | -2.4704 | |
| 468 | E | A | -2.0714 | |
| 469 | V | A | 0.3513 | |
| 470 | L | A | 0.9975 |
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