| Chain sequence(s) |
A: TRCTHLQNRDFVSGTQGTTRVSLVLELGGCVTLTAEGKPSVDVWLDDIHQENPAKTREYCLHAKLANSKVAARCPAMGPATLPEEHQASTVCRRDQSDRGWGNHCGLFGKGSIVACAKFSCEAKKKATGYVYDVNKITYVVKVEPHTGDYLAANESHSNRKTASFTTQSEKTILTLGDYGDISLTCRVTSGVDPAQTVVLELDKTAEHLPKAWQVHRDWFEDLSLPWRHGGAQEWNHADRLVEFGEPHAVKMDIFNLGDQTGILLKSLAGVPVANIEGSKYHLQSGHVTCDVGLEKLKMKGMTYTVCEGSKFAWKRPPTDSGHDTVVMEVTYTGSKPCRIPVRAVAHGEPNVNVASLITPNPSMETTGGGFVELQLPPGDNIIYVGELSHQWFQKGSTIGRVLEKTRRGIERLTVVGEHAWDFGSVGGMLSSVGKALHTAFGAAFNTIFGGVGFLPRILLGVALAWLGLNSRNPTLSVGFLITGGLVLTMTLGVGA
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 (00:08:11)
[INFO] Main: Simulation completed successfully. (00:08:15)
|
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 | T | A | 0.0000 | |
| 2 | R | A | -0.8236 | |
| 3 | C | A | 0.0000 | |
| 4 | T | A | -0.6673 | |
| 5 | H | A | -1.0794 | |
| 6 | L | A | -1.1212 | |
| 7 | Q | A | -1.9772 | |
| 8 | N | A | -2.0083 | |
| 9 | R | A | 0.0000 | |
| 10 | D | A | -0.7969 | |
| 11 | F | A | 0.2929 | |
| 12 | V | A | 0.0000 | |
| 13 | S | A | -0.5711 | |
| 14 | G | A | -0.9909 | |
| 15 | T | A | -1.1617 | |
| 16 | Q | A | -2.0776 | |
| 17 | G | A | -1.8892 | |
| 18 | T | A | -1.4384 | |
| 19 | T | A | -1.8881 | |
| 20 | R | A | -2.0738 | |
| 21 | V | A | 0.0000 | |
| 22 | S | A | -0.1992 | |
| 23 | L | A | 0.0000 | |
| 24 | V | A | 0.0000 | |
| 25 | L | A | 0.0000 | |
| 26 | E | A | -0.5405 | |
| 27 | L | A | -0.7461 | |
| 28 | G | A | -1.1742 | |
| 29 | G | A | 0.0000 | |
| 30 | C | A | 0.0000 | |
| 31 | V | A | 0.0000 | |
| 32 | T | A | 0.0000 | |
| 33 | L | A | 0.0000 | |
| 34 | T | A | -0.4569 | |
| 35 | A | A | -1.5214 | |
| 36 | E | A | -2.6113 | |
| 37 | G | A | -1.9003 | |
| 38 | K | A | -2.0734 | |
| 39 | P | A | 0.0000 | |
| 40 | S | A | 0.0000 | |
| 41 | V | A | 0.0000 | |
| 42 | D | A | 0.0000 | |
| 43 | V | A | 0.0000 | |
| 44 | W | A | 0.0000 | |
| 45 | L | A | 0.0000 | |
| 46 | D | A | -1.0439 | |
| 47 | D | A | -0.9200 | |
| 48 | I | A | 0.0000 | |
| 49 | H | A | -1.5050 | |
| 50 | Q | A | 0.0000 | |
| 51 | E | A | -3.3640 | |
| 52 | N | A | -2.7051 | |
| 53 | P | A | 0.0000 | |
| 54 | A | A | -0.8642 | |
| 55 | K | A | -1.2457 | |
| 56 | T | A | -0.8663 | |
| 57 | R | A | 0.0000 | |
| 58 | E | A | 0.0000 | |
| 59 | Y | A | 0.0000 | |
| 60 | C | A | 0.0000 | |
| 61 | L | A | 0.0000 | |
| 62 | H | A | -1.4433 | |
| 63 | A | A | 0.0000 | |
| 64 | K | A | -1.8995 | |
| 65 | L | A | -0.9857 | |
| 66 | A | A | -1.2767 | |
| 67 | N | A | -1.7770 | |
| 68 | S | A | -1.3268 | |
| 69 | K | A | -1.4371 | |
| 70 | V | A | -0.2142 | |
| 71 | A | A | -0.3131 | |
| 72 | A | A | -0.6733 | |
| 73 | R | A | -1.4986 | |
| 74 | C | A | -0.5921 | |
| 75 | P | A | 0.0000 | |
| 76 | A | A | 0.2232 | |
| 77 | M | A | 0.4042 | |
| 78 | G | A | -0.3160 | |
| 79 | P | A | -1.0001 | |
| 80 | A | A | 0.0000 | |
| 81 | T | A | -0.6451 | |
| 82 | L | A | 0.0000 | |
| 83 | P | A | -1.0318 | |
| 84 | E | A | -1.5629 | |
| 85 | E | A | -1.4049 | |
| 86 | H | A | -1.7315 | |
| 87 | Q | A | -1.7589 | |
| 88 | A | A | -1.2848 | |
| 89 | S | A | -1.2825 | |
| 90 | T | A | -1.2614 | |
| 91 | V | A | 0.0000 | |
| 92 | C | A | -0.8980 | |
| 93 | R | A | -1.5565 | |
| 94 | R | A | -2.3071 | |
| 95 | D | A | -2.6967 | |
| 96 | Q | A | -3.1983 | |
| 97 | S | A | 0.0000 | |
| 98 | D | A | -2.4238 | |
| 99 | R | A | 0.0000 | |
| 100 | G | A | 0.0000 | |
| 101 | W | A | 0.9453 | |
| 102 | G | A | -0.2432 | |
| 103 | N | A | -0.5055 | |
| 104 | H | A | -0.8628 | |
| 105 | C | A | 0.0000 | |
| 106 | G | A | 0.4726 | |
| 107 | L | A | 1.7640 | |
| 108 | F | A | 1.7606 | |
| 109 | G | A | -0.4735 | |
| 110 | K | A | -2.5357 | |
| 111 | G | A | 0.0000 | |
| 112 | S | A | -1.9422 | |
| 113 | I | A | 0.0000 | |
| 114 | V | A | 0.0000 | |
| 115 | A | A | 0.0000 | |
| 116 | C | A | 0.0000 | |
| 117 | A | A | 0.0000 | |
| 118 | K | A | -1.6614 | |
| 119 | F | A | 0.0000 | |
| 120 | S | A | -1.1855 | |
| 121 | C | A | -1.1486 | |
| 122 | E | A | -1.9397 | |
| 123 | A | A | -1.5337 | |
| 124 | K | A | -2.5407 | |
| 125 | K | A | -1.9812 | |
| 126 | K | A | -1.3872 | |
| 127 | A | A | 0.0000 | |
| 128 | T | A | -0.5614 | |
| 129 | G | A | 0.0000 | |
| 130 | Y | A | -0.2682 | |
| 131 | V | A | -0.0807 | |
| 132 | Y | A | 0.0000 | |
| 133 | D | A | -1.3135 | |
| 134 | V | A | -0.7820 | |
| 135 | N | A | -2.1668 | |
| 136 | K | A | -2.9162 | |
| 137 | I | A | 0.0000 | |
| 138 | T | A | -0.9856 | |
| 139 | Y | A | 0.0000 | |
| 140 | V | A | -0.3350 | |
| 141 | V | A | 0.0000 | |
| 142 | K | A | -0.8434 | |
| 143 | V | A | 0.0000 | |
| 144 | E | A | 0.0000 | |
| 145 | P | A | 0.0000 | |
| 146 | H | A | 0.0000 | |
| 147 | T | A | -0.4284 | |
| 148 | G | A | 0.0000 | |
| 149 | D | A | -0.1789 | |
| 150 | Y | A | 0.3370 | |
| 151 | L | A | -0.3079 | |
| 152 | A | A | -0.7414 | |
| 153 | A | A | -1.0294 | |
| 154 | N | A | -1.9624 | |
| 155 | E | A | -1.8679 | |
| 156 | S | A | -1.2977 | |
| 157 | H | A | -0.9930 | |
| 158 | S | A | -0.8051 | |
| 159 | N | A | -1.0443 | |
| 160 | R | A | -1.0116 | |
| 161 | K | A | -0.9079 | |
| 162 | T | A | -0.6316 | |
| 163 | A | A | 0.0000 | |
| 164 | S | A | -0.2537 | |
| 165 | F | A | 0.0000 | |
| 166 | T | A | -1.4852 | |
| 167 | T | A | -1.6726 | |
| 168 | Q | A | -2.2396 | |
| 169 | S | A | -2.0835 | |
| 170 | E | A | -2.9780 | |
| 171 | K | A | -2.3886 | |
| 172 | T | A | -0.7314 | |
| 173 | I | A | 0.5774 | |
| 174 | L | A | 0.2987 | |
| 175 | T | A | -0.6203 | |
| 176 | L | A | 0.0000 | |
| 177 | G | A | -1.7296 | |
| 178 | D | A | -2.5113 | |
| 179 | Y | A | 0.0000 | |
| 180 | G | A | -2.2233 | |
| 181 | D | A | -1.5189 | |
| 182 | I | A | 0.0000 | |
| 183 | S | A | -0.7963 | |
| 184 | L | A | 0.0000 | |
| 185 | T | A | -1.3793 | |
| 186 | C | A | 0.0000 | |
| 187 | R | A | -1.3552 | |
| 188 | V | A | 0.0000 | |
| 189 | T | A | -0.5126 | |
| 190 | S | A | -0.5024 | |
| 191 | G | A | 0.0000 | |
| 192 | V | A | -0.3384 | |
| 193 | D | A | -1.3232 | |
| 194 | P | A | 0.0000 | |
| 195 | A | A | -0.8942 | |
| 196 | Q | A | -1.9845 | |
| 197 | T | A | -1.2959 | |
| 198 | V | A | 0.0000 | |
| 199 | V | A | 0.0000 | |
| 200 | L | A | 0.0000 | |
| 201 | E | A | -0.6869 | |
| 202 | L | A | 0.0000 | |
| 203 | D | A | -2.0955 | |
| 204 | K | A | -2.9082 | |
| 205 | T | A | -1.8054 | |
| 206 | A | A | -1.6755 | |
| 207 | E | A | -2.5951 | |
| 208 | H | A | -1.9252 | |
| 209 | L | A | -0.9870 | |
| 210 | P | A | -0.8694 | |
| 211 | K | A | -1.5522 | |
| 212 | A | A | 0.0000 | |
| 213 | W | A | 0.0000 | |
| 214 | Q | A | -0.4980 | |
| 215 | V | A | 0.0000 | |
| 216 | H | A | -1.9669 | |
| 217 | R | A | -2.8740 | |
| 218 | D | A | -3.2806 | |
| 219 | W | A | -2.0220 | |
| 220 | F | A | 0.0000 | |
| 221 | E | A | -2.6711 | |
| 222 | D | A | -2.7098 | |
| 223 | L | A | -1.1487 | |
| 224 | S | A | -0.9341 | |
| 225 | L | A | -0.9435 | |
| 226 | P | A | 0.0000 | |
| 227 | W | A | -0.9294 | |
| 228 | R | A | -1.5568 | |
| 229 | H | A | -1.8839 | |
| 230 | G | A | -1.4427 | |
| 231 | G | A | -1.4341 | |
| 232 | A | A | -1.6086 | |
| 233 | Q | A | -2.1086 | |
| 234 | E | A | -2.0684 | |
| 235 | W | A | -1.4544 | |
| 236 | N | A | -1.7299 | |
| 237 | H | A | -1.6383 | |
| 238 | A | A | -1.5244 | |
| 239 | D | A | -2.3510 | |
| 240 | R | A | -2.0961 | |
| 241 | L | A | 0.0000 | |
| 242 | V | A | 0.0000 | |
| 243 | E | A | -1.6980 | |
| 244 | F | A | 0.0000 | |
| 245 | G | A | -1.7052 | |
| 246 | E | A | -2.9316 | |
| 247 | P | A | -2.6594 | |
| 248 | H | A | -2.2923 | |
| 249 | A | A | -1.7362 | |
| 250 | V | A | -0.1072 | |
| 251 | K | A | -1.6844 | |
| 252 | M | A | 0.0000 | |
| 253 | D | A | -1.7379 | |
| 254 | I | A | -0.4429 | |
| 255 | F | A | 0.6213 | |
| 256 | N | A | -0.3451 | |
| 257 | L | A | 0.4831 | |
| 258 | G | A | -0.3066 | |
| 259 | D | A | -0.8966 | |
| 260 | Q | A | 0.0781 | |
| 261 | T | A | 0.0000 | |
| 262 | G | A | 0.1977 | |
| 263 | I | A | 1.1857 | |
| 264 | L | A | 0.0000 | |
| 265 | L | A | 0.0752 | |
| 266 | K | A | -1.0193 | |
| 267 | S | A | -0.3967 | |
| 268 | L | A | 0.0000 | |
| 269 | A | A | -0.5220 | |
| 270 | G | A | -0.4140 | |
| 271 | V | A | 0.2050 | |
| 272 | P | A | -0.0694 | |
| 273 | V | A | 0.2684 | |
| 274 | A | A | 0.0000 | |
| 275 | N | A | -1.2555 | |
| 276 | I | A | -1.5537 | |
| 277 | E | A | -2.5563 | |
| 278 | G | A | -2.0087 | |
| 279 | S | A | -2.1005 | |
| 280 | K | A | -2.5964 | |
| 281 | Y | A | 0.0000 | |
| 282 | H | A | 0.0000 | |
| 283 | L | A | 0.0000 | |
| 284 | Q | A | -1.2366 | |
| 285 | S | A | -0.7928 | |
| 286 | G | A | -0.3650 | |
| 287 | H | A | -0.1193 | |
| 288 | V | A | 0.0000 | |
| 289 | T | A | 0.0000 | |
| 290 | C | A | 0.0000 | |
| 291 | D | A | -0.9772 | |
| 292 | V | A | 0.0000 | |
| 293 | G | A | 0.0000 | |
| 294 | L | A | 0.0000 | |
| 295 | E | A | -3.4149 | |
| 296 | K | A | -3.1880 | |
| 297 | L | A | 0.0000 | |
| 298 | K | A | -2.9141 | |
| 299 | M | A | -1.1387 | |
| 300 | K | A | -0.9817 | |
| 301 | G | A | -0.2195 | |
| 302 | M | A | 0.8234 | |
| 303 | T | A | 0.6264 | |
| 304 | Y | A | 0.6133 | |
| 305 | T | A | 0.5471 | |
| 306 | V | A | 1.1156 | |
| 307 | C | A | 0.0000 | |
| 308 | E | A | -2.2037 | |
| 309 | G | A | -1.7475 | |
| 310 | S | A | -1.8486 | |
| 311 | K | A | -2.0402 | |
| 312 | F | A | 0.0000 | |
| 313 | A | A | -0.8710 | |
| 314 | W | A | -0.8776 | |
| 315 | K | A | -1.9672 | |
| 316 | R | A | -1.5168 | |
| 317 | P | A | -0.8794 | |
| 318 | P | A | 0.0000 | |
| 319 | T | A | -0.5764 | |
| 320 | D | A | -1.1981 | |
| 321 | S | A | -0.9309 | |
| 322 | G | A | -1.1236 | |
| 323 | H | A | -1.0815 | |
| 324 | D | A | -1.1894 | |
| 325 | T | A | 0.0000 | |
| 326 | V | A | 0.0000 | |
| 327 | V | A | -0.1810 | |
| 328 | M | A | 0.0000 | |
| 329 | E | A | 0.0000 | |
| 330 | V | A | 0.0000 | |
| 331 | T | A | -0.7768 | |
| 332 | Y | A | 0.0000 | |
| 333 | T | A | -0.8255 | |
| 334 | G | A | -1.1207 | |
| 335 | S | A | -1.0395 | |
| 336 | K | A | -0.8467 | |
| 337 | P | A | -0.6060 | |
| 338 | C | A | 0.0000 | |
| 339 | R | A | -0.0849 | |
| 340 | I | A | 0.0000 | |
| 341 | P | A | -0.4670 | |
| 342 | V | A | -0.6870 | |
| 343 | R | A | -1.0342 | |
| 344 | A | A | 0.0000 | |
| 345 | V | A | 0.0000 | |
| 346 | A | A | -1.3469 | |
| 347 | H | A | -2.0768 | |
| 348 | G | A | -1.9661 | |
| 349 | E | A | -2.4616 | |
| 350 | P | A | -1.8091 | |
| 351 | N | A | -1.7507 | |
| 352 | V | A | -0.9649 | |
| 353 | N | A | -1.5250 | |
| 354 | V | A | -0.5667 | |
| 355 | A | A | -0.3178 | |
| 356 | S | A | -0.2572 | |
| 357 | L | A | 0.2543 | |
| 358 | I | A | 0.0000 | |
| 359 | T | A | 0.0000 | |
| 360 | P | A | -0.3501 | |
| 361 | N | A | -0.1145 | |
| 362 | P | A | 0.0000 | |
| 363 | S | A | 0.0000 | |
| 364 | M | A | 0.0000 | |
| 365 | E | A | -0.8510 | |
| 366 | T | A | -0.6082 | |
| 367 | T | A | -0.5248 | |
| 368 | G | A | -0.5355 | |
| 369 | G | A | -0.4420 | |
| 370 | G | A | 0.0000 | |
| 371 | F | A | 0.0000 | |
| 372 | V | A | 0.0000 | |
| 373 | E | A | 0.0000 | |
| 374 | L | A | 0.0000 | |
| 375 | Q | A | -0.1845 | |
| 376 | L | A | 0.0000 | |
| 377 | P | A | -0.4523 | |
| 378 | P | A | -0.6239 | |
| 379 | G | A | -0.8078 | |
| 380 | D | A | -1.2780 | |
| 381 | N | A | 0.0000 | |
| 382 | I | A | -0.4270 | |
| 383 | I | A | 0.0000 | |
| 384 | Y | A | -0.7625 | |
| 385 | V | A | 0.0000 | |
| 386 | G | A | -1.4139 | |
| 387 | E | A | -2.2128 | |
| 388 | L | A | -0.8573 | |
| 389 | S | A | -0.8500 | |
| 390 | H | A | -0.4995 | |
| 391 | Q | A | -0.9478 | |
| 392 | W | A | -0.1486 | |
| 393 | F | A | 0.7107 | |
| 394 | Q | A | 0.0000 | |
| 395 | K | A | -1.8068 | |
| 396 | G | A | -1.0611 | |
| 397 | S | A | 0.1176 | |
| 398 | T | A | 1.1446 | |
| 399 | I | A | 2.4414 | |
| 400 | G | A | 0.9511 | |
| 401 | R | A | 0.5640 | |
| 402 | V | A | 1.8980 | |
| 403 | L | A | 1.3799 | |
| 404 | E | A | -0.5679 | |
| 405 | K | A | -1.5939 | |
| 406 | T | A | -1.0284 | |
| 407 | R | A | -2.0439 | |
| 408 | R | A | -2.1741 | |
| 409 | G | A | -1.1616 | |
| 410 | I | A | -0.2874 | |
| 411 | E | A | -1.0198 | |
| 412 | R | A | -0.2180 | |
| 413 | L | A | 0.3402 | |
| 414 | T | A | 0.9435 | |
| 415 | V | A | 1.7979 | |
| 416 | V | A | 0.0000 | |
| 417 | G | A | -0.0576 | |
| 418 | E | A | -0.5183 | |
| 419 | H | A | -0.2331 | |
| 420 | A | A | 0.1483 | |
| 421 | W | A | 0.3070 | |
| 422 | D | A | 0.0000 | |
| 423 | F | A | 0.3618 | |
| 424 | G | A | 0.1521 | |
| 425 | S | A | 0.3147 | |
| 426 | V | A | 0.8009 | |
| 427 | G | A | 0.2242 | |
| 428 | G | A | 0.7927 | |
| 429 | M | A | 1.7196 | |
| 430 | L | A | 2.1524 | |
| 431 | S | A | 1.4461 | |
| 432 | S | A | 1.1141 | |
| 433 | V | A | 2.1211 | |
| 434 | G | A | 1.1946 | |
| 435 | K | A | 0.3448 | |
| 436 | A | A | 0.8544 | |
| 437 | L | A | 1.6556 | |
| 438 | H | A | 0.4537 | |
| 439 | T | A | 0.3069 | |
| 440 | A | A | 0.7680 | |
| 441 | F | A | 1.0192 | |
| 442 | G | A | 0.1863 | |
| 443 | A | A | 0.0325 | |
| 444 | A | A | 0.3747 | |
| 445 | F | A | 0.0000 | |
| 446 | N | A | -0.7585 | |
| 447 | T | A | 0.1805 | |
| 448 | I | A | 1.4467 | |
| 449 | F | A | 0.0000 | |
| 450 | G | A | -0.6418 | |
| 451 | G | A | -0.2581 | |
| 452 | V | A | 0.6699 | |
| 453 | G | A | 0.8592 | |
| 454 | F | A | 2.8363 | |
| 455 | L | A | 2.7001 | |
| 456 | P | A | 1.7106 | |
| 457 | R | A | 1.6854 | |
| 458 | I | A | 2.4738 | |
| 459 | L | A | 2.6516 | |
| 460 | L | A | 1.8374 | |
| 461 | G | A | 0.0000 | |
| 462 | V | A | 2.0059 | |
| 463 | A | A | 2.1485 | |
| 464 | L | A | 2.3912 | |
| 465 | A | A | 2.7655 | |
| 466 | W | A | 2.5917 | |
| 467 | L | A | 2.4582 | |
| 468 | G | A | 0.0000 | |
| 469 | L | A | 2.1184 | |
| 470 | N | A | -0.0562 | |
| 471 | S | A | -0.1433 | |
| 472 | R | A | -2.0428 | |
| 473 | N | A | -1.4006 | |
| 474 | P | A | -0.1177 | |
| 475 | T | A | 0.5198 | |
| 476 | L | A | 1.8296 | |
| 477 | S | A | 1.8803 | |
| 478 | V | A | 2.8556 | |
| 479 | G | A | 2.2459 | |
| 480 | F | A | 3.0635 | |
| 481 | L | A | 3.4737 | |
| 482 | I | A | 3.1077 | |
| 483 | T | A | 1.7579 | |
| 484 | G | A | 0.0000 | |
| 485 | G | A | 1.2377 | |
| 486 | L | A | 1.2889 | |
| 487 | V | A | 0.0000 | |
| 488 | L | A | 1.6135 | |
| 489 | T | A | 1.0022 | |
| 490 | M | A | 1.3050 | |
| 491 | T | A | 0.0000 | |
| 492 | L | A | 2.1845 | |
| 493 | G | A | 1.3076 | |
| 494 | V | A | 2.2481 | |
| 495 | G | A | 0.8906 | |
| 496 | A | A | 0.3872 |
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