| Chain sequence(s) |
A: MAGRGGSALLALCGALAACGWLLGAEAQEPGAPAAGMRRRRRLQQEDGISFEYHRYPELREALVSVWLQCTAISRIYTVGRSFEGRELLVIELSDNPGVHEPGEPEFKYIGNMHGNEAVGRELLIFLAQYLCNEYQKGNETIVNLIHSTRIHIMPSLNPDGFEKAASQPGELKDWFVGRSNAQGIDLNRNFPDLDRIVYVNEKEGGPNNHLLKNMKKIVDQNTKLAPETKAVIHWIMDIPFVLSANLHGGDLVANYPYDETRSGSAHEYSSSPDDAIFQSLARAYSSFNPAMSDPNRPPCRKNDDDSSFVDGTTNGGAWYSVPGGMQDFNYLSSNCFEITVELSCEKFPPEETLKTYWEDNKNSLISYLEQIHRGVKGFVRDLQGNPIANATISVEGIDHDVTSAKDGDYWRLLIPGNYKLTASAPGYLAITKKVAVPYSPAAGVDFELESFSERKEEEKEELMEWWKMMSETLNF
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 (00:00:00)
[INFO] Analysis: Starting Aggrescan3D on folded.pdb (00:05:21)
[INFO] Main: Simulation completed successfully. (00:05:24)
|
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 | 0.9750 | |
| 2 | A | A | -0.1006 | |
| 3 | G | A | -1.1590 | |
| 4 | R | A | -2.4224 | |
| 5 | G | A | -1.8807 | |
| 6 | G | A | -1.2651 | |
| 7 | S | A | -0.1679 | |
| 8 | A | A | 0.9211 | |
| 9 | L | A | 2.2896 | |
| 10 | L | A | 2.6736 | |
| 11 | A | A | 2.0382 | |
| 12 | L | A | 2.1594 | |
| 13 | C | A | 1.2217 | |
| 14 | G | A | 0.6573 | |
| 15 | A | A | 0.7503 | |
| 16 | L | A | 1.5251 | |
| 17 | A | A | 1.0989 | |
| 18 | A | A | 0.6566 | |
| 19 | C | A | 0.7931 | |
| 20 | G | A | 0.8227 | |
| 21 | W | A | 2.2581 | |
| 22 | L | A | 2.7297 | |
| 23 | L | A | 2.3282 | |
| 24 | G | A | 0.2781 | |
| 25 | A | A | -0.6794 | |
| 26 | E | A | -2.1230 | |
| 27 | A | A | -1.7830 | |
| 28 | Q | A | -2.5182 | |
| 29 | E | A | -2.6076 | |
| 30 | P | A | -1.6339 | |
| 31 | G | A | -1.0027 | |
| 32 | A | A | -0.3612 | |
| 33 | P | A | -0.3165 | |
| 34 | A | A | -0.1642 | |
| 35 | A | A | -0.1103 | |
| 36 | G | A | -0.6507 | |
| 37 | M | A | -0.7578 | |
| 38 | R | A | -3.1363 | |
| 39 | R | A | -4.3591 | |
| 40 | R | A | -4.4186 | |
| 41 | R | A | -4.2285 | |
| 42 | R | A | -3.5328 | |
| 43 | L | A | -1.5392 | |
| 44 | Q | A | -2.6923 | |
| 45 | Q | A | -3.1594 | |
| 46 | E | A | -3.2351 | |
| 47 | D | A | -2.6958 | |
| 48 | G | A | -2.1614 | |
| 49 | I | A | 0.0000 | |
| 50 | S | A | -1.3299 | |
| 51 | F | A | -1.2415 | |
| 52 | E | A | -2.1630 | |
| 53 | Y | A | -1.0793 | |
| 54 | H | A | -1.4043 | |
| 55 | R | A | -1.4642 | |
| 56 | Y | A | -1.1813 | |
| 57 | P | A | -1.6846 | |
| 58 | E | A | -2.4967 | |
| 59 | L | A | 0.0000 | |
| 60 | R | A | -1.8442 | |
| 61 | E | A | -2.4924 | |
| 62 | A | A | -1.1507 | |
| 63 | L | A | 0.0000 | |
| 64 | V | A | -0.0618 | |
| 65 | S | A | 0.0227 | |
| 66 | V | A | 0.0000 | |
| 67 | W | A | 0.7253 | |
| 68 | L | A | 1.4479 | |
| 69 | Q | A | 0.1956 | |
| 70 | C | A | 0.0000 | |
| 71 | T | A | 0.1906 | |
| 72 | A | A | -0.3931 | |
| 73 | I | A | 0.0000 | |
| 74 | S | A | 0.0000 | |
| 75 | R | A | -0.5289 | |
| 76 | I | A | 0.2046 | |
| 77 | Y | A | 0.2634 | |
| 78 | T | A | -0.0895 | |
| 79 | V | A | -0.1821 | |
| 80 | G | A | -0.8282 | |
| 81 | R | A | -1.9352 | |
| 82 | S | A | 0.0000 | |
| 83 | F | A | 0.3533 | |
| 84 | E | A | -1.4977 | |
| 85 | G | A | -1.2990 | |
| 86 | R | A | -1.3206 | |
| 87 | E | A | -1.2135 | |
| 88 | L | A | 0.0000 | |
| 89 | L | A | 0.0000 | |
| 90 | V | A | 0.0000 | |
| 91 | I | A | 0.0000 | |
| 92 | E | A | 0.0000 | |
| 93 | L | A | 0.0000 | |
| 94 | S | A | 0.0000 | |
| 95 | D | A | -2.2318 | |
| 96 | N | A | -1.6023 | |
| 97 | P | A | -0.9568 | |
| 98 | G | A | -0.4225 | |
| 99 | V | A | 0.4354 | |
| 100 | H | A | -0.5728 | |
| 101 | E | A | -1.0976 | |
| 102 | P | A | -1.1793 | |
| 103 | G | A | -0.8083 | |
| 104 | E | A | -0.8842 | |
| 105 | P | A | 0.0000 | |
| 106 | E | A | 0.0000 | |
| 107 | F | A | 0.0000 | |
| 108 | K | A | 0.0000 | |
| 109 | Y | A | 0.0000 | |
| 110 | I | A | 0.0000 | |
| 111 | G | A | 0.0000 | |
| 112 | N | A | 0.0000 | |
| 113 | M | A | 0.0000 | |
| 114 | H | A | 0.0000 | |
| 115 | G | A | 0.0000 | |
| 116 | N | A | 0.0000 | |
| 117 | E | A | 0.0000 | |
| 118 | A | A | 0.0000 | |
| 119 | V | A | 0.0000 | |
| 120 | G | A | 0.0000 | |
| 121 | R | A | 0.0000 | |
| 122 | E | A | 0.0000 | |
| 123 | L | A | 0.0000 | |
| 124 | L | A | 0.0000 | |
| 125 | I | A | 0.0000 | |
| 126 | F | A | 0.0000 | |
| 127 | L | A | 0.0000 | |
| 128 | A | A | 0.0000 | |
| 129 | Q | A | -0.3988 | |
| 130 | Y | A | -0.4136 | |
| 131 | L | A | 0.0000 | |
| 132 | C | A | 0.0000 | |
| 133 | N | A | -1.4260 | |
| 134 | E | A | -1.6979 | |
| 135 | Y | A | -1.6242 | |
| 136 | Q | A | -2.2172 | |
| 137 | K | A | -2.8159 | |
| 138 | G | A | -2.3895 | |
| 139 | N | A | -2.2710 | |
| 140 | E | A | -2.5853 | |
| 141 | T | A | -1.6311 | |
| 142 | I | A | 0.0000 | |
| 143 | V | A | -1.9667 | |
| 144 | N | A | -2.2705 | |
| 145 | L | A | 0.0000 | |
| 146 | I | A | 0.0000 | |
| 147 | H | A | -2.0547 | |
| 148 | S | A | -1.4241 | |
| 149 | T | A | 0.0000 | |
| 150 | R | A | 0.0000 | |
| 151 | I | A | 0.0000 | |
| 152 | H | A | 0.0000 | |
| 153 | I | A | 0.0000 | |
| 154 | M | A | 0.0000 | |
| 155 | P | A | 0.0000 | |
| 156 | S | A | 0.0000 | |
| 157 | L | A | 0.0000 | |
| 158 | N | A | 0.0000 | |
| 159 | P | A | 0.0000 | |
| 160 | D | A | 0.0000 | |
| 161 | G | A | 0.0000 | |
| 162 | F | A | 0.0000 | |
| 163 | E | A | -1.1902 | |
| 164 | K | A | -1.9442 | |
| 165 | A | A | 0.0000 | |
| 166 | A | A | -0.8479 | |
| 167 | S | A | -1.0493 | |
| 168 | Q | A | -1.1267 | |
| 169 | P | A | -0.9708 | |
| 170 | G | A | -1.4891 | |
| 171 | E | A | -2.0834 | |
| 172 | L | A | -0.2326 | |
| 173 | K | A | -0.6946 | |
| 174 | D | A | -0.3527 | |
| 175 | W | A | 1.2337 | |
| 176 | F | A | 2.2739 | |
| 177 | V | A | 0.8221 | |
| 178 | G | A | 0.0000 | |
| 179 | R | A | 0.0546 | |
| 180 | S | A | -0.3860 | |
| 181 | N | A | 0.0000 | |
| 182 | A | A | -0.5860 | |
| 183 | Q | A | -0.5746 | |
| 184 | G | A | -0.6902 | |
| 185 | I | A | -0.5419 | |
| 186 | D | A | -0.7388 | |
| 187 | L | A | 0.0000 | |
| 188 | N | A | 0.0000 | |
| 189 | R | A | -1.1486 | |
| 190 | N | A | -1.0109 | |
| 191 | F | A | 0.0000 | |
| 192 | P | A | -0.4810 | |
| 193 | D | A | -1.1351 | |
| 194 | L | A | 0.0000 | |
| 195 | D | A | 0.0000 | |
| 196 | R | A | -0.6177 | |
| 197 | I | A | 0.4583 | |
| 198 | V | A | 0.0000 | |
| 199 | Y | A | 0.0000 | |
| 200 | V | A | -0.1967 | |
| 201 | N | A | -1.3247 | |
| 202 | E | A | -2.0416 | |
| 203 | K | A | -2.6546 | |
| 204 | E | A | -2.8014 | |
| 205 | G | A | -2.1095 | |
| 206 | G | A | -1.3806 | |
| 207 | P | A | -0.9522 | |
| 208 | N | A | -1.1278 | |
| 209 | N | A | -0.7853 | |
| 210 | H | A | -0.9272 | |
| 211 | L | A | -0.4860 | |
| 212 | L | A | -0.6827 | |
| 213 | K | A | -2.2958 | |
| 214 | N | A | -2.3622 | |
| 215 | M | A | 0.0000 | |
| 216 | K | A | -2.2585 | |
| 217 | K | A | -2.7681 | |
| 218 | I | A | -1.1915 | |
| 219 | V | A | 0.0000 | |
| 220 | D | A | -2.5462 | |
| 221 | Q | A | -2.2902 | |
| 222 | N | A | -1.7708 | |
| 223 | T | A | -1.4009 | |
| 224 | K | A | -2.0256 | |
| 225 | L | A | -1.2655 | |
| 226 | A | A | 0.0000 | |
| 227 | P | A | -0.6560 | |
| 228 | E | A | 0.0000 | |
| 229 | T | A | 0.0000 | |
| 230 | K | A | -1.0490 | |
| 231 | A | A | 0.0000 | |
| 232 | V | A | 0.0000 | |
| 233 | I | A | 0.0000 | |
| 234 | H | A | -1.0677 | |
| 235 | W | A | 0.0000 | |
| 236 | I | A | 0.0000 | |
| 237 | M | A | -0.8459 | |
| 238 | D | A | -1.6673 | |
| 239 | I | A | -0.8014 | |
| 240 | P | A | -0.5767 | |
| 241 | F | A | 0.0000 | |
| 242 | V | A | 0.0000 | |
| 243 | L | A | 0.0000 | |
| 244 | S | A | 0.0000 | |
| 245 | A | A | 0.0000 | |
| 246 | N | A | 0.0000 | |
| 247 | L | A | 0.0000 | |
| 248 | H | A | 0.0000 | |
| 249 | G | A | 0.0000 | |
| 250 | G | A | -0.4655 | |
| 251 | D | A | 0.0000 | |
| 252 | L | A | -0.0310 | |
| 253 | V | A | 0.0000 | |
| 254 | A | A | 0.0000 | |
| 255 | N | A | 0.0000 | |
| 256 | Y | A | 0.0000 | |
| 257 | P | A | 0.0000 | |
| 258 | Y | A | 0.0000 | |
| 259 | D | A | 0.0000 | |
| 260 | E | A | 0.0000 | |
| 261 | T | A | 0.0000 | |
| 262 | R | A | -0.9111 | |
| 263 | S | A | -0.9575 | |
| 264 | G | A | -1.1359 | |
| 265 | S | A | -0.8480 | |
| 266 | A | A | -0.5139 | |
| 267 | H | A | -0.9446 | |
| 268 | E | A | -0.6520 | |
| 269 | Y | A | 0.5126 | |
| 270 | S | A | 0.0000 | |
| 271 | S | A | -0.0081 | |
| 272 | S | A | 0.0000 | |
| 273 | P | A | -0.7895 | |
| 274 | D | A | 0.0000 | |
| 275 | D | A | -0.3422 | |
| 276 | A | A | -0.1739 | |
| 277 | I | A | 0.0000 | |
| 278 | F | A | 0.0000 | |
| 279 | Q | A | -0.9915 | |
| 280 | S | A | -0.8084 | |
| 281 | L | A | 0.0000 | |
| 282 | A | A | 0.0000 | |
| 283 | R | A | -1.7069 | |
| 284 | A | A | 0.0000 | |
| 285 | Y | A | 0.0000 | |
| 286 | S | A | 0.0000 | |
| 287 | S | A | -0.5478 | |
| 288 | F | A | 0.7439 | |
| 289 | N | A | 0.0000 | |
| 290 | P | A | -0.4832 | |
| 291 | A | A | -0.5508 | |
| 292 | M | A | 0.0000 | |
| 293 | S | A | -1.0485 | |
| 294 | D | A | -1.7674 | |
| 295 | P | A | -1.4449 | |
| 296 | N | A | -1.8831 | |
| 297 | R | A | -1.3646 | |
| 298 | P | A | -1.4091 | |
| 299 | P | A | -2.0335 | |
| 300 | C | A | -1.6874 | |
| 301 | R | A | -2.9200 | |
| 302 | K | A | -3.3630 | |
| 303 | N | A | -3.3687 | |
| 304 | D | A | -3.4281 | |
| 305 | D | A | -3.0107 | |
| 306 | D | A | -1.4418 | |
| 307 | S | A | -0.6798 | |
| 308 | S | A | 0.0739 | |
| 309 | F | A | 0.3361 | |
| 310 | V | A | 0.7388 | |
| 311 | D | A | -1.2497 | |
| 312 | G | A | -0.7968 | |
| 313 | T | A | 0.0000 | |
| 314 | T | A | 0.0000 | |
| 315 | N | A | 0.0000 | |
| 316 | G | A | 0.0000 | |
| 317 | G | A | 0.0000 | |
| 318 | A | A | 0.0737 | |
| 319 | W | A | -0.1275 | |
| 320 | Y | A | 0.1756 | |
| 321 | S | A | -0.1708 | |
| 322 | V | A | 0.0000 | |
| 323 | P | A | -0.8487 | |
| 324 | G | A | -1.0164 | |
| 325 | G | A | 0.0000 | |
| 326 | M | A | 0.0000 | |
| 327 | Q | A | 0.0000 | |
| 328 | D | A | 0.0000 | |
| 329 | F | A | 0.0000 | |
| 330 | N | A | 0.0000 | |
| 331 | Y | A | 0.0000 | |
| 332 | L | A | 0.0000 | |
| 333 | S | A | 0.0000 | |
| 334 | S | A | 0.0000 | |
| 335 | N | A | -0.2630 | |
| 336 | C | A | 0.0000 | |
| 337 | F | A | 0.0000 | |
| 338 | E | A | 0.0000 | |
| 339 | I | A | 0.0000 | |
| 340 | T | A | 0.0000 | |
| 341 | V | A | 0.0000 | |
| 342 | E | A | 0.0000 | |
| 343 | L | A | 0.0000 | |
| 344 | S | A | 0.0000 | |
| 345 | C | A | -0.6867 | |
| 346 | E | A | -1.6305 | |
| 347 | K | A | -0.7941 | |
| 348 | F | A | -0.7994 | |
| 349 | P | A | 0.0000 | |
| 350 | P | A | -1.9054 | |
| 351 | E | A | -2.5814 | |
| 352 | E | A | -2.7723 | |
| 353 | T | A | -1.6115 | |
| 354 | L | A | 0.0000 | |
| 355 | K | A | -1.8007 | |
| 356 | T | A | -1.3587 | |
| 357 | Y | A | -1.0297 | |
| 358 | W | A | 0.0000 | |
| 359 | E | A | -2.5050 | |
| 360 | D | A | -1.4875 | |
| 361 | N | A | 0.0000 | |
| 362 | K | A | -1.3257 | |
| 363 | N | A | -0.9732 | |
| 364 | S | A | 0.0000 | |
| 365 | L | A | 0.0000 | |
| 366 | I | A | -0.3787 | |
| 367 | S | A | -0.5599 | |
| 368 | Y | A | 0.0000 | |
| 369 | L | A | 0.0000 | |
| 370 | E | A | -1.3463 | |
| 371 | Q | A | -0.6502 | |
| 372 | I | A | 0.0000 | |
| 373 | H | A | -0.6443 | |
| 374 | R | A | 0.0000 | |
| 375 | G | A | 0.0000 | |
| 376 | V | A | 0.0000 | |
| 377 | K | A | -1.1973 | |
| 378 | G | A | -1.1571 | |
| 379 | F | A | -1.4230 | |
| 380 | V | A | 0.0000 | |
| 381 | R | A | -2.2619 | |
| 382 | D | A | -1.5690 | |
| 383 | L | A | -0.8664 | |
| 384 | Q | A | -1.7223 | |
| 385 | G | A | -1.7257 | |
| 386 | N | A | -2.2424 | |
| 387 | P | A | -2.1363 | |
| 388 | I | A | 0.0000 | |
| 389 | A | A | -1.7807 | |
| 390 | N | A | -1.8064 | |
| 391 | A | A | 0.0000 | |
| 392 | T | A | -0.4887 | |
| 393 | I | A | 0.0000 | |
| 394 | S | A | -1.0271 | |
| 395 | V | A | 0.0000 | |
| 396 | E | A | -2.6484 | |
| 397 | G | A | -1.7377 | |
| 398 | I | A | -1.4571 | |
| 399 | D | A | -2.3509 | |
| 400 | H | A | 0.0000 | |
| 401 | D | A | -1.0140 | |
| 402 | V | A | 0.0000 | |
| 403 | T | A | -0.8142 | |
| 404 | S | A | 0.0000 | |
| 405 | A | A | -1.5667 | |
| 406 | K | A | -2.6157 | |
| 407 | D | A | -2.6617 | |
| 408 | G | A | 0.0000 | |
| 409 | D | A | 0.0000 | |
| 410 | Y | A | 0.0000 | |
| 411 | W | A | 0.0000 | |
| 412 | R | A | 0.0000 | |
| 413 | L | A | 0.0000 | |
| 414 | L | A | 0.0000 | |
| 415 | I | A | 0.3265 | |
| 416 | P | A | 0.0672 | |
| 417 | G | A | -0.5562 | |
| 418 | N | A | -1.6762 | |
| 419 | Y | A | -1.8573 | |
| 420 | K | A | -2.3785 | |
| 421 | L | A | 0.0000 | |
| 422 | T | A | -0.8748 | |
| 423 | A | A | 0.0000 | |
| 424 | S | A | -0.3017 | |
| 425 | A | A | 0.0000 | |
| 426 | P | A | -0.2688 | |
| 427 | G | A | 0.1365 | |
| 428 | Y | A | 0.2162 | |
| 429 | L | A | 0.4180 | |
| 430 | A | A | 0.1062 | |
| 431 | I | A | -0.1085 | |
| 432 | T | A | -1.0532 | |
| 433 | K | A | -1.9869 | |
| 434 | K | A | -2.6726 | |
| 435 | V | A | -1.3885 | |
| 436 | A | A | -0.8795 | |
| 437 | V | A | 0.0000 | |
| 438 | P | A | 0.2287 | |
| 439 | Y | A | 1.0792 | |
| 440 | S | A | 0.0802 | |
| 441 | P | A | -0.4098 | |
| 442 | A | A | -0.3452 | |
| 443 | A | A | -0.5258 | |
| 444 | G | A | -1.0880 | |
| 445 | V | A | 0.0000 | |
| 446 | D | A | -2.5029 | |
| 447 | F | A | 0.0000 | |
| 448 | E | A | -2.4765 | |
| 449 | L | A | 0.0000 | |
| 450 | E | A | -0.4911 | |
| 451 | S | A | -0.1079 | |
| 452 | F | A | -0.0054 | |
| 453 | S | A | -1.3290 | |
| 454 | E | A | -2.5594 | |
| 455 | R | A | -3.6395 | |
| 456 | K | A | -5.0351 | |
| 457 | E | A | -5.6486 | |
| 458 | E | A | -5.9153 | |
| 459 | E | A | -6.0738 | |
| 460 | K | A | -5.5643 | |
| 461 | E | A | -5.2131 | |
| 462 | E | A | -4.6020 | |
| 463 | L | A | -2.0595 | |
| 464 | M | A | -1.3364 | |
| 465 | E | A | -2.2572 | |
| 466 | W | A | -0.2950 | |
| 467 | W | A | 0.1681 | |
| 468 | K | A | -1.1959 | |
| 469 | M | A | 0.0758 | |
| 470 | M | A | 0.1718 | |
| 471 | S | A | -0.5241 | |
| 472 | E | A | -1.2658 | |
| 473 | T | A | 0.1139 | |
| 474 | L | A | 0.9588 | |
| 475 | N | A | -0.1986 | |
| 476 | F | A | 1.4289 |
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