| Chain sequence(s) |
A: MVQISNVWGFGLAIMASLAAAAPKDCPDGLCLRTRANLSPLEVSQELGPLISNASSIFGPSDSRWANATARYQQYAAPKFTVVVRVARESDVSVIIKYANRNSLPFYAVNRGHGLPISQAKFSGLEIDMQLLTGITIQSNGKSALFQGGTYDQQVMDTLWEEGYVTTTGSCGCVGMLGPALGGGHGRQQGFHGLISDNILKLNVVLADGTTATVSNTSHTDLFWAMKGAGHNFGVVTSFEMSIYPTQVHSWYYKNYVFTQDKLEDLFEQLNVLQGNGTQPVKMAAQYGIYMMDSTVSATEAIIWWTFGYAGSQSEAQQYLTPFDDLNPLSSTDGNVPFPEVPNVQGTGINNATCDKGLERIVGPAGLQVYNATAQRQIYDLFNRNVKSYPELAASAVVMEGYSVEAVRKVDSDSSAYPMRDDYLLMQTTVSYSPNSTLDNVAIDWVTENQKFWNEGQPTRKPTAYVNYASGRESLEAMYGYEPWRLERLRKLKAKYDPEGRFSYYNPIV
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 (00:00:01)
[INFO] Analysis: Starting Aggrescan3D on folded.pdb (00:04:53)
[INFO] Main: Simulation completed successfully. (00:04:57)
|
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 | 1.6438 | |
| 2 | V | A | 2.0646 | |
| 3 | Q | A | 0.9013 | |
| 4 | I | A | 1.5604 | |
| 5 | S | A | 0.3156 | |
| 6 | N | A | 0.3362 | |
| 7 | V | A | 1.7217 | |
| 8 | W | A | 1.9987 | |
| 9 | G | A | 1.3000 | |
| 10 | F | A | 2.1260 | |
| 11 | G | A | 1.3610 | |
| 12 | L | A | 2.4778 | |
| 13 | A | A | 2.1865 | |
| 14 | I | A | 2.9080 | |
| 15 | M | A | 2.4298 | |
| 16 | A | A | 1.4847 | |
| 17 | S | A | 1.1787 | |
| 18 | L | A | 1.6535 | |
| 19 | A | A | 0.8116 | |
| 20 | A | A | 0.5309 | |
| 21 | A | A | 0.0208 | |
| 22 | A | A | -0.7010 | |
| 23 | P | A | -1.1366 | |
| 24 | K | A | -2.5424 | |
| 25 | D | A | -2.7577 | |
| 26 | C | A | -1.2463 | |
| 27 | P | A | -1.5365 | |
| 28 | D | A | -1.8932 | |
| 29 | G | A | -0.7659 | |
| 30 | L | A | 0.3767 | |
| 31 | C | A | 0.3715 | |
| 32 | L | A | 0.7561 | |
| 33 | R | A | -1.1742 | |
| 34 | T | A | -1.0644 | |
| 35 | R | A | -1.2960 | |
| 36 | A | A | -1.1328 | |
| 37 | N | A | -1.5365 | |
| 38 | L | A | 0.0000 | |
| 39 | S | A | -0.4176 | |
| 40 | P | A | -0.0427 | |
| 41 | L | A | 0.5324 | |
| 42 | E | A | -1.1978 | |
| 43 | V | A | 0.0000 | |
| 44 | S | A | -0.5861 | |
| 45 | Q | A | -1.4584 | |
| 46 | E | A | -1.1385 | |
| 47 | L | A | 0.0000 | |
| 48 | G | A | -0.5991 | |
| 49 | P | A | -0.3682 | |
| 50 | L | A | 0.6925 | |
| 51 | I | A | 0.0478 | |
| 52 | S | A | -0.8778 | |
| 53 | N | A | -1.3627 | |
| 54 | A | A | -0.8183 | |
| 55 | S | A | -0.7166 | |
| 56 | S | A | -0.2972 | |
| 57 | I | A | 0.1238 | |
| 58 | F | A | 0.0000 | |
| 59 | G | A | 0.0000 | |
| 60 | P | A | -0.6154 | |
| 61 | S | A | -0.7206 | |
| 62 | D | A | -0.9966 | |
| 63 | S | A | -1.1722 | |
| 64 | R | A | -1.6765 | |
| 65 | W | A | -1.0339 | |
| 66 | A | A | -0.9739 | |
| 67 | N | A | -1.6216 | |
| 68 | A | A | 0.0000 | |
| 69 | T | A | -0.6949 | |
| 70 | A | A | -0.7940 | |
| 71 | R | A | 0.0000 | |
| 72 | Y | A | -0.8230 | |
| 73 | Q | A | 0.0000 | |
| 74 | Q | A | -0.8156 | |
| 75 | Y | A | -0.2139 | |
| 76 | A | A | -0.3195 | |
| 77 | A | A | -0.6755 | |
| 78 | P | A | 0.0000 | |
| 79 | K | A | -1.9366 | |
| 80 | F | A | -0.6871 | |
| 81 | T | A | -0.6410 | |
| 82 | V | A | 0.0000 | |
| 83 | V | A | 0.0000 | |
| 84 | V | A | 0.0000 | |
| 85 | R | A | -0.3435 | |
| 86 | V | A | 0.0000 | |
| 87 | A | A | -1.0010 | |
| 88 | R | A | -2.1642 | |
| 89 | E | A | -1.3890 | |
| 90 | S | A | -0.8879 | |
| 91 | D | A | 0.0000 | |
| 92 | V | A | 0.0000 | |
| 93 | S | A | 0.0000 | |
| 94 | V | A | 0.4351 | |
| 95 | I | A | 0.0000 | |
| 96 | I | A | 0.0000 | |
| 97 | K | A | -1.2623 | |
| 98 | Y | A | 0.0000 | |
| 99 | A | A | 0.0000 | |
| 100 | N | A | -1.4035 | |
| 101 | R | A | -1.2500 | |
| 102 | N | A | 0.0000 | |
| 103 | S | A | -0.9292 | |
| 104 | L | A | 0.0000 | |
| 105 | P | A | -0.3397 | |
| 106 | F | A | 0.0000 | |
| 107 | Y | A | 0.0398 | |
| 108 | A | A | 0.1472 | |
| 109 | V | A | -0.0668 | |
| 110 | N | A | -0.1926 | |
| 111 | R | A | -0.3411 | |
| 112 | G | A | -0.4001 | |
| 113 | H | A | -0.2845 | |
| 114 | G | A | -0.0945 | |
| 115 | L | A | 0.0000 | |
| 116 | P | A | 0.0000 | |
| 117 | I | A | 0.2747 | |
| 118 | S | A | -0.2231 | |
| 119 | Q | A | 0.0000 | |
| 120 | A | A | -0.9330 | |
| 121 | K | A | -1.8801 | |
| 122 | F | A | 0.0000 | |
| 123 | S | A | -1.3504 | |
| 124 | G | A | 0.0000 | |
| 125 | L | A | 0.0000 | |
| 126 | E | A | 0.0000 | |
| 127 | I | A | 0.0000 | |
| 128 | D | A | 0.0000 | |
| 129 | M | A | 0.0000 | |
| 130 | Q | A | 0.0469 | |
| 131 | L | A | 0.2423 | |
| 132 | L | A | 0.0000 | |
| 133 | T | A | 0.0904 | |
| 134 | G | A | -0.0034 | |
| 135 | I | A | 0.2400 | |
| 136 | T | A | 0.1550 | |
| 137 | I | A | -0.4966 | |
| 138 | Q | A | -1.2031 | |
| 139 | S | A | -1.3080 | |
| 140 | N | A | -2.0639 | |
| 141 | G | A | -1.7952 | |
| 142 | K | A | -2.1624 | |
| 143 | S | A | 0.0000 | |
| 144 | A | A | 0.0000 | |
| 145 | L | A | 0.3240 | |
| 146 | F | A | 0.0000 | |
| 147 | Q | A | -0.3593 | |
| 148 | G | A | 0.0000 | |
| 149 | G | A | 0.0000 | |
| 150 | T | A | 0.0000 | |
| 151 | Y | A | 0.2135 | |
| 152 | D | A | 0.0000 | |
| 153 | Q | A | 0.0000 | |
| 154 | Q | A | -0.3358 | |
| 155 | V | A | 0.0000 | |
| 156 | M | A | 0.0000 | |
| 157 | D | A | -1.8313 | |
| 158 | T | A | -1.4142 | |
| 159 | L | A | 0.0000 | |
| 160 | W | A | -1.8889 | |
| 161 | E | A | -2.9237 | |
| 162 | E | A | -2.8181 | |
| 163 | G | A | -1.8222 | |
| 164 | Y | A | -1.1918 | |
| 165 | V | A | 0.0000 | |
| 166 | T | A | 0.0000 | |
| 167 | T | A | 0.0000 | |
| 168 | T | A | 0.0000 | |
| 169 | G | A | 0.0000 | |
| 170 | S | A | 0.0621 | |
| 171 | C | A | 0.2194 | |
| 172 | G | A | 0.0000 | |
| 173 | C | A | 0.0171 | |
| 174 | V | A | 0.3100 | |
| 175 | G | A | 0.0000 | |
| 176 | M | A | 0.0000 | |
| 177 | L | A | 0.0000 | |
| 178 | G | A | -0.2344 | |
| 179 | P | A | -0.1253 | |
| 180 | A | A | 0.0000 | |
| 181 | L | A | 0.0000 | |
| 182 | G | A | 0.0000 | |
| 183 | G | A | 0.0000 | |
| 184 | G | A | 0.0000 | |
| 185 | H | A | 0.0000 | |
| 186 | G | A | 0.0000 | |
| 187 | R | A | 0.0000 | |
| 188 | Q | A | 0.0000 | |
| 189 | Q | A | 0.0000 | |
| 190 | G | A | 0.0000 | |
| 191 | F | A | 0.1833 | |
| 192 | H | A | -0.2730 | |
| 193 | G | A | 0.0000 | |
| 194 | L | A | 0.0000 | |
| 195 | I | A | 0.0000 | |
| 196 | S | A | 0.0000 | |
| 197 | D | A | -0.3101 | |
| 198 | N | A | 0.0000 | |
| 199 | I | A | 0.0000 | |
| 200 | L | A | 0.4372 | |
| 201 | K | A | -0.4150 | |
| 202 | L | A | 0.0000 | |
| 203 | N | A | -0.6377 | |
| 204 | V | A | 0.0000 | |
| 205 | V | A | 0.0000 | |
| 206 | L | A | -0.5780 | |
| 207 | A | A | 0.0000 | |
| 208 | D | A | -2.3888 | |
| 209 | G | A | 0.0000 | |
| 210 | T | A | -0.6121 | |
| 211 | T | A | -0.4008 | |
| 212 | A | A | -0.2678 | |
| 213 | T | A | -0.5027 | |
| 214 | V | A | 0.0000 | |
| 215 | S | A | -0.9382 | |
| 216 | N | A | -1.4431 | |
| 217 | T | A | -0.9056 | |
| 218 | S | A | -0.9677 | |
| 219 | H | A | -1.1029 | |
| 220 | T | A | -1.0513 | |
| 221 | D | A | -0.9220 | |
| 222 | L | A | 0.0000 | |
| 223 | F | A | 0.0000 | |
| 224 | W | A | 0.0000 | |
| 225 | A | A | 0.0000 | |
| 226 | M | A | 0.0000 | |
| 227 | K | A | -0.3161 | |
| 228 | G | A | 0.0000 | |
| 229 | A | A | 0.0000 | |
| 230 | G | A | 0.0000 | |
| 231 | H | A | -0.1075 | |
| 232 | N | A | 0.0000 | |
| 233 | F | A | 0.0000 | |
| 234 | G | A | 0.0000 | |
| 235 | V | A | 0.0000 | |
| 236 | V | A | 0.0000 | |
| 237 | T | A | 0.0000 | |
| 238 | S | A | 0.0000 | |
| 239 | F | A | 0.0000 | |
| 240 | E | A | 0.0000 | |
| 241 | M | A | 0.0000 | |
| 242 | S | A | -0.3458 | |
| 243 | I | A | 0.0000 | |
| 244 | Y | A | -0.3228 | |
| 245 | P | A | -0.8428 | |
| 246 | T | A | -1.1612 | |
| 247 | Q | A | -1.3679 | |
| 248 | V | A | -1.0098 | |
| 249 | H | A | -1.3940 | |
| 250 | S | A | -1.1021 | |
| 251 | W | A | 0.0000 | |
| 252 | Y | A | 0.0000 | |
| 253 | Y | A | -0.7810 | |
| 254 | K | A | 0.0000 | |
| 255 | N | A | 0.0000 | |
| 256 | Y | A | 0.0000 | |
| 257 | V | A | 0.5128 | |
| 258 | F | A | 0.0000 | |
| 259 | T | A | -0.6722 | |
| 260 | Q | A | -1.7919 | |
| 261 | D | A | -2.4395 | |
| 262 | K | A | -1.9965 | |
| 263 | L | A | 0.0000 | |
| 264 | E | A | -2.6840 | |
| 265 | D | A | -3.1757 | |
| 266 | L | A | 0.0000 | |
| 267 | F | A | 0.0000 | |
| 268 | E | A | -2.4154 | |
| 269 | Q | A | -1.0792 | |
| 270 | L | A | 0.0000 | |
| 271 | N | A | -0.4812 | |
| 272 | V | A | 0.9694 | |
| 273 | L | A | 0.0000 | |
| 274 | Q | A | 0.0000 | |
| 275 | G | A | -0.1673 | |
| 276 | N | A | -1.2377 | |
| 277 | G | A | 0.0000 | |
| 278 | T | A | -0.3068 | |
| 279 | Q | A | 0.0000 | |
| 280 | P | A | -0.0066 | |
| 281 | V | A | 0.1558 | |
| 282 | K | A | -0.3910 | |
| 283 | M | A | 0.0000 | |
| 284 | A | A | 0.0000 | |
| 285 | A | A | 0.0000 | |
| 286 | Q | A | 0.0000 | |
| 287 | Y | A | 0.0000 | |
| 288 | G | A | 0.0000 | |
| 289 | I | A | 0.5939 | |
| 290 | Y | A | 0.0000 | |
| 291 | M | A | 0.2464 | |
| 292 | M | A | -0.0377 | |
| 293 | D | A | -0.3599 | |
| 294 | S | A | -0.2974 | |
| 295 | T | A | 0.0251 | |
| 296 | V | A | 0.4974 | |
| 297 | S | A | -0.1515 | |
| 298 | A | A | -0.4231 | |
| 299 | T | A | -1.0239 | |
| 300 | E | A | -1.5083 | |
| 301 | A | A | 0.0000 | |
| 302 | I | A | 0.0000 | |
| 303 | I | A | 0.0000 | |
| 304 | W | A | 0.3504 | |
| 305 | W | A | 0.0000 | |
| 306 | T | A | 0.0000 | |
| 307 | F | A | 0.0000 | |
| 308 | G | A | 0.0000 | |
| 309 | Y | A | 0.0000 | |
| 310 | A | A | 0.0000 | |
| 311 | G | A | -1.0194 | |
| 312 | S | A | -1.2274 | |
| 313 | Q | A | -1.7746 | |
| 314 | S | A | -1.2270 | |
| 315 | E | A | -1.4938 | |
| 316 | A | A | 0.0000 | |
| 317 | Q | A | -1.3035 | |
| 318 | Q | A | -1.4528 | |
| 319 | Y | A | -0.3017 | |
| 320 | L | A | 0.0000 | |
| 321 | T | A | -1.0554 | |
| 322 | P | A | -1.1814 | |
| 323 | F | A | 0.0000 | |
| 324 | D | A | -1.8854 | |
| 325 | D | A | -2.4681 | |
| 326 | L | A | -1.9829 | |
| 327 | N | A | -1.7770 | |
| 328 | P | A | -0.5278 | |
| 329 | L | A | 0.8750 | |
| 330 | S | A | 0.1240 | |
| 331 | S | A | -0.5581 | |
| 332 | T | A | -0.8803 | |
| 333 | D | A | -1.9652 | |
| 334 | G | A | -1.5335 | |
| 335 | N | A | -1.8783 | |
| 336 | V | A | -1.0504 | |
| 337 | P | A | -0.9033 | |
| 338 | F | A | 0.0000 | |
| 339 | P | A | 0.0000 | |
| 340 | E | A | -1.2715 | |
| 341 | V | A | 0.0000 | |
| 342 | P | A | 0.0000 | |
| 343 | N | A | -0.9366 | |
| 344 | V | A | -0.5738 | |
| 345 | Q | A | 0.0000 | |
| 346 | G | A | -0.4869 | |
| 347 | T | A | -0.3873 | |
| 348 | G | A | 0.0000 | |
| 349 | I | A | -0.2397 | |
| 350 | N | A | -1.5031 | |
| 351 | N | A | -1.2687 | |
| 352 | A | A | -1.0773 | |
| 353 | T | A | -0.8213 | |
| 354 | C | A | -1.1072 | |
| 355 | D | A | -2.2496 | |
| 356 | K | A | -1.8717 | |
| 357 | G | A | -1.1864 | |
| 358 | L | A | -0.7932 | |
| 359 | E | A | -0.6603 | |
| 360 | R | A | 0.0000 | |
| 361 | I | A | 0.0000 | |
| 362 | V | A | 0.0000 | |
| 363 | G | A | 0.0000 | |
| 364 | P | A | 0.0000 | |
| 365 | A | A | 0.0000 | |
| 366 | G | A | -0.5862 | |
| 367 | L | A | 0.0000 | |
| 368 | Q | A | -0.7963 | |
| 369 | V | A | -0.1023 | |
| 370 | Y | A | 0.0000 | |
| 371 | N | A | -1.1112 | |
| 372 | A | A | -1.3559 | |
| 373 | T | A | -0.9062 | |
| 374 | A | A | 0.0000 | |
| 375 | Q | A | 0.0000 | |
| 376 | R | A | -1.6028 | |
| 377 | Q | A | -1.9102 | |
| 378 | I | A | 0.0000 | |
| 379 | Y | A | 0.0000 | |
| 380 | D | A | -2.7329 | |
| 381 | L | A | -1.9016 | |
| 382 | F | A | 0.0000 | |
| 383 | N | A | 0.0000 | |
| 384 | R | A | -2.6351 | |
| 385 | N | A | 0.0000 | |
| 386 | V | A | 0.0000 | |
| 387 | K | A | -2.5400 | |
| 388 | S | A | -1.4359 | |
| 389 | Y | A | -1.0085 | |
| 390 | P | A | -1.5828 | |
| 391 | E | A | -2.0889 | |
| 392 | L | A | 0.0000 | |
| 393 | A | A | -0.7446 | |
| 394 | A | A | -0.2645 | |
| 395 | S | A | 0.0000 | |
| 396 | A | A | 0.2960 | |
| 397 | V | A | 0.0000 | |
| 398 | V | A | 0.4423 | |
| 399 | M | A | 0.0000 | |
| 400 | E | A | 0.0000 | |
| 401 | G | A | 0.0000 | |
| 402 | Y | A | 0.0000 | |
| 403 | S | A | 0.0000 | |
| 404 | V | A | 0.0000 | |
| 405 | E | A | -0.9314 | |
| 406 | A | A | -0.9240 | |
| 407 | V | A | 0.0000 | |
| 408 | R | A | -2.4039 | |
| 409 | K | A | -2.4475 | |
| 410 | V | A | -1.8429 | |
| 411 | D | A | -2.6656 | |
| 412 | S | A | -2.1243 | |
| 413 | D | A | -2.0328 | |
| 414 | S | A | -1.3885 | |
| 415 | S | A | 0.0000 | |
| 416 | A | A | 0.0000 | |
| 417 | Y | A | 0.0000 | |
| 418 | P | A | -0.9511 | |
| 419 | M | A | 0.0000 | |
| 420 | R | A | 0.0000 | |
| 421 | D | A | -2.1607 | |
| 422 | D | A | 0.0000 | |
| 423 | Y | A | -0.7465 | |
| 424 | L | A | 0.0000 | |
| 425 | L | A | 0.0000 | |
| 426 | M | A | 0.0000 | |
| 427 | Q | A | 0.0000 | |
| 428 | T | A | 0.0000 | |
| 429 | T | A | 0.0000 | |
| 430 | V | A | 0.0000 | |
| 431 | S | A | 0.0000 | |
| 432 | Y | A | 0.0000 | |
| 433 | S | A | -0.9128 | |
| 434 | P | A | -0.8473 | |
| 435 | N | A | -1.0911 | |
| 436 | S | A | -0.8600 | |
| 437 | T | A | -0.6700 | |
| 438 | L | A | 0.0000 | |
| 439 | D | A | -1.1170 | |
| 440 | N | A | -1.6201 | |
| 441 | V | A | -0.8495 | |
| 442 | A | A | 0.0000 | |
| 443 | I | A | -1.0478 | |
| 444 | D | A | -2.1501 | |
| 445 | W | A | 0.0000 | |
| 446 | V | A | 0.0000 | |
| 447 | T | A | -1.5508 | |
| 448 | E | A | -2.1367 | |
| 449 | N | A | 0.0000 | |
| 450 | Q | A | -1.7722 | |
| 451 | K | A | -2.5885 | |
| 452 | F | A | -1.9756 | |
| 453 | W | A | 0.0000 | |
| 454 | N | A | -2.4829 | |
| 455 | E | A | -2.8713 | |
| 456 | G | A | -1.5374 | |
| 457 | Q | A | -1.4296 | |
| 458 | P | A | -1.5621 | |
| 459 | T | A | -1.1421 | |
| 460 | R | A | -1.7971 | |
| 461 | K | A | -2.3518 | |
| 462 | P | A | -1.7891 | |
| 463 | T | A | -0.7274 | |
| 464 | A | A | 0.0000 | |
| 465 | Y | A | 0.0000 | |
| 466 | V | A | 0.0000 | |
| 467 | N | A | -0.0928 | |
| 468 | Y | A | 0.1287 | |
| 469 | A | A | 0.0000 | |
| 470 | S | A | 0.0000 | |
| 471 | G | A | -0.3786 | |
| 472 | R | A | -0.7392 | |
| 473 | E | A | -0.7645 | |
| 474 | S | A | -0.4992 | |
| 475 | L | A | 0.0317 | |
| 476 | E | A | -0.9575 | |
| 477 | A | A | 0.0000 | |
| 478 | M | A | 0.0000 | |
| 479 | Y | A | 0.0000 | |
| 480 | G | A | 0.0000 | |
| 481 | Y | A | -0.4572 | |
| 482 | E | A | -0.9418 | |
| 483 | P | A | -1.0303 | |
| 484 | W | A | -1.0757 | |
| 485 | R | A | 0.0000 | |
| 486 | L | A | 0.0000 | |
| 487 | E | A | -3.0471 | |
| 488 | R | A | -2.5606 | |
| 489 | L | A | 0.0000 | |
| 490 | R | A | -2.6246 | |
| 491 | K | A | -3.4298 | |
| 492 | L | A | 0.0000 | |
| 493 | K | A | 0.0000 | |
| 494 | A | A | -1.8537 | |
| 495 | K | A | -2.5346 | |
| 496 | Y | A | 0.0000 | |
| 497 | D | A | 0.0000 | |
| 498 | P | A | -2.1704 | |
| 499 | E | A | -2.5009 | |
| 500 | G | A | -0.9268 | |
| 501 | R | A | -1.2466 | |
| 502 | F | A | -0.2909 | |
| 503 | S | A | -0.1123 | |
| 504 | Y | A | -0.0493 | |
| 505 | Y | A | 0.2804 | |
| 506 | N | A | 0.0000 | |
| 507 | P | A | 0.4883 | |
| 508 | I | A | 0.0000 | |
| 509 | V | A | 1.5095 |